data_2nb1_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 2nb1 _Structure_validation_residue.Date_analyzed 2016-12-02 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 ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 . . . . . 0 C--O 1.233 0.211 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.5 tp -74.02 94.32 2.36 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.3 mt -93.03 167.45 11.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -134.0 159.58 40.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.44 90.29 49.04 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -71.28 108.27 2.32 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 125.249 3.966 . . . . 0.0 108.645 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.0 t -138.5 148.64 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 124.338 1.055 . . . . 0.0 110.516 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.2 102.06 4.88 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 175.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.46 124.49 1.25 Allowed Glycine 0 CA--C 1.522 0.472 0 N-CA-C 104.955 -3.258 . . . . 0.0 104.955 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -52.19 26.84 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 120.34 2.07 . . . . 0.0 111.476 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.84 -42.17 95.14 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -56.9 -47.79 79.7 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.24 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.93 -53.99 51.74 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.835 0.743 . . . . 0.0 111.211 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -55.33 -47.59 75.45 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -69.68 -44.16 71.02 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 118.237 0.472 . . . . 0.0 112.267 -179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.88 -44.11 94.04 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.22 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -50.36 63.27 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.947 0.794 . . . . 0.0 109.757 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.59 -50.1 73.95 Favored 'General case' 0 C--O 1.225 -0.202 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.83 -32.25 57.35 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 CA-C-N 119.672 1.124 . . . . 0.0 110.155 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HE2' HG13 ' C' 1010 ' ' VAL . 19.3 tptp -66.59 -46.55 75.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.69 -54.24 34.73 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.786 1.234 . . . . 0.0 110.924 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 m -53.61 -44.72 69.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 119.941 1.246 . . . . 0.0 112.086 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.53 -50.95 48.18 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.616 0.644 . . . . 0.0 110.017 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -54.42 -47.88 72.27 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.386 1.074 . . . . 0.0 110.817 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -64.62 -43.77 92.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.907 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 54.2 ttp -55.61 -48.19 75.3 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.115 0.87 . . . . 0.0 109.676 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -76.54 -14.39 60.02 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -86.33 -54.26 4.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 119.631 1.105 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 CA--C 1.534 0.35 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.991 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.3 t60 . . . . . 0 CA--C 1.535 0.384 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.0 m -59.79 -47.52 85.35 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 123.417 0.687 . . . . 0.0 111.006 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 8.3 mt -60.3 -44.55 95.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 126.395 1.878 . . . . 0.0 111.933 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.07 -58.72 7.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.5 m -55.83 -41.01 73.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.622 0.769 . . . . 0.0 111.162 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -65.34 -53.93 36.43 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.986 0.914 . . . . 0.0 110.993 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -61.73 -41.58 97.82 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.582 -0.699 . . . . 0.0 110.502 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.94 -54.24 33.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.014 0.926 . . . . 0.0 109.415 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -58.5 -44.39 89.42 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 119.649 1.113 . . . . 0.0 110.707 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -58.03 -36.39 72.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.441 1.019 . . . . 0.0 109.662 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.27 -53.73 33.35 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 CA--C 1.535 0.395 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.815 -179.693 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 56.4 m . . . . . 0 N--CA 1.451 -0.412 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -101.62 138.52 38.5 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -117.22 145.63 43.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.428 1.491 . . . . 0.0 109.577 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.3 mt -136.06 128.83 30.97 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 125.027 1.331 . . . . 0.0 107.469 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -129.46 100.52 5.58 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.22 149.87 11.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 124.065 0.946 . . . . 0.0 108.797 -179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -114.11 102.36 10.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.4 0.68 . . . . 0.0 110.739 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.57 113.76 0.75 Allowed Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 116.396 -2.335 . . . . 0.0 108.72 177.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -60.59 -56.42 21.55 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.669 2.735 . . . . 0.0 110.501 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -63.06 -52.03 64.36 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -51.96 -49.62 62.85 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.825 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -63.24 -44.84 94.09 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 120.623 1.556 . . . . 0.0 111.596 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -57.06 -50.69 71.98 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.346 0.976 . . . . 0.0 110.4 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 81.2 mt -62.01 -58.27 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 127.058 2.143 . . . . 0.0 110.609 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.61 -36.79 77.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 116.647 -1.644 . . . . 0.0 110.043 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 64.0 mtp -63.08 -52.88 60.97 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 121.423 1.919 . . . . 0.0 110.316 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.45 -43.21 97.1 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.513 0.597 . . . . 0.0 111.827 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 74.6 mt -69.66 -34.49 74.07 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.67 0.668 . . . . 0.0 110.815 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . 0.458 ' HZ1' ' ND2' ' D' 1108 ' ' ASN . 0.2 OUTLIER -66.24 -54.16 28.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.684 0.794 . . . . 0.0 109.78 180.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -60.93 -41.94 97.21 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.011 1.325 . . . . 0.0 108.818 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.6 t -52.78 -52.97 54.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.827 0.851 . . . . 0.0 110.992 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' D' 1108 ' ' ASN . 3.8 mm? -68.2 -38.64 82.17 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.92 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -46.09 88.37 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.577 1.081 . . . . 0.0 109.071 178.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -67.45 -45.07 77.08 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 117.151 -1.404 . . . . 0.0 108.01 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 6.3 tpt -53.89 -33.35 56.27 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 120.101 1.319 . . . . 0.0 110.383 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.47 -31.92 48.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.847 0.859 . . . . 0.0 111.107 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 51.1 tp -87.88 -33.43 18.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 4.1 m -93.46 148.08 34.85 Favored Pre-proline 0 C--O 1.235 0.313 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.59 175.41 9.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 120.981 1.121 . . . . 0.0 110.071 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.36 33.47 0.05 OUTLIER Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 117.538 2.422 . . . . 0.0 117.538 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.26 -57.23 0.79 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 123.07 2.132 . . . . 0.0 112.551 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -28.89 69.9 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.974 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 9.9 t -63.25 -56.54 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.109 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.218 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.46 -35.68 77.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.157 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 9.6 t -61.71 -50.26 73.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 109.247 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.79 -40.41 72.58 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.896 -0.502 . . . . 0.0 109.759 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -52.89 -48.22 67.34 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.145 1.378 . . . . 0.0 111.448 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -77.7 -46.18 22.62 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 123.362 0.665 . . . . 0.0 112.09 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -55.59 -39.03 70.19 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.8 tm0? -80.55 -29.61 37.12 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 125.306 1.443 . . . . 0.0 109.048 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.28 -30.06 64.38 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.546 1.521 . . . . 0.0 108.035 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 14.3 mt -59.38 -13.66 9.2 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 118.917 0.78 . . . . 0.0 112.797 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.546 0.812 0 C-N-CA 126.218 1.807 . . . . 0.0 108.94 177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 . . . . . 0 N--CA 1.464 0.243 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 61.5 tp -77.17 95.29 4.24 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 16.7 mt -96.48 127.41 42.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.723 2.009 . . . . 0.0 108.874 -178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -106.2 122.61 46.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.591 0.756 . . . . 0.0 109.465 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.3 mt -95.72 100.24 5.99 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 117.552 -1.213 . . . . 0.0 108.842 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -75.33 121.94 6.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.809 2.34 . . . . 0.0 110.252 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1010 ' ' VAL . . . . . 0.432 HG13 ' HE2' ' A' ' 23' ' ' LYS . 4.8 t -145.63 152.37 14.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 O-C-N 120.951 -1.093 . . . . 0.0 110.716 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.18 102.02 4.87 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.22 130.49 2.13 Favored Glycine 0 CA--C 1.52 0.365 0 CA-C-O 116.311 -2.383 . . . . 0.0 107.646 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -52.53 22.77 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.655 2.727 . . . . 0.0 111.911 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -72.54 -31.14 65.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.54 -41.55 98.45 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.822 0.849 . . . . 0.0 110.203 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 11.1 t80 -69.61 -52.04 29.57 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.057 0.844 . . . . 0.0 108.947 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -54.3 -57.42 11.29 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.81 -45.87 91.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.03 0.532 . . . . 0.0 111.999 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.5 mm? -67.29 -38.2 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.962 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.24 -49.03 47.52 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 119.988 1.267 . . . . 0.0 111.079 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.21 -46.97 75.93 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.407 1.003 . . . . 0.0 110.959 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 84.5 mt -68.69 -45.39 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.2 tptp -58.02 -45.84 86.25 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 124.537 1.135 . . . . 0.0 110.615 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -67.36 -50.98 57.55 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.434 1.094 . . . . 0.0 108.894 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 30.2 m -53.96 -42.6 69.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.368 0.985 . . . . 0.0 111.134 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -68.89 -52.13 32.82 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.452 1.101 . . . . 0.0 109.894 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -58.55 -43.55 89.36 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 122.956 0.502 . . . . 0.0 110.886 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.09 -40.02 86.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.762 -1.113 . . . . 0.0 109.516 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 49.0 ttp -63.13 -35.73 81.26 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.005 0.821 . . . . 0.0 110.163 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -87.6 -12.87 44.37 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.28 0.945 . . . . 0.0 112.496 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 7.2 t80 -98.58 -57.85 2.1 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.859 1.264 . . . . 0.0 113.029 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.391 0 C-N-CA 123.727 0.811 . . . . 0.0 111.933 -178.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.0 t60 . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 44.4 m -59.14 -43.51 92.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.044 -0.979 . . . . 0.0 108.463 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 42.4 mt -61.54 -45.41 98.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 119.791 1.178 . . . . 0.0 109.334 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -56.26 -55.37 34.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.806 0.842 . . . . 0.0 110.266 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 41.2 m -65.24 -34.85 79.35 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.819 -0.55 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.68 -52.61 56.32 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.473 1.109 . . . . 0.0 109.929 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -55.65 -47.33 76.83 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -59.32 -57.15 14.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.915 0.886 . . . . 0.0 109.966 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -50.2 -50.47 49.39 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.722 0.809 . . . . 0.0 111.349 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -63.13 -40.7 98.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.612 0.642 . . . . 0.0 110.97 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -62.89 -43.95 97.42 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.545 0.738 . . . . 0.0 109.455 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 . . . . . 0 N--CA 1.448 -0.548 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.135 178.942 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.5 m . . . . . 0 CA--C 1.534 0.363 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -101.82 134.38 45.09 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -120.84 123.3 42.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 125.837 1.655 . . . . 0.0 109.209 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.65 147.83 49.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.174 0.99 . . . . 0.0 108.884 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 7.4 pm0 -136.06 110.87 8.73 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.098 2.159 . . . . 0.0 109.428 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -155.2 151.21 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.471 1.509 . . . . 0.0 110.639 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.67 102.44 7.6 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.732 1.151 . . . . 0.0 110.535 177.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.56 122.87 2.04 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 105.197 -3.161 . . . . 0.0 105.197 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.57 -58.19 5.7 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 120.989 2.395 . . . . 0.0 114.3 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -63.06 -41.02 99.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.596 0.635 . . . . 0.0 109.327 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1108 ' ' ASN . . . . . 0.459 HD22 ' HB3' ' B' ' 119' ' ' LEU . 4.9 m-80 -53.02 -48.58 67.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.288 179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.6 t80 -63.76 -48.38 77.2 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 119.514 1.052 . . . . 0.0 111.727 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.0 -47.29 68.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.197 0.908 . . . . 0.0 111.313 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.4 mt -68.57 -57.56 8.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 126.104 1.762 . . . . 0.0 110.79 -179.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 5.1 mp -56.68 -39.0 73.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 118.925 0.784 . . . . 0.0 110.797 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 42.1 mtp -63.55 -52.67 60.08 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.362 0.983 . . . . 0.0 110.237 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.08 -33.33 75.25 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.428 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 31.6 mt -70.32 -38.37 74.91 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 120.215 1.37 . . . . 0.0 109.951 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 21.8 tptt -62.67 -52.49 63.08 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -57.01 -42.37 80.22 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.412 1.485 . . . . 0.0 109.693 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 44.8 t -52.64 -54.63 30.71 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.529 1.132 . . . . 0.0 110.255 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.09 -43.39 74.61 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.411 -0.805 . . . . 0.0 110.977 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -55.36 -48.15 74.69 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.172 0.896 . . . . 0.0 111.7 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.35 -48.76 39.4 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 116.208 -1.853 . . . . 0.0 109.058 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.5 tpt -54.51 -33.06 59.2 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.846 1.657 . . . . 0.0 109.436 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -74.87 -32.96 62.01 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 117.897 -1.049 . . . . 0.0 110.572 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 43.7 tp -87.03 -32.55 19.95 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.179 1.354 . . . . 0.0 113.624 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 9.7 m -92.41 148.45 36.44 Favored Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 120.752 -1.218 . . . . 0.0 108.322 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -68.84 177.34 5.03 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 N-CA-C 109.426 -1.028 . . . . 0.0 109.426 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1127 ' ' GLN . . . . . 0.4 ' H ' ' CD ' ' D' 1127 ' ' GLN . 3.2 pm0 -113.4 47.71 0.38 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 116.361 1.986 . . . . 0.0 116.361 -177.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.41 -51.18 0.77 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.744 2.296 . . . . 0.0 113.014 -178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -29.6 69.43 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.136 -0.978 . . . . 0.0 110.625 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.6 t -61.17 -54.48 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 124.034 0.934 . . . . 0.0 108.669 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.63 -45.73 92.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.02 0.827 . . . . 0.0 111.428 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.8 t -59.07 -50.46 74.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.095 0.958 . . . . 0.0 110.484 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.1 t80 -68.39 -42.16 79.48 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.035 1.334 . . . . 0.0 110.853 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.49 -49.15 68.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 119.107 0.867 . . . . 0.0 111.023 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -74.43 -39.93 62.29 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.1 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -62.79 -29.9 71.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.822 0.449 . . . . 0.0 111.42 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -80.19 -39.06 29.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -56.75 -32.67 65.8 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.814 -0.554 . . . . 0.0 109.518 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 15.1 mt -64.26 -12.19 38.83 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.605 1.162 . . . . 0.0 113.097 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 CA--C 1.537 0.468 0 C-N-CA 124.618 1.167 . . . . 0.0 109.122 178.284 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.3 95.4 0.43 Allowed 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -104.14 129.16 51.85 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.292 1.037 . . . . 0.0 110.243 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -103.38 118.6 37.12 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -101.93 96.02 6.23 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 125.806 1.642 . . . . 0.0 111.118 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -75.38 113.95 3.88 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 125.12 3.88 . . . . 0.0 111.466 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.9 t -145.11 154.91 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.278 -0.889 . . . . 0.0 109.487 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -135.34 101.88 4.97 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 125.046 1.339 . . . . 0.0 107.817 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.94 121.36 0.97 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 107.64 -2.184 . . . . 0.0 107.64 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.92 -51.57 31.81 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 120.232 2.016 . . . . 0.0 108.45 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.98 -32.82 73.5 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -61.52 -53.37 57.27 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.135 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -67.65 -39.16 84.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.02 -57.23 12.56 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.332 0.515 . . . . 0.0 110.397 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -71.48 -33.38 69.24 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 119.322 -0.37 . . . . 0.0 111.494 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 tp -61.22 -53.34 58.11 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.172 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.88 -34.95 77.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.225 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.25 -49.22 72.6 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.602 1.092 . . . . 0.0 110.607 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.0 mt -83.25 -35.05 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 123.612 0.765 . . . . 0.0 112.169 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.52 -46.63 87.54 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 120.186 -1.571 . . . . 0.0 109.359 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -67.83 -48.9 64.9 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 117.346 -1.311 . . . . 0.0 109.812 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.3 p -53.03 -41.26 64.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 120.04 1.291 . . . . 0.0 112.158 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -74.19 -49.67 22.53 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.898 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -54.46 -47.61 72.71 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.031 0.832 . . . . 0.0 109.913 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 55.8 mt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.709 1.604 . . . . 0.0 110.857 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.9 ttt -56.75 -47.1 80.84 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.586 1.154 . . . . 0.0 109.079 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -64.84 -40.28 94.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.866 1.267 . . . . 0.0 111.532 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.8 -30.33 65.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.696 1.199 . . . . 0.0 112.307 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.3 tp . . . . . 0 C--O 1.238 0.449 0 C-N-CA 123.657 0.783 . . . . 0.0 109.918 -179.362 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.0 m80 . . . . . 0 CA--C 1.538 0.498 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.6 m -57.15 -48.53 78.46 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.252 1.387 . . . . 0.0 107.798 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.4 mt -65.35 -44.48 94.69 Favored 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 124.38 1.072 . . . . 0.0 108.616 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.04 -39.27 77.97 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.449 0.568 . . . . 0.0 111.98 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.4 m -66.6 -52.48 44.81 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -55.76 -51.38 67.59 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 123.408 0.683 . . . . 0.0 111.042 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -53.21 -48.44 68.13 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.737 0.415 . . . . 0.0 111.3 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -64.02 -50.81 67.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.539 0.735 . . . . 0.0 111.924 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -61.53 -40.49 94.84 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.019 0.928 . . . . 0.0 111.846 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -45.37 67.95 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -58.02 -29.15 65.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.412 1.005 . . . . 0.0 111.709 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.763 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 59.2 m . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 120.517 0.198 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -123.37 142.24 51.17 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 124.488 1.115 . . . . 0.0 108.567 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -127.2 147.45 50.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.06 0.944 . . . . 0.0 109.777 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.16 144.87 51.15 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.357 1.863 . . . . 0.0 107.371 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.08 98.92 4.12 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.223 1.009 . . . . 0.0 112.321 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -151.72 150.35 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.174 -1.579 . . . . 0.0 112.108 -178.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.2 100.85 6.9 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 121.924 0.869 . . . . 0.0 108.883 177.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.64 116.54 1.04 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 103.753 -3.739 . . . . 0.0 103.753 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.7 -56.78 14.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 120.473 2.137 . . . . 0.0 111.002 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -61.11 -48.96 79.25 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 -54.86 -45.5 74.57 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.428 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -61.83 -55.05 33.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.356 -1.307 . . . . 0.0 111.216 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -48.45 -54.32 14.6 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.291 1.036 . . . . 0.0 111.049 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.3 mt -60.62 -57.73 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 126.13 1.772 . . . . 0.0 110.028 -179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.44 -25.77 67.44 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.195 -0.94 . . . . 0.0 112.136 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 5.5 ttt -68.91 -52.42 29.63 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.657 1.117 . . . . 0.0 108.218 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -65.58 -37.67 87.31 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 118.894 -1.123 . . . . 0.0 110.344 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.0 mt -63.89 -38.89 92.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.756 -0.59 . . . . 0.0 111.241 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . 0.467 ' HZ2' ' HB2' ' B' ' 116' ' ' LYS . 0.1 OUTLIER -66.15 -54.21 28.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 O-C-N 121.344 -0.848 . . . . 0.0 110.025 -179.661 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -54.66 -42.83 71.79 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 125.377 1.673 . . . . 0.0 108.337 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 40.8 t -58.04 -48.65 79.45 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.242 1.017 . . . . 0.0 110.899 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.26 -43.43 86.48 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.65 0.659 . . . . 0.0 111.26 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.07 -45.63 91.24 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.198 0.908 . . . . 0.0 109.598 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -48.05 75.02 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.635 -0.666 . . . . 0.0 109.818 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -24.0 67.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.129 0.972 . . . . 0.0 111.098 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -89.31 -20.65 23.8 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.747 1.158 . . . . 0.0 110.521 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.08 -33.18 11.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 120.034 1.288 . . . . 0.0 112.149 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.1 t -95.49 148.08 34.04 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.729 1.612 . . . . 0.0 108.487 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.25 -178.1 3.98 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 123.481 2.788 . . . . 0.0 111.635 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -129.0 62.84 64.43 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 116.752 2.13 . . . . 0.0 116.752 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.19 -54.83 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.517 2.811 . . . . 0.0 113.728 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 tt -56.33 -34.09 66.24 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.627 0.771 . . . . 0.0 109.767 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 14.8 t -61.25 -47.57 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 126.101 1.76 . . . . 0.0 109.3 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -63.49 -36.29 83.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.646 1.112 . . . . 0.0 109.74 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 2.8 t -70.62 -39.05 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.881 0.472 . . . . 0.0 110.166 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -70.1 -50.76 37.57 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.315 1.446 . . . . 0.0 109.371 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.17 -48.12 68.25 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.447 1.499 . . . . 0.0 110.445 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 -68.34 -48.05 65.87 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.732 1.151 . . . . 0.0 110.648 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -56.0 -40.47 73.41 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.004 -0.435 . . . . 0.0 110.924 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -80.74 -27.71 36.74 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.541 1.137 . . . . 0.0 111.264 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -63.68 -33.3 75.32 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.654 1.57 . . . . 0.0 108.483 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.7 mt -63.96 -15.68 59.78 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.043 0.937 . . . . 0.0 111.756 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 CA--C 1.539 0.546 0 C-N-CA 125.094 1.357 . . . . 0.0 109.433 178.558 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 36.3 tt0 . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 21.9 tp -73.78 95.15 2.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.82 176.36 5.32 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.306 2.242 . . . . 0.0 109.276 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -138.42 144.83 40.36 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.633 1.573 . . . . 0.0 107.224 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.9 tp -126.11 105.78 25.32 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.418 1.487 . . . . 0.0 110.494 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -82.66 115.43 2.47 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 123.868 3.045 . . . . 0.0 111.43 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 96.4 t -139.93 150.86 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 120.299 -1.501 . . . . 0.0 108.056 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.39 104.77 5.71 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.205 0.602 . . . . 0.0 110.775 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -165.96 125.42 1.34 Allowed Glycine 0 CA--C 1.519 0.319 0 N-CA-C 105.881 -2.888 . . . . 0.0 105.881 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -68.52 -51.78 39.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 121.779 2.79 . . . . 0.0 109.881 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.0 -41.71 97.4 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.561 0.696 . . . . 0.0 109.138 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -61.93 -46.82 87.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 124.344 1.057 . . . . 0.0 111.647 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 17.1 t80 -66.77 -41.91 86.93 Favored 'General case' 0 C--O 1.23 0.065 0 CA-C-N 120.157 1.344 . . . . 0.0 111.863 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -55.54 -56.99 13.86 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.563 0.745 . . . . 0.0 110.716 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 tmm? -70.47 -40.26 73.77 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 118.507 -0.758 . . . . 0.0 112.594 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 8.5 tp -58.11 -40.95 82.49 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.242 0.928 . . . . 0.0 108.904 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 6.6 mt -66.87 -47.14 72.8 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.919 -1.039 . . . . 0.0 109.142 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -55.52 -49.14 73.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.382 0.992 . . . . 0.0 111.976 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.76 -36.89 66.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 O-C-N 121.866 -0.521 . . . . 0.0 111.183 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -66.59 -57.9 6.29 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.108 -0.995 . . . . 0.0 109.122 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -54.96 -55.23 33.08 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.327 1.451 . . . . 0.0 109.731 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 33.1 p -53.37 -49.9 66.2 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.958 1.254 . . . . 0.0 112.49 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.28 -52.07 63.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 118.197 0.453 . . . . 0.0 110.767 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.84 -40.67 80.66 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.452 0.701 . . . . 0.0 112.089 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 31.5 mt -71.36 -44.5 64.91 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.036 -1.04 . . . . 0.0 110.012 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -43.25 85.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -66.61 -44.45 82.06 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.404 1.882 . . . . 0.0 110.951 179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 t80 -68.64 -44.46 74.12 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 12.6 tp . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 124.621 1.168 . . . . 0.0 110.869 -178.287 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 13.3 m80 . . . . . 0 CA--C 1.534 0.363 0 CA-C-O 119.775 -0.155 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -51.55 66.81 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.75 1.22 . . . . 0.0 108.801 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 48.3 mt -65.39 -45.31 93.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 125.743 1.617 . . . . 0.0 108.676 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.48 -45.3 69.57 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 124.911 1.284 . . . . 0.0 111.314 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.7 m -65.68 -52.9 47.88 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.752 1.221 . . . . 0.0 109.784 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -55.78 -48.97 74.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.027 0.931 . . . . 0.0 111.208 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -55.22 -48.53 73.76 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.3 0.64 . . . . 0.0 110.468 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -33.72 75.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.97 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.76 -48.74 77.86 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.522 0.729 . . . . 0.0 109.089 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -60.25 -46.58 89.3 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.896 0.479 . . . . 0.0 109.718 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -58.64 -33.49 70.12 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.198 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 CA--C 1.541 0.6 0 CA-C-N 119.826 1.194 . . . . 0.0 108.443 178.696 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.362 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -119.83 130.49 54.93 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -120.6 142.79 49.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.401 1.08 . . . . 0.0 109.227 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.31 134.83 54.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.703 1.201 . . . . 0.0 108.197 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -128.25 111.52 13.49 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.7 m -155.38 151.68 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 126.209 1.804 . . . . 0.0 108.71 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.88 101.68 7.38 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.86 122.32 1.81 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 106.833 -2.507 . . . . 0.0 106.833 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -67.51 -58.0 5.51 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 120.799 2.299 . . . . 0.0 113.683 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 51.6 mttm -65.83 -42.93 89.93 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -51.98 -49.01 64.08 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.227 -0.892 . . . . 0.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 75.2 t80 -62.94 -49.63 73.99 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.301 0.955 . . . . 0.0 112.558 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -56.77 -49.71 74.47 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.208 0.913 . . . . 0.0 110.551 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.8 mt -58.98 -48.81 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 1.8 mm? -62.3 -34.7 77.1 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.313 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -52.85 57.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.189 0.904 . . . . 0.0 108.562 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -62.97 -42.47 99.84 Favored 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.72 -0.792 . . . . 0.0 111.232 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 34.9 mt -64.1 -44.59 91.85 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 118.209 0.459 . . . . 0.0 112.157 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1116 ' ' LYS . . . . . 0.42 ' HZ2' ' HB2' ' D' 1116 ' ' LYS . 0.1 OUTLIER -65.62 -51.96 55.6 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 118.703 0.683 . . . . 0.0 110.475 -178.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.05 -52.12 59.55 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.583 1.177 . . . . 0.0 108.815 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 42.2 t -56.5 -44.7 80.94 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.143 -1.408 . . . . 0.0 112.839 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.87 -44.9 91.68 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.899 1.227 . . . . 0.0 110.487 -179.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.77 -48.26 81.45 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.635 0.774 . . . . 0.0 109.511 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -44.95 89.26 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.2 1.0 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.4 -30.55 70.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.769 1.227 . . . . 0.0 111.47 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 40.0 tp10 -78.7 -34.69 45.85 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.843 -0.599 . . . . 0.0 109.914 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.1 pp -85.75 -29.81 23.58 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.1 p -94.2 144.26 27.74 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 119.917 1.235 . . . . 0.0 109.059 -178.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.65 175.51 7.92 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.484 1.456 . . . . 0.0 110.667 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -117.93 39.96 0.31 Allowed Pre-proline 0 CA--C 1.553 1.083 0 N-CA-C 118.07 2.619 . . . . 0.0 118.07 -176.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -57.54 -48.76 15.8 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.727 2.284 . . . . 0.0 115.08 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 9.1 tt -65.1 -38.98 92.45 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.4 t -58.11 -48.32 84.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 123.773 0.829 . . . . 0.0 109.01 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.85 -45.08 78.55 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 2.5 m -63.05 -48.0 80.58 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 119.183 -0.437 . . . . 0.0 110.238 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.38 -52.59 64.73 Favored 'General case' 0 C--O 1.227 -0.109 0 C-N-CA 124.834 1.253 . . . . 0.0 110.948 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -53.23 -46.04 68.94 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.37 1.868 . . . . 0.0 110.822 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.75 -50.78 26.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.626 0.648 . . . . 0.0 110.226 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -56.08 -35.15 66.66 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.818 -0.552 . . . . 0.0 110.888 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -78.1 -32.89 50.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.165 0.986 . . . . 0.0 110.286 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -59.57 -33.09 71.0 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.7 mt -61.2 -9.93 5.75 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.423 0.689 . . . . 0.0 112.544 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.744 0 C-N-CA 126.582 1.953 . . . . 0.0 109.665 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.9 tp -77.58 108.91 11.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.034 1.334 . . . . 0.0 111.429 -178.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -103.34 162.64 12.84 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -135.97 102.25 4.98 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.338 -0.852 . . . . 0.0 111.094 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mp -75.73 119.4 76.97 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 119.897 1.226 . . . . 0.0 108.626 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -86.85 117.42 1.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 122.836 2.358 . . . . 0.0 107.839 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.4 t -141.13 152.07 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 119.955 1.252 . . . . 0.0 108.763 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.16 102.9 5.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.93 124.58 1.24 Allowed Glycine 0 C--O 1.225 -0.444 0 CA-C-O 115.695 -2.725 . . . . 0.0 107.682 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -69.88 -52.0 28.45 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 122.617 3.209 . . . . 0.0 111.288 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -76.17 -30.85 58.24 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.816 1.246 . . . . 0.0 109.29 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 m -67.0 -51.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -58.88 -37.9 77.61 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 119.036 0.835 . . . . 0.0 109.912 179.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -57.64 9.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.472 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -64.95 -44.09 90.57 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.497 0.59 . . . . 0.0 111.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.04 -51.4 69.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.2 1.0 . . . . 0.0 108.49 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -70.77 -45.56 64.51 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.323 0.965 . . . . 0.0 111.85 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -56.31 -48.85 75.87 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.657 1.117 . . . . 0.0 113.367 -177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.7 mt -74.4 -32.97 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.718 -0.614 . . . . 0.0 109.352 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.89 -48.23 79.89 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.98 -45.46 93.55 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 125.554 1.541 . . . . 0.0 109.139 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.2 t -53.17 -51.35 62.33 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.747 0.819 . . . . 0.0 110.72 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tt -61.6 -55.56 29.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.865 0.866 . . . . 0.0 109.946 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.89 -51.63 65.4 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 124.547 1.139 . . . . 0.0 112.588 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.05 -41.55 86.31 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.141 -0.974 . . . . 0.0 112.521 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.89 -45.5 93.48 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -67.23 -31.51 71.92 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 118.36 -0.829 . . . . 0.0 111.378 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -71.39 -27.59 63.43 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.159 0.89 . . . . 0.0 109.767 178.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.2 mt . . . . . 0 C--O 1.241 0.631 0 CA-C-N 119.743 1.156 . . . . 0.0 109.417 178.497 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.236 0.363 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -45.68 79.02 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.759 -0.588 . . . . 0.0 112.026 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.2 mm -67.49 -34.76 70.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 123.849 0.86 . . . . 0.0 111.048 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -58.7 -54.85 42.47 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -58.74 -41.11 85.72 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.649 0.78 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -60.42 -53.4 57.99 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.22 0.918 . . . . 0.0 110.558 179.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.07 -40.46 81.09 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.074 0.55 . . . . 0.0 109.867 -178.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.55 -47.92 65.64 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.77 -0.633 . . . . 0.0 109.712 179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.41 -46.8 76.6 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.41 1.484 . . . . 0.0 110.995 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -62.36 -49.72 74.45 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.713 0.805 . . . . 0.0 110.47 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.08 -41.87 98.62 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.635 1.174 . . . . 0.0 111.253 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 123.064 0.546 . . . . 0.0 111.896 -179.191 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -102.74 129.61 49.43 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -105.68 155.14 19.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.71 145.91 26.94 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.27 108.6 5.27 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.367 1.867 . . . . 0.0 109.892 -179.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . 0.447 HG11 ' HE3' ' D' 1116 ' ' LYS . 54.6 t -155.37 146.37 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.54 1.136 . . . . 0.0 109.372 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -97.27 104.77 16.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.07 108.06 0.5 Allowed Glycine 0 C--O 1.225 -0.45 0 CA-C-O 116.448 -2.306 . . . . 0.0 111.451 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -64.53 -57.23 9.74 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.546 3.173 . . . . 0.0 110.775 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -50.09 66.64 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.927 0.891 . . . . 0.0 109.908 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -56.71 -43.57 80.69 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 118.481 -0.771 . . . . 0.0 112.031 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -61.47 -49.96 74.69 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.225 0.921 . . . . 0.0 109.483 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.62 -53.73 54.28 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 124.04 0.837 . . . . 0.0 112.349 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.34 -58.03 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.601 1.56 . . . . 0.0 110.921 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.31 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 117.606 -1.188 . . . . 0.0 111.184 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -70.25 -44.81 67.72 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 120.821 1.646 . . . . 0.0 108.169 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.04 -47.6 71.4 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 18.5 mt -67.99 -39.54 83.23 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.013 0.925 . . . . 0.0 111.454 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . 0.457 ' HZ2' ' HB3' ' D' 1108 ' ' ASN . 1.5 tpmt? -57.93 -59.07 5.81 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.751 1.62 . . . . 0.0 109.012 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -54.27 -50.3 67.57 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.769 2.028 . . . . 0.0 110.369 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 16.4 m -59.07 -36.25 74.75 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -38.42 64.14 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.097 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.96 -42.75 98.9 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.48 -42.64 99.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.25 -38.11 89.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.64 0.776 . . . . 0.0 110.85 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.63 -38.16 70.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.775 0.83 . . . . 0.0 111.404 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -32.97 28.24 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 65.4 t -93.72 141.28 23.59 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 119.3 0.955 . . . . 0.0 108.524 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -67.72 -164.38 0.1 OUTLIER 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 122.841 2.361 . . . . 0.0 110.389 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -108.77 47.3 0.2 Allowed Pre-proline 0 CA--C 1.555 1.154 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -67.89 -71.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.314 2.676 . . . . 0.0 112.602 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.76 -38.69 79.01 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 7.5 t -52.89 -55.86 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 126.777 2.031 . . . . 0.0 109.975 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -66.01 -43.39 87.84 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.314 1.046 . . . . 0.0 111.583 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.1 t -56.73 -49.92 73.77 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.513 0.725 . . . . 0.0 109.986 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -64.77 -48.79 73.24 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.686 1.594 . . . . 0.0 108.111 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.0 66.3 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.761 1.224 . . . . 0.0 112.098 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.32 -56.62 10.26 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.91 0.777 . . . . 0.0 110.692 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -53.98 -41.39 67.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.096 0.558 . . . . 0.0 110.94 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -69.56 -41.63 75.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.569 1.148 . . . . 0.0 110.261 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -56.96 -31.45 65.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 119.434 1.015 . . . . 0.0 109.871 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.37 -11.49 6.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.15 0.886 . . . . 0.0 112.45 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.54 0.559 0 C-N-CA 125.57 1.548 . . . . 0.0 109.638 178.236 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.59 106.58 8.32 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.373 1.869 . . . . 0.0 110.462 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.07 154.27 19.9 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.025 1.73 . . . . 0.0 109.072 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -119.16 145.32 46.09 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.217 0.917 . . . . 0.0 111.519 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.8 mt -117.79 90.3 35.89 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.711 1.604 . . . . 0.0 110.661 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.0 106.72 2.27 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.952 3.768 . . . . 0.0 110.769 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 15.3 t -139.41 156.91 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.339 1.456 . . . . 0.0 108.917 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.57 101.56 4.83 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 123.156 0.583 . . . . 0.0 110.026 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.87 121.92 1.02 Allowed Glycine 0 CA--C 1.522 0.512 0 N-CA-C 108.363 -1.895 . . . . 0.0 108.363 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -69.19 -51.84 33.96 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.277 2.039 . . . . 0.0 111.255 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -70.7 -33.46 70.91 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.48 0.657 . . . . 0.0 109.465 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 33.1 m -60.1 -51.29 70.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.319 1.448 . . . . 0.0 108.552 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.12 -44.52 95.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.751 1.221 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -55.91 -57.18 13.16 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.6 ppp? -65.24 -39.12 92.28 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.682 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 19.7 tp -60.07 -49.6 77.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.671 -0.681 . . . . 0.0 112.078 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.63 -45.86 88.33 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.594 0.634 . . . . 0.0 109.856 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -55.2 -45.58 75.86 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.266 0.626 . . . . 0.0 111.549 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 25.8 mt -76.27 -46.73 32.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.207 0.603 . . . . 0.0 111.169 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -59.6 -37.24 78.02 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.35 0.66 . . . . 0.0 110.221 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -66.64 -51.97 50.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.3 t -53.44 -51.52 62.4 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.693 0.797 . . . . 0.0 112.131 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.18 -53.64 54.42 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.609 0.764 . . . . 0.0 110.764 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -58.84 -51.03 71.74 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.159 0.584 . . . . 0.0 111.967 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.8 -38.03 89.6 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.655 0.782 . . . . 0.0 111.4 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.2 tmt? -62.04 -46.79 87.58 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -74.93 -20.27 59.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.702 0.683 . . . . 0.0 110.888 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -76.64 -38.09 55.22 Favored 'General case' 0 C--N 1.346 0.445 0 O-C-N 120.568 -1.332 . . . . 0.0 108.396 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 17.5 mt . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 177.532 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.467 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.92 71.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.148 1.34 . . . . 0.0 111.281 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.34 -36.95 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.687 1.195 . . . . 0.0 110.45 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.5 -52.46 61.16 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.131 1.772 . . . . 0.0 108.762 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.8 m -64.11 -40.81 97.0 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -56.59 -53.65 55.18 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.409 1.084 . . . . 0.0 109.614 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -63.09 -40.09 96.61 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.444 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.75 -48.83 80.05 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.879 0.763 . . . . 0.0 109.031 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -62.09 -50.77 70.6 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.276 1.43 . . . . 0.0 111.283 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -57.02 -43.79 82.21 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.386 1.074 . . . . 0.0 108.978 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -64.66 -54.32 33.63 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.791 0.837 . . . . 0.0 109.3 178.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.0 tt0 . . . . . 0 CA--C 1.529 0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 112.675 -178.562 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.541 0.614 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -102.22 128.91 48.54 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.63 160.87 13.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.165 1.386 . . . . 0.0 109.453 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -152.8 152.67 31.87 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.409 -1.432 . . . . 0.0 107.893 176.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -151.39 98.0 2.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.779 1.232 . . . . 0.0 109.032 -177.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 55.2 t -148.73 149.65 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.983 1.713 . . . . 0.0 108.35 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -118.94 102.06 8.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.403 1.456 . . . . 0.0 112.606 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.37 124.93 2.42 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 107.164 -2.374 . . . . 0.0 107.164 176.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -67.3 -57.15 7.18 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 120.641 2.22 . . . . 0.0 110.979 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.58 -47.98 83.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1108 ' ' ASN . . . . . 0.457 ' HB3' ' HZ2' ' B' ' 116' ' ' LYS . 86.2 m-20 -52.84 -50.52 63.57 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.482 1.513 . . . . 0.0 112.402 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 66.7 t80 -64.31 -48.01 77.24 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.17 -178.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.84 -53.03 54.61 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.022 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.98 -57.95 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 125.474 1.51 . . . . 0.0 110.597 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.24 -40.05 88.89 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.9 -1.048 . . . . 0.0 111.551 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.5 tmt? -64.1 -48.9 74.33 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 120.418 1.463 . . . . 0.0 109.726 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 14.3 ttmm -53.47 -51.89 61.28 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.492 0.717 . . . . 0.0 109.205 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 40.0 mt -62.7 -42.06 99.44 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.407 1.083 . . . . 0.0 111.57 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1116 ' ' LYS . . . . . 0.447 ' HE3' HG11 ' B' ' 103' ' ' VAL . 39.0 tptt -59.77 -53.3 59.55 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.748 1.219 . . . . 0.0 110.798 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -59.54 -51.38 70.07 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.385 1.474 . . . . 0.0 109.491 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.5 m -54.76 -44.61 73.78 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.09 0.956 . . . . 0.0 112.179 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -36.74 77.94 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.265 0.484 . . . . 0.0 110.988 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.65 -41.29 92.75 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.399 1.0 . . . . 0.0 109.127 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.72 -52.25 58.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.805 1.242 . . . . 0.0 110.376 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.5 -19.87 65.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.235 0.471 . . . . 0.0 111.75 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -79.64 -39.16 32.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.857 1.208 . . . . 0.0 109.065 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -75.62 -28.9 59.01 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 118.245 -0.883 . . . . 0.0 112.61 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.91 147.39 33.87 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.781 0.832 . . . . 0.0 110.057 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.45 -176.53 2.54 Favored 'Trans proline' 0 CA--C 1.547 1.14 0 C-N-CA 123.314 2.676 . . . . 0.0 110.496 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -104.22 40.94 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.256 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.84 -56.76 0.23 Allowed 'Trans proline' 0 C--N 1.355 0.875 0 CA-C-N 124.34 2.586 . . . . 0.0 113.096 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.57 -44.63 90.09 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.193 0.906 . . . . 0.0 108.824 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 t -53.07 -53.46 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 125.544 1.538 . . . . 0.0 110.504 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 7.4 t70 -63.53 -38.51 91.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.154 0.888 . . . . 0.0 111.44 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 21.5 t -62.89 -50.09 72.25 Favored 'General case' 0 N--CA 1.457 -0.119 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -62.14 -42.57 99.37 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -48.02 73.66 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.62 0.768 . . . . 0.0 110.011 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -69.66 -47.79 62.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.175 0.898 . . . . 0.0 110.672 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -55.7 -40.44 72.4 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.814 1.246 . . . . 0.0 111.231 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -80.64 -33.77 35.47 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.058 1.743 . . . . 0.0 110.611 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -60.5 -30.89 70.0 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.483 1.038 . . . . 0.0 108.671 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.3 -20.48 59.34 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.441 0.564 . . . . 0.0 111.956 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.539 0.543 0 C-N-CA 124.956 1.302 . . . . 0.0 112.014 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 CA--C 1.548 0.879 0 CA-C-O 120.878 0.371 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -81.53 101.54 10.01 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.18 -1.575 . . . . 0.0 107.002 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.64 168.79 11.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.711 1.205 . . . . 0.0 108.602 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -133.26 138.28 46.39 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.919 1.288 . . . . 0.0 108.653 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.8 90.43 48.37 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 124.823 1.249 . . . . 0.0 111.966 -178.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.74 112.39 2.66 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 124.5 3.467 . . . . 0.0 111.806 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.7 t -144.71 152.96 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.554 1.141 . . . . 0.0 108.501 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -135.18 100.88 4.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.67 1.123 . . . . 0.0 108.858 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.99 124.21 1.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-O 116.343 -2.365 . . . . 0.0 107.356 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -66.16 -51.09 61.11 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 121.399 2.6 . . . . 0.0 110.055 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.02 -41.65 92.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.202 1.001 . . . . 0.0 111.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -64.81 -50.0 68.47 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.125 1.37 . . . . 0.0 108.692 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -56.92 -51.82 67.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.643 -0.694 . . . . 0.0 111.028 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -55.3 -54.87 38.05 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 124.159 0.912 . . . . 0.0 111.942 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.443 ' HE3' ' HE3' ' D' 1114 ' ' LYS . 37.6 ttm -59.55 -50.45 73.85 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.488 0.315 . . . . 0.0 111.391 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.82 -41.69 91.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.854 0.862 . . . . 0.0 110.813 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 tt -68.05 -45.72 73.1 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.46 -40.16 81.91 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.949 0.795 . . . . 0.0 111.512 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mt -72.77 -43.64 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -59.26 -46.23 89.06 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.545 -0.722 . . . . 0.0 109.316 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -56.03 -55.21 35.57 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.935 1.694 . . . . 0.0 109.65 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 p -64.18 -44.32 92.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.04 -47.88 84.34 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 118.669 0.668 . . . . 0.0 109.88 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -62.13 -43.57 98.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.02 -49.92 70.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 118.733 0.697 . . . . 0.0 111.324 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.0 ttm -57.4 -37.17 72.29 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.72 -34.55 64.85 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.022 -1.049 . . . . 0.0 111.628 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -77.07 -30.85 55.71 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.606 1.094 . . . . 0.0 110.894 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 CA--C 1.539 0.532 0 C-N-CA 126.68 1.992 . . . . 0.0 107.896 -179.373 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 m -61.73 -45.54 93.5 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.086 -1.008 . . . . 0.0 109.359 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 9.1 mm -63.47 -41.07 91.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 123.837 0.855 . . . . 0.0 110.578 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.9 -36.92 78.01 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.609 1.564 . . . . 0.0 109.726 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.5 m -68.52 -52.39 32.66 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -60.36 -36.07 77.16 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.309 1.044 . . . . 0.0 111.55 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -48.96 76.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.684 1.194 . . . . 0.0 108.712 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -67.22 -55.88 12.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 118.499 -0.762 . . . . 0.0 111.205 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.92 -54.76 34.28 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.425 1.09 . . . . 0.0 111.576 -178.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.39 -39.55 93.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.516 -0.754 . . . . 0.0 111.373 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -64.02 -49.81 70.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.833 0.742 . . . . 0.0 109.347 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 . . . . . 0 CA--C 1.531 0.233 0 CA-C-N 118.798 0.726 . . . . 0.0 110.03 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 96.8 m . . . . . 0 N--CA 1.449 -0.51 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -102.1 150.93 22.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -123.56 137.14 54.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.52 1.128 . . . . 0.0 109.777 -177.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 19.7 tp -139.68 149.83 44.16 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 123.387 0.675 . . . . 0.0 110.805 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -145.68 108.29 4.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.367 -2.457 . . . . 0.0 104.367 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 m -149.66 150.67 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.804 1.184 . . . . 0.0 112.153 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.42 102.14 10.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.67 114.42 0.82 Allowed Glycine 0 C--O 1.227 -0.316 0 CA-C-O 116.006 -2.552 . . . . 0.0 109.873 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -68.05 -57.44 6.12 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 122.489 3.144 . . . . 0.0 108.404 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -70.3 -49.88 45.06 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.14 -51.32 58.65 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.059 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -67.12 -36.52 82.08 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.958 1.254 . . . . 0.0 111.682 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -60.71 -54.14 48.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 120.003 1.274 . . . . 0.0 110.768 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.77 -51.08 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 125.745 1.618 . . . . 0.0 110.611 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.3 mt -60.41 -33.88 73.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.718 -179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -45.92 70.21 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.771 1.623 . . . . 0.0 108.212 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . 0.404 ' HE3' ' HE1' ' C' 1018 ' ' MET . 29.1 ttpt -55.83 -49.49 73.13 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 30.7 mt -60.43 -36.34 77.96 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-O 119.009 -0.52 . . . . 0.0 110.97 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -59.99 4.46 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 119.477 1.035 . . . . 0.0 109.149 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -62.05 -43.81 98.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.619 -0.705 . . . . 0.0 111.423 -178.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 4.1 t -58.05 -45.29 87.27 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.405 1.002 . . . . 0.0 111.501 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -69.56 -46.34 66.63 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 117.846 -1.073 . . . . 0.0 109.679 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -57.01 -49.34 76.09 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.051 0.841 . . . . 0.0 109.939 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.51 -50.72 72.75 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 123.808 0.843 . . . . 0.0 110.726 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -69.6 -18.87 63.65 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -83.57 -47.38 11.36 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.034 1.334 . . . . 0.0 108.976 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.79 -32.67 72.56 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.699 -179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 77.6 t -92.76 144.51 28.71 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -67.61 -176.76 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.08 2.52 . . . . 0.0 111.274 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -111.5 48.37 0.29 Allowed Pre-proline 0 CA--C 1.551 1.0 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.93 -57.46 0.13 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.251 1.967 . . . . 0.0 113.782 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.7 tt -63.38 -31.96 73.26 Favored 'General case' 0 C--N 1.349 0.546 0 O-C-N 120.627 -1.296 . . . . 0.0 110.952 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 t -51.8 -56.78 4.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 C-N-CA 124.226 1.01 . . . . 0.0 111.943 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -73.9 -31.49 63.12 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.406 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.2 m -61.06 -47.88 84.32 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 122.398 1.094 . . . . 0.0 108.088 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -66.98 -38.36 85.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.466 1.506 . . . . 0.0 108.409 178.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -46.99 84.37 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.96 0.904 . . . . 0.0 109.188 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -59.03 -46.41 88.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -44.66 89.04 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.41 0.684 . . . . 0.0 110.906 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -35.36 73.71 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.169 0.987 . . . . 0.0 110.076 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -56.21 -40.31 73.85 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.2 -18.29 63.34 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.562 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp . . . . . 0 C--N 1.342 0.252 0 CA-C-N 119.904 1.229 . . . . 0.0 110.154 179.763 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 120.831 0.348 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 33.7 tp -76.54 95.49 3.91 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 103.968 -2.605 . . . . 0.0 103.968 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 58.4 mt -89.54 124.64 34.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 124.35 1.06 . . . . 0.0 108.222 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -104.57 125.93 51.18 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 128.917 2.887 . . . . 0.0 108.1 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.95 92.01 19.75 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.244 1.417 . . . . 0.0 109.641 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.24 118.17 4.86 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.648 2.232 . . . . 0.0 107.501 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 22.0 t -145.15 155.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 119.706 1.139 . . . . 0.0 109.978 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -134.98 102.58 5.27 Favored 'General case' 0 C--N 1.343 0.312 0 O-C-N 121.214 -0.929 . . . . 0.0 109.134 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.37 116.83 0.7 Allowed Glycine 0 CA--C 1.519 0.31 0 CA-C-O 115.496 -2.836 . . . . 0.0 107.001 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.4 tpp85 -61.98 -51.82 66.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.697 2.749 . . . . 0.0 111.976 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -69.2 -41.07 77.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.868 0.758 . . . . 0.0 109.502 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -55.47 -46.49 76.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.3 t80 -65.57 -47.93 74.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.54 0.736 . . . . 0.0 109.998 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -53.18 -50.71 64.07 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.774 1.23 . . . . 0.0 110.69 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1018 ' ' MET . . . . . 0.404 ' HE1' ' HE3' ' B' ' 114' ' ' LYS . 3.1 tmm? -69.33 -43.16 74.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.314 0.646 . . . . 0.0 111.41 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.12 -46.55 89.26 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.735 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.25 -46.33 81.01 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 119.268 0.94 . . . . 0.0 111.612 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -54.98 -44.46 74.47 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.111 0.868 . . . . 0.0 110.335 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.5 mt -72.63 -44.11 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.839 1.256 . . . . 0.0 111.166 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -57.77 -49.08 77.78 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.847 0.859 . . . . 0.0 109.34 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.25 -45.45 80.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.305 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.7 p -61.08 -40.6 94.3 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 120.328 1.422 . . . . 0.0 111.536 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 64.4 mt -67.87 -46.32 72.02 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.124 0.97 . . . . 0.0 109.471 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.18 -44.18 97.18 Favored 'General case' 0 C--O 1.224 -0.264 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 1.4 mm? -57.95 -44.3 86.88 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 119.12 0.873 . . . . 0.0 110.515 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 4.6 ttm -57.19 -36.07 70.37 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -76.96 -37.17 55.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.365 -1.302 . . . . 0.0 111.669 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -83.1 -19.59 36.47 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 120.942 1.701 . . . . 0.0 113.667 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.9 mm? . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 179.145 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.18 -43.18 96.08 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.126 -0.984 . . . . 0.0 110.373 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 13.0 mm -63.93 -34.33 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.369 1.068 . . . . 0.0 109.808 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -69.56 -44.34 71.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.246 1.018 . . . . 0.0 108.892 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.3 m -62.94 -46.74 86.32 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.1 t80 -59.24 -50.36 74.29 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.247 1.419 . . . . 0.0 111.226 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 tpp85 -56.43 -48.48 76.91 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.923 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -57.26 -55.73 31.03 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.313 0.96 . . . . 0.0 109.585 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.96 -54.36 39.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.846 1.259 . . . . 0.0 112.968 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -65.23 -47.01 78.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.118 1.367 . . . . 0.0 111.592 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -56.62 -47.17 80.26 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.589 1.156 . . . . 0.0 108.231 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 . . . . . 0 N--CA 1.453 -0.319 0 C-N-CA 124.576 1.15 . . . . 0.0 110.471 178.869 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -131.4 158.33 41.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.846 1.258 . . . . 0.0 109.069 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -124.44 160.58 27.9 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.152 1.381 . . . . 0.0 110.352 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 13.4 tp -159.88 139.01 10.93 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.585 1.154 . . . . 0.0 108.496 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -138.97 98.07 3.45 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 30.4 m -145.45 151.72 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 O-C-N 120.683 -1.26 . . . . 0.0 114.254 -176.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.14 103.48 12.69 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.45 100.56 0.24 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 103.661 -3.776 . . . . 0.0 103.661 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -61.82 -57.49 11.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 122.474 3.137 . . . . 0.0 112.803 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 6.5 mttp -66.34 -38.73 88.33 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.376 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.5 m120 -59.39 -51.76 68.51 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.67 -1.157 . . . . 0.0 111.36 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1109 ' ' PHE . . . . . 0.401 ' CZ ' ' HG3' ' D' 1113 ' ' MET . 84.2 t80 -60.84 -42.1 97.13 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 120.247 1.385 . . . . 0.0 110.333 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.45 -53.71 52.9 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.469 0.652 . . . . 0.0 110.068 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.96 -54.04 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 125.562 1.545 . . . . 0.0 110.607 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.11 -38.86 74.02 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.488 1.515 . . . . 0.0 111.186 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1113 ' ' MET . . . . . 0.401 ' HG3' ' CZ ' ' D' 1109 ' ' PHE . 0.0 OUTLIER -71.74 -43.99 64.86 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.213 1.369 . . . . 0.0 109.577 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' D' D 1114 ' ' LYS . . . . . 0.443 ' HE3' ' HE3' ' A' ' 18' ' ' MET . 8.8 ttpt -56.9 -44.74 82.66 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 68.9 mt -63.46 -36.09 82.6 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.869 0.868 . . . . 0.0 111.248 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -60.03 4.47 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.215 -0.928 . . . . 0.0 108.68 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -64.4 -29.37 70.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.368 0.267 . . . . 0.0 111.081 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 17.8 t -64.45 -47.68 78.17 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.842 0.747 . . . . 0.0 110.088 178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.51 -44.3 58.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 116.959 -1.496 . . . . 0.0 111.979 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -59.28 -41.24 88.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.952 1.705 . . . . 0.0 110.827 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.1 mm? -66.33 -50.6 63.04 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 3.5 ttt -61.76 -27.4 68.7 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.31 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -78.6 -37.07 43.33 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.345 1.458 . . . . 0.0 111.773 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -79.43 -27.9 41.71 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 118.362 -0.828 . . . . 0.0 112.257 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.25 147.14 33.98 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 118.735 0.698 . . . . 0.0 109.988 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.92 -175.16 0.55 Allowed 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.243 2.629 . . . . 0.0 109.378 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.272 7.2 pt20 -111.63 51.18 0.34 Allowed Pre-proline 0 CA--C 1.557 1.232 0 O-C-N 120.039 -1.663 . . . . 0.0 114.425 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.42 -65.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.462 2.775 . . . . 0.0 113.127 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.15 -30.43 71.49 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.708 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -58.92 -55.79 21.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.814 1.246 . . . . 0.0 110.367 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 45.2 t0 -63.63 -40.71 97.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.649 0.659 . . . . 0.0 110.483 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 19.9 m -60.13 -50.4 73.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.327 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.7 t80 -62.96 -42.92 99.97 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.89 1.276 . . . . 0.0 110.39 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -45.61 70.44 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -69.03 -52.88 24.02 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.577 0.751 . . . . 0.0 110.512 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -50.47 -47.51 57.04 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.027 1.731 . . . . 0.0 111.183 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.72 -38.99 62.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.547 1.139 . . . . 0.0 109.281 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.5 -32.39 39.92 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.495 1.043 . . . . 0.0 110.882 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -56.98 -23.55 46.72 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 118.684 0.675 . . . . 0.0 112.171 177.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 32.2 tp . . . . . 0 N--CA 1.467 0.397 0 CA-C-N 120.485 1.493 . . . . 0.0 112.898 -179.767 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.418 ' HG3' ' H ' ' A' ' 5' ' ' LEU . 2.2 tp10 . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 110.582 -0.155 . . . . 0.0 110.582 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.418 ' H ' ' HG3' ' A' ' 4' ' ' GLU . 57.3 tp -79.38 95.24 5.69 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.1 mt -95.52 140.73 29.94 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -112.21 144.11 42.15 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.774 1.63 . . . . 0.0 107.902 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.4 tp -130.39 94.04 30.99 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 124.596 1.158 . . . . 0.0 109.546 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -78.58 121.26 5.07 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 109.356 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.4 t -144.78 156.08 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.03 1.286 . . . . 0.0 108.719 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -133.03 102.17 5.5 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.99 110.58 0.41 Allowed Glycine 0 C--O 1.219 -0.84 0 CA-C-O 115.839 -2.645 . . . . 0.0 107.526 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.32 65.29 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 122.94 3.37 . . . . 0.0 109.1 178.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -67.05 -46.84 73.14 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -36.85 84.8 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.925 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -71.11 -43.9 66.73 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 120.189 1.359 . . . . 0.0 108.672 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.14 -49.8 76.21 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.511 1.051 . . . . 0.0 109.308 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.4 ttp -57.22 -46.77 82.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.882 0.473 . . . . 0.0 109.82 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.54 -38.97 93.17 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 123.921 0.888 . . . . 0.0 110.027 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.37 -47.13 71.29 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 119.297 0.953 . . . . 0.0 109.718 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -48.95 74.01 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.582 0.753 . . . . 0.0 110.501 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.3 mt -73.01 -33.45 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.185 0.994 . . . . 0.0 110.957 -178.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -67.58 -56.9 7.62 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.57 -38.94 72.64 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.058 2.143 . . . . 0.0 110.426 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -61.19 -52.52 64.48 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.405 -0.807 . . . . 0.0 110.838 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -39.27 61.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.012 0.824 . . . . 0.0 111.851 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.79 -54.47 46.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.827 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.21 -41.45 77.05 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 117.97 -1.015 . . . . 0.0 110.264 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -57.86 -38.99 76.68 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.247 0.931 . . . . 0.0 110.668 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -79.53 -20.63 46.66 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.328 0.513 . . . . 0.0 110.119 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -82.59 -39.56 22.06 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.984 -1.072 . . . . 0.0 112.103 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.3 tp . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.876 1.67 . . . . 0.0 109.933 -179.285 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 80.4 m80 . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.5 m -54.8 -51.16 66.65 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.165 2.186 . . . . 0.0 109.031 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.48 -45.87 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 125.607 1.563 . . . . 0.0 109.733 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.97 -55.6 32.06 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.817 0.447 . . . . 0.0 111.845 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -62.0 -43.01 99.74 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.42 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -58.02 -49.55 76.48 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 119.494 1.043 . . . . 0.0 108.9 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.97 -48.2 82.69 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.193 1.397 . . . . 0.0 111.725 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -59.85 -56.55 20.36 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.477 1.111 . . . . 0.0 110.091 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -58.48 -43.95 89.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.155 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -52.86 -46.75 68.01 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.163 0.985 . . . . 0.0 111.95 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.12 -53.9 38.11 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.009 0.524 . . . . 0.0 111.016 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 121.011 0.434 . . . . 0.0 110.84 -179.472 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.7 m . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -106.03 150.68 25.51 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -128.58 140.15 51.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.511 1.125 . . . . 0.0 110.718 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.5 mt -133.21 110.12 9.9 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -110.29 98.59 7.8 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 128.503 2.721 . . . . 0.0 105.808 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -154.41 151.17 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.226 1.41 . . . . 0.0 109.012 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.33 101.27 7.27 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.685 0.675 . . . . 0.0 110.813 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.19 105.42 0.39 Allowed Glycine 0 C--O 1.228 -0.28 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -53.79 -54.15 42.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 121.586 2.693 . . . . 0.0 112.918 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.89 -40.65 89.45 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.868 0.758 . . . . 0.0 109.854 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -60.18 -50.58 73.13 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.154 -0.926 . . . . 0.0 110.539 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -54.33 -46.04 72.8 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 119.256 0.935 . . . . 0.0 111.194 -178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -61.74 -53.74 51.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.34 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 45.2 mt -58.05 -52.54 57.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.985 1.714 . . . . 0.0 110.543 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 73.6 mt -65.76 -32.28 73.73 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.154 1.381 . . . . 0.0 111.885 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 24.3 mtp -68.24 -54.56 16.85 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.85 1.205 . . . . 0.0 109.433 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -60.71 -35.95 77.62 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.674 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.95 -54.77 11.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 117.836 -1.078 . . . . 0.0 110.697 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 5.3 tptp -58.16 -40.83 82.42 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 121.059 1.754 . . . . 0.0 110.018 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.5 -58.53 7.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 126.322 1.849 . . . . 0.0 106.39 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 90.2 p -57.68 -36.16 71.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.3 -42.77 65.11 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.17 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -64.84 -40.03 94.52 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.012 1.278 . . . . 0.0 107.583 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 44.6 mt -64.24 -46.16 85.0 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.026 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -71.2 -19.08 62.43 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.312 0.96 . . . . 0.0 110.7 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -89.08 -42.79 11.51 Favored 'General case' 0 C--N 1.343 0.323 0 O-C-N 121.01 -1.056 . . . . 0.0 113.225 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -76.3 -33.01 59.07 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.0 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -95.5 147.56 33.2 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 178.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -71.68 177.89 6.36 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.508 1.472 . . . . 0.0 110.382 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -112.17 50.85 0.37 Allowed Pre-proline 0 CA--C 1.554 1.099 0 O-C-N 121.08 -1.013 . . . . 0.0 112.389 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.37 -57.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.732 2.288 . . . . 0.0 113.292 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.2 tt -65.33 -33.52 76.16 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 119.992 1.269 . . . . 0.0 109.206 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 40.2 t -54.36 -56.33 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.851 1.661 . . . . 0.0 109.228 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.59 -47.35 85.88 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.81 0.844 . . . . 0.0 111.233 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 30.1 t -54.75 -50.78 67.58 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 0.0 110.442 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -68.55 -44.08 75.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.87 1.268 . . . . 0.0 111.019 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -54.96 -46.0 74.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 118.822 0.737 . . . . 0.0 109.729 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -65.81 -49.63 67.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.448 0.567 . . . . 0.0 110.917 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -57.28 -44.77 84.29 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.229 0.612 . . . . 0.0 111.673 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.69 -29.82 61.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.882 0.873 . . . . 0.0 109.547 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -61.75 -32.83 73.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -6.0 3.62 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.07 1.348 . . . . 0.0 113.021 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.468 0.448 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.902 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.5 tp10 . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 110.894 -0.039 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 67.2 tp -78.47 95.21 5.08 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 42.8 mt -90.52 153.75 20.13 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -123.29 142.31 51.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.584 1.154 . . . . 0.0 108.921 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 41.7 tp -134.11 94.89 17.43 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.11 0.964 . . . . 0.0 111.182 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.18 130.03 9.05 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.432 2.755 . . . . 0.0 109.964 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 2.4 t -145.78 152.04 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.602 1.161 . . . . 0.0 108.478 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -134.91 101.83 5.03 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 177.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.57 117.01 0.7 Allowed Glycine 0 CA--C 1.519 0.328 0 N-CA-C 105.402 -3.079 . . . . 0.0 105.402 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -52.41 58.85 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 122.067 2.934 . . . . 0.0 110.968 -179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.95 -41.14 78.43 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 54.0 m -58.27 -48.03 81.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 118.316 -0.849 . . . . 0.0 109.964 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.4 t80 -58.54 -50.59 73.21 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 119.147 0.885 . . . . 0.0 110.145 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.0 -48.8 78.72 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 ttt -58.69 -49.34 77.93 Favored 'General case' 0 N--CA 1.46 0.066 0 C-N-CA 124.754 1.222 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.86 -50.28 73.85 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.385 1.074 . . . . 0.0 109.132 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -55.86 28.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.011 0.924 . . . . 0.0 111.15 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -55.6 -48.52 74.75 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.676 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 76.7 mt -67.0 -43.93 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.669 -0.644 . . . . 0.0 111.176 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.16 -52.28 59.77 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 123.786 0.835 . . . . 0.0 111.539 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -66.92 -35.11 79.25 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.258 1.023 . . . . 0.0 110.044 -179.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 4.8 t -56.05 -51.77 66.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -48.27 80.17 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 123.193 0.308 . . . . 0.0 110.663 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -57.06 -54.62 44.68 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.51 0.724 . . . . 0.0 111.989 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.43 -41.4 84.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 119.342 0.974 . . . . 0.0 112.344 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -44.6 92.8 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 -22.99 46.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.733 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 t80 -79.14 -33.45 44.16 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.117 1.326 . . . . 0.0 111.311 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 49.8 tp . . . . . 0 CA--C 1.536 0.405 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 179.427 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 38.3 m80 . . . . . 0 CA--C 1.533 0.293 0 CA-C-O 118.554 -0.736 . . . . 0.0 112.934 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.6 m -61.27 -49.39 77.27 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 120.117 1.326 . . . . 0.0 109.451 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1037 ' ' ILE . . . . . 0.453 ' CD1' ' H ' ' C' 1037 ' ' ILE . 2.2 mp -59.21 -42.95 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 126.342 1.857 . . . . 0.0 109.526 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.73 -59.41 4.93 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.676 1.19 . . . . 0.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.3 m -60.1 -52.74 64.05 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.153 1.381 . . . . 0.0 111.897 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.27 -50.33 69.8 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.466 0.706 . . . . 0.0 112.37 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -61.13 -44.7 96.94 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 118.887 0.767 . . . . 0.0 111.641 -179.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -61.93 -48.91 78.32 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -64.55 -36.24 83.56 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-O 116.984 -1.484 . . . . 0.0 111.127 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -60.46 -42.33 95.95 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 120.92 1.691 . . . . 0.0 108.239 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -47.6 84.89 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 118.997 0.817 . . . . 0.0 110.598 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 3.4 tp60 . . . . . 0 CA--C 1.542 0.661 0 O-C-N 123.41 0.444 . . . . 0.0 110.647 -179.836 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 80.6 m . . . . . 0 C--O 1.235 0.311 0 CA-C-O 121.265 0.555 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -120.38 143.12 48.59 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -126.83 142.94 51.41 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.777 1.231 . . . . 0.0 110.677 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 90.4 mt -129.86 140.97 50.89 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -136.87 98.44 3.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.423 1.077 . . . . 0.0 108.117 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.6 m -153.19 151.51 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.944 1.298 . . . . 0.0 111.671 -177.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.33 102.79 10.18 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.374 0.988 . . . . 0.0 111.604 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.25 116.81 0.99 Allowed Glycine 0 C--O 1.229 -0.168 0 CA-C-O 115.636 -2.758 . . . . 0.0 107.886 177.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.78 -56.93 11.81 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 122.521 3.16 . . . . 0.0 111.592 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.84 -43.8 97.83 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 14.7 m120 -54.13 -47.88 71.39 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 117.671 -1.156 . . . . 0.0 112.038 -178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.1 t80 -64.5 -46.25 83.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.524 1.056 . . . . 0.0 109.856 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.98 -52.39 65.7 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.537 1.062 . . . . 0.0 111.408 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.16 -48.61 84.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 126.971 2.108 . . . . 0.0 111.825 -178.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 53.8 mt -67.72 -36.14 80.06 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.901 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 68.8 mtp -65.45 -53.2 46.32 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 119.999 1.272 . . . . 0.0 109.729 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -56.37 -40.72 75.01 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.359 0.981 . . . . 0.0 111.276 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 38.6 mt -74.24 -41.0 62.03 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1116 ' ' LYS . . . . . 0.521 ' HZ1' ' HG2' ' D' 1120 ' ' GLU . 3.1 tptp -65.7 -43.44 89.17 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.476 -1.39 . . . . 0.0 107.941 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -59.47 -52.86 63.76 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.482 1.513 . . . . 0.0 108.021 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 84.2 p -60.6 -34.64 74.53 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.008 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.07 -36.98 78.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.233 0.924 . . . . 0.0 109.489 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D 1120 ' ' GLU . . . . . 0.521 ' HG2' ' HZ1' ' D' 1116 ' ' LYS . 0.6 OUTLIER -64.71 -52.48 56.9 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.238 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 43.3 mt -57.8 -47.12 83.49 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.135 1.774 . . . . 0.0 112.122 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.0 ppp? -76.49 -24.61 53.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 120.074 1.306 . . . . 0.0 112.749 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -80.44 -42.9 21.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.115 0.87 . . . . 0.0 110.049 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.3 -32.24 38.07 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.77 149.07 35.86 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.766 1.226 . . . . 0.0 107.916 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -65.36 167.95 15.52 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 121.339 1.359 . . . . 0.0 110.954 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -118.79 57.05 3.1 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 124.507 1.123 . . . . 0.0 113.113 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -70.51 -64.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.25 2.633 . . . . 0.0 112.826 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.7 tt -58.81 -33.78 70.76 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.868 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.8 t -52.2 -53.52 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 C-N-CA 124.154 0.982 . . . . 0.0 110.054 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 35.5 t0 -70.52 -41.17 72.91 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.202 0.91 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 14.5 t -54.82 -49.82 70.07 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.16 -49.72 63.73 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.423 1.489 . . . . 0.0 109.8 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -53.53 -45.91 69.96 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.216 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.67 -49.18 69.55 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 120.525 1.511 . . . . 0.0 110.236 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -52.03 -49.26 63.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.125 1.37 . . . . 0.0 109.242 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -39.68 75.24 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 127.138 2.175 . . . . 0.0 111.173 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -59.94 -28.09 67.33 Favored 'General case' 0 N--CA 1.462 0.156 0 O-C-N 120.988 -1.07 . . . . 0.0 109.651 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -19.71 47.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.506 0.722 . . . . 0.0 111.076 177.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.1 tt . . . . . 0 CA--C 1.53 0.194 0 C-N-CA 125.17 1.388 . . . . 0.0 110.332 179.359 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 CA--C 1.521 -0.149 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -66.19 96.43 0.34 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.785 1.634 . . . . 0.0 109.121 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.88 143.73 26.69 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -103.79 100.69 10.5 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 30.7 tp -92.11 107.36 22.48 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 128.468 2.707 . . . . 0.0 108.217 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -85.16 129.68 3.88 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.218 2.612 . . . . 0.0 110.767 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 t -145.43 150.62 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.92 1.236 . . . . 0.0 110.867 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -136.43 102.24 4.9 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.95 128.1 1.63 Allowed Glycine 0 N--CA 1.459 0.208 0 CA-C-O 114.845 -3.197 . . . . 0.0 107.765 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -52.97 17.64 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 122.791 3.295 . . . . 0.0 109.898 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.35 -33.79 76.51 Favored 'General case' 0 C--N 1.343 0.29 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 m -60.48 -50.26 74.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.287 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.95 -46.42 87.81 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.217 -178.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -59.24 -52.37 65.95 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.413 0.551 . . . . 0.0 111.067 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 34.6 ttm -59.12 -52.0 67.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.245 1.018 . . . . 0.0 109.215 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.7 mp -60.8 -30.72 70.23 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.78 0.718 . . . . 0.0 111.015 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -55.77 7.74 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 119.197 0.908 . . . . 0.0 108.849 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.14 -39.04 92.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -178.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.4 mt -62.13 -47.6 92.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.41 -58.04 9.82 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -51.97 -39.29 59.1 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.358 1.863 . . . . 0.0 113.386 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 p -69.02 -51.16 42.12 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.675 0.671 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 tt -62.83 -50.65 70.14 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 124.614 1.166 . . . . 0.0 111.553 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.91 -53.99 48.34 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.33 1.052 . . . . 0.0 110.79 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.34 -35.81 76.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.562 0.619 . . . . 0.0 111.365 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -27.03 68.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.509 1.05 . . . . 0.0 110.529 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -92.77 -28.26 16.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.791 -0.568 . . . . 0.0 109.848 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -75.46 -29.92 59.78 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.145 0.884 . . . . 0.0 110.65 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 tm? . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.677 1.591 . . . . 0.0 107.771 179.921 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.2 m80 . . . . . 0 CA--C 1.53 0.192 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.0 m -59.3 -45.15 92.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.614 1.097 . . . . 0.0 110.106 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.47 -49.66 82.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 C-N-CA 125.384 1.474 . . . . 0.0 108.148 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.34 -41.57 96.71 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.2 m -60.88 -50.22 74.29 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.11 -43.16 77.87 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.627 0.771 . . . . 0.0 110.287 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -49.38 78.01 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.86 -0.525 . . . . 0.0 110.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -65.52 -50.39 65.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.948 0.899 . . . . 0.0 110.899 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -54.93 36.82 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.543 1.137 . . . . 0.0 110.596 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? -64.91 -32.9 74.84 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.886 1.221 . . . . 0.0 112.734 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.47 -47.77 74.93 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 118.762 0.71 . . . . 0.0 109.159 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 . . . . . 0 N--CA 1.451 -0.424 0 C-N-CA 124.434 1.094 . . . . 0.0 109.502 -179.853 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.467 0.384 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -109.8 140.03 44.18 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.42 145.94 49.84 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 127.466 2.306 . . . . 0.0 107.867 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 50.0 mt -147.94 150.16 33.54 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.772 0.829 . . . . 0.0 109.052 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.02 107.63 4.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.524 -1.227 . . . . 0.0 110.43 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.9 t -155.13 144.82 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 119.879 1.218 . . . . 0.0 109.374 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.06 103.85 15.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -141.38 112.75 0.79 Allowed Glycine 0 C--O 1.227 -0.307 0 N-CA-C 106.985 -2.446 . . . . 0.0 106.985 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 46.3 tpt85 -65.22 -59.21 4.32 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.991 2.396 . . . . 0.0 112.068 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -71.67 -42.02 68.0 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.16 -50.81 61.07 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 125.639 1.576 . . . . 0.0 110.468 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.31 -41.04 85.99 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.822 1.192 . . . . 0.0 110.322 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.85 -52.44 62.78 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.491 1.042 . . . . 0.0 109.134 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 56.2 mt -57.08 -57.88 8.14 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 C-N-CA 127.205 2.202 . . . . 0.0 110.118 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 mp -55.26 -54.01 48.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.571 1.148 . . . . 0.0 110.869 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 7.3 ttp -59.84 -45.12 93.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.356 0.98 . . . . 0.0 111.417 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -56.31 -52.43 64.55 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.897 0.879 . . . . 0.0 109.934 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 78.4 mt -70.49 -30.0 66.68 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -58.81 -60.04 4.48 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.43 -45.27 80.84 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 124.201 0.938 . . . . 0.0 110.688 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 66.7 m -60.48 -44.06 96.32 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 118.034 -0.984 . . . . 0.0 113.389 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -38.21 63.01 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.894 1.224 . . . . 0.0 109.458 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -55.35 -52.81 62.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.798 0.808 . . . . 0.0 109.396 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.08 -42.41 94.13 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.452 -1.261 . . . . 0.0 109.288 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.52 -31.08 70.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.338 0.972 . . . . 0.0 111.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -77.09 -40.02 47.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.828 0.74 . . . . 0.0 110.013 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 26.7 tp -76.61 -22.46 54.15 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 33.3 m -94.5 147.61 33.54 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 119.848 1.203 . . . . 0.0 109.334 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.54 177.4 7.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 121.883 1.722 . . . . 0.0 108.639 178.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -112.09 56.58 0.47 Allowed Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 121.056 -1.028 . . . . 0.0 113.013 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.5 -72.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.584 2.19 . . . . 0.0 110.544 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.17 -36.91 85.18 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.8 t -54.29 -56.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 125.029 1.331 . . . . 0.0 111.597 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.18 -44.94 90.46 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.161 1.346 . . . . 0.0 111.497 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 17.4 t -57.83 -47.0 83.89 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -68.25 -35.63 78.21 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.235 1.414 . . . . 0.0 109.684 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 23.0 ttm-85 -55.46 -48.95 73.71 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.229 1.377 . . . . 0.0 108.834 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -69.72 -51.64 32.51 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.905 0.882 . . . . 0.0 111.631 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -51.11 -49.07 61.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.861 0.864 . . . . 0.0 110.068 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.26 -37.54 71.94 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.527 1.131 . . . . 0.0 110.579 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -57.13 -27.62 61.99 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.172 0.989 . . . . 0.0 110.6 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.25 -12.97 57.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.778 0.717 . . . . 0.0 112.186 177.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.539 0.541 0 O-C-N 120.943 -1.098 . . . . 0.0 111.045 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 7.6 tt -79.37 98.88 6.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.147 1.379 . . . . 0.0 108.528 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.2 mt -87.64 152.74 21.93 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 126.125 1.77 . . . . 0.0 107.138 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -115.15 100.07 7.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 23.6 tp -82.04 108.57 11.84 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.455 1.502 . . . . 0.0 108.932 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -93.74 103.43 0.14 Allowed 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 124.772 3.648 . . . . 0.0 110.923 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 68.0 t -136.39 159.18 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 120.759 -1.213 . . . . 0.0 110.641 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -135.52 102.2 5.05 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.51 130.97 2.22 Favored Glycine 0 CA--C 1.517 0.176 0 CA-C-O 115.538 -2.812 . . . . 0.0 109.23 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -70.12 -52.68 21.77 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 121.351 2.576 . . . . 0.0 108.636 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.33 -34.93 78.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.199 0.599 . . . . 0.0 109.825 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.7 m -65.95 -47.98 72.85 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 89.9 t80 -64.33 -49.48 71.54 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.843 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -55.46 -53.23 58.94 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.527 1.131 . . . . 0.0 110.506 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 10.4 ttm -58.17 -53.59 56.6 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 123.285 0.634 . . . . 0.0 110.25 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.1 mp -62.75 -28.62 70.09 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.725 -1.131 . . . . 0.0 111.489 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.81 -56.6 5.96 Favored 'General case' 0 CA--C 1.522 -0.102 0 CA-C-N 120.696 1.589 . . . . 0.0 108.259 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -61.11 -46.9 88.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.479 0.712 . . . . 0.0 112.785 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 48.0 mt -67.9 -44.12 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.604 0.638 . . . . 0.0 110.632 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.2 tmpt? -66.73 -44.22 82.14 Favored 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 120.974 -1.079 . . . . 0.0 110.01 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -62.93 -50.85 69.21 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.582 0.753 . . . . 0.0 110.518 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 19.0 p -56.14 -46.41 79.25 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.184 0.902 . . . . 0.0 111.475 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 4.2 tt -62.94 -49.1 76.07 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.927 1.291 . . . . 0.0 110.056 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -60.27 -54.91 40.13 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.788 0.835 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.76 -40.93 94.31 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 124.416 1.086 . . . . 0.0 112.132 -178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmm? -63.27 -44.29 95.55 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -65.0 -37.11 86.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -33.54 76.15 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.801 1.24 . . . . 0.0 112.714 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.3 tm? . . . . . 0 CA--C 1.544 0.746 0 CA-C-N 119.28 0.946 . . . . 0.0 109.713 -179.419 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 26.5 m80 . . . . . 0 N--CA 1.456 -0.167 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 60.8 m -57.95 -47.67 82.24 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.473 1.033 . . . . 0.0 108.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 4.0 mp -59.29 -42.09 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.915 0.886 . . . . 0.0 109.062 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.06 -57.73 10.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.652 0.381 . . . . 0.0 111.213 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 91.2 m -57.82 -43.46 85.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.3 1.04 . . . . 0.0 109.745 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -58.43 -46.54 86.29 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.539 1.063 . . . . 0.0 110.302 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -49.16 76.54 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.69 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -68.32 -47.74 66.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 118.802 -0.618 . . . . 0.0 110.99 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -48.28 -51.19 26.88 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.081 1.353 . . . . 0.0 110.102 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . 0.296 3.7 pp0? -72.98 -31.72 64.71 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.74 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -66.25 -40.25 90.07 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.184 1.356 . . . . 0.0 108.456 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 20.1 tp60 . . . . . 0 CA--C 1.532 0.262 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.941 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 121.019 0.438 . . . . 0.0 110.687 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -106.99 145.4 32.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -130.03 143.29 50.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 125.571 1.548 . . . . 0.0 107.306 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 59.7 mt -144.42 154.81 43.35 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.095 0.558 . . . . 0.0 110.446 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -145.02 107.42 4.38 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.453 1.901 . . . . 0.0 108.116 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 99.6 t -155.55 152.32 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 128.547 2.739 . . . . 0.0 106.497 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 103.49 7.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 121.128 1.785 . . . . 0.0 112.854 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.39 120.33 1.75 Allowed Glycine 0 C--O 1.228 -0.279 0 N-CA-C 105.957 -2.857 . . . . 0.0 105.957 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 9.3 tpt85 -57.85 -56.61 19.69 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.439 1.62 . . . . 0.0 111.688 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 58.7 mttp -67.51 -48.91 65.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -51.7 -52.03 51.47 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.051 0.94 . . . . 0.0 110.51 -177.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 93.1 t80 -61.06 -51.03 70.91 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 117.89 -1.052 . . . . 0.0 111.816 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -57.63 -47.56 81.88 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.875 1.216 . . . . 0.0 111.415 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 87.7 mt -61.21 -58.2 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.832 1.253 . . . . 0.0 108.896 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 4.6 mp -55.2 -47.47 75.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.264 0.626 . . . . 0.0 109.802 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -44.38 87.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.695 1.198 . . . . 0.0 110.279 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -62.72 -53.03 60.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.751 1.16 . . . . 0.0 108.558 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 59.4 mt -59.2 -30.06 67.94 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.084 0.553 . . . . 0.0 112.475 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -64.34 -60.52 3.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.703 1.201 . . . . 0.0 108.522 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.23 -41.21 99.07 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 123.704 0.628 . . . . 0.0 110.722 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 58.6 m -58.91 -48.18 82.36 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.35 0.977 . . . . 0.0 112.019 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -41.63 70.21 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -57.27 -46.55 82.97 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.645 1.111 . . . . 0.0 110.341 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.52 -39.67 88.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 117.804 -1.093 . . . . 0.0 108.783 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -66.97 -30.75 70.95 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.151 0.98 . . . . 0.0 110.605 178.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -75.7 -28.74 58.75 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.935 1.694 . . . . 0.0 109.661 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 40.9 tp -85.48 -33.1 21.92 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.597 1.159 . . . . 0.0 112.476 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 21.2 m -93.46 148.0 34.72 Favored Pre-proline 0 C--N 1.332 -0.181 0 O-C-N 120.934 -1.104 . . . . 0.0 110.233 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -70.82 -179.9 3.75 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 N-CA-C 108.105 -1.536 . . . . 0.0 108.105 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -112.0 61.52 0.57 Allowed Pre-proline 0 CA--C 1.544 0.718 0 O-C-N 120.814 -1.179 . . . . 0.0 111.936 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.96 -75.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 123.598 2.865 . . . . 0.0 109.974 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.4 tt -65.05 -30.35 71.31 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.9 t -55.9 -52.41 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.328 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.15 -45.96 75.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.182 1.355 . . . . 0.0 110.693 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -50.25 67.53 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.643 0.777 . . . . 0.0 109.839 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 24.8 t80 -67.02 -42.46 84.9 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 125.335 1.454 . . . . 0.0 110.064 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -57.06 -47.8 80.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.954 1.252 . . . . 0.0 110.866 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -67.45 -37.77 83.48 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.898 0.772 . . . . 0.0 110.453 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -64.67 -34.0 77.26 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.767 1.627 . . . . 0.0 111.238 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.97 -43.69 19.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.53 1.532 . . . . 0.0 108.501 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -57.76 -31.53 66.59 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.018 0.927 . . . . 0.0 110.498 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 19.3 mt -58.6 -21.35 53.16 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.708 0.803 . . . . 0.0 111.429 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 C-N-CA 123.368 0.667 . . . . 0.0 111.884 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.236 0.357 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.0 tp -89.8 121.75 32.24 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -106.57 163.75 12.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.597 1.159 . . . . 0.0 108.011 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -132.44 145.17 51.0 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -132.99 96.91 17.26 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-O 118.272 -0.871 . . . . 0.0 109.255 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.05 126.4 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.582 2.855 . . . . 0.0 112.737 -179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 t -145.77 148.63 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 119.655 1.116 . . . . 0.0 109.917 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -136.28 100.94 4.53 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.55 117.45 0.74 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 105.389 -3.084 . . . . 0.0 105.389 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -65.09 -50.94 64.18 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 122.174 2.987 . . . . 0.0 111.592 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.267 0.939 . . . . 0.0 110.228 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.2 m -63.84 -49.57 72.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -59.0 -34.88 72.36 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.932 1.242 . . . . 0.0 112.123 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.05 -57.38 13.34 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.422 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 1.2 ptp -63.82 -37.8 88.74 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 119.74 -0.784 . . . . 0.0 112.336 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.55 -53.62 48.88 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 117.896 -1.05 . . . . 0.0 111.817 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.01 -52.6 64.3 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 119.661 1.119 . . . . 0.0 110.439 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -56.29 -47.57 78.39 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.67 -47.62 69.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 118.709 0.686 . . . . 0.0 109.979 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.49 -53.78 41.17 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.937 0.895 . . . . 0.0 109.817 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -61.52 -34.39 75.43 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.978 0.911 . . . . 0.0 112.69 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 p -67.77 -43.74 79.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.489 0.586 . . . . 0.0 110.291 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.07 -42.45 89.38 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.399 1.079 . . . . 0.0 109.333 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -54.74 -53.87 49.4 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 56.5 tp -60.07 -56.28 23.57 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.402 1.081 . . . . 0.0 112.765 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.421 ' HE2' HH21 ' A' ' 41' ' ' ARG . 0.2 OUTLIER -54.36 -32.35 56.68 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.347 1.459 . . . . 0.0 112.467 -178.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -89.92 -41.64 11.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.633 0.651 . . . . 0.0 111.129 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -70.58 -21.71 62.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 112.912 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp . . . . . 0 C--O 1.236 0.364 0 C-N-CA 123.992 0.917 . . . . 0.0 110.652 -178.987 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 . . . . . 0 CA--C 1.53 0.201 0 CA-C-O 119.18 -0.438 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 m -62.14 -51.25 68.64 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.5 mp -57.21 -48.1 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.531 1.132 . . . . 0.0 108.682 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -60.57 -58.68 7.45 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.8 p -59.93 -50.02 75.39 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 123.726 0.81 . . . . 0.0 111.9 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.84 -35.25 76.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 118.043 0.383 . . . . 0.0 111.069 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.421 HH21 ' HE2' ' A' ' 29' ' ' MET . 37.9 ttm180 -67.24 -48.57 67.4 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -58.61 -45.62 88.78 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.657 0.383 . . . . 0.0 110.672 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -63.59 -49.66 72.49 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.422 -0.799 . . . . 0.0 110.337 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -58.01 -40.14 80.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.142 0.883 . . . . 0.0 110.239 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -67.19 -49.79 63.34 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 CA--C 1.534 0.356 0 O-C-N 121.599 -0.688 . . . . 0.0 110.42 179.606 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 98.3 m . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -119.69 130.11 54.87 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 104.15 -2.537 . . . . 0.0 104.15 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -108.33 151.03 26.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.507 1.523 . . . . 0.0 110.43 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 45.1 mt -148.67 150.73 33.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.698 0.799 . . . . 0.0 109.362 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.26 106.02 4.13 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.327 1.451 . . . . 0.0 109.867 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 57.5 t -154.68 151.48 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.968 1.307 . . . . 0.0 109.156 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -113.08 102.33 10.29 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.51 1.504 . . . . 0.0 111.603 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.15 111.32 0.64 Allowed Glycine 0 CA--C 1.52 0.366 0 CA-C-O 116.046 -2.53 . . . . 0.0 108.08 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 11.2 tpt180 -60.32 -58.02 10.3 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.954 2.877 . . . . 0.0 112.566 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -67.28 -41.83 84.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 118.544 0.611 . . . . 0.0 110.613 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -58.78 -48.05 82.6 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.54 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -63.7 -44.13 94.56 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 119.007 0.821 . . . . 0.0 110.438 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -57.66 -53.92 52.71 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.737 0.699 . . . . 0.0 111.277 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.8 mt -59.7 -54.17 38.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 124.31 1.044 . . . . 0.0 109.757 -178.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 58.1 mt -58.63 -51.32 70.42 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 117.259 -1.353 . . . . 0.0 112.247 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 26.2 ttt -64.16 -44.59 91.63 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.96 1.255 . . . . 0.0 111.133 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.1 ttpt -54.05 -52.37 61.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 119.028 0.831 . . . . 0.0 109.115 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 81.6 mt -72.57 -23.88 61.03 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.384 0.674 . . . . 0.0 112.187 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . 0.424 ' HE3' ' CB ' ' D' 1103 ' ' VAL . 25.2 tptt -63.26 -60.11 3.83 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 120.196 1.362 . . . . 0.0 107.978 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -39.13 77.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.434 1.709 . . . . 0.0 108.649 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 7.0 t -57.03 -45.31 83.21 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 123.43 0.692 . . . . 0.0 111.322 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.27 -42.77 71.67 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.382 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.91 -37.03 85.9 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 120.728 1.604 . . . . 0.0 110.248 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 mt -66.57 -48.28 70.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -61.61 -31.9 72.0 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.935 0.894 . . . . 0.0 111.113 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -73.9 -33.35 63.97 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.178 0.899 . . . . 0.0 109.671 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 52.7 tp -83.54 -33.69 25.41 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.5 m -94.16 148.6 35.42 Favored Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -71.42 172.26 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.082 0 CA-C-N 119.904 1.002 . . . . 0.0 110.5 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -112.84 41.6 0.23 Allowed Pre-proline 0 CA--C 1.556 1.18 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.51 -48.81 2.88 Favored 'Trans proline' 0 C--N 1.354 0.836 0 CA-C-N 122.417 1.899 . . . . 0.0 111.502 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.2 -36.13 80.98 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.016 0.826 . . . . 0.0 109.567 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.25 -46.65 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.068 0 C-N-CA 123.809 0.844 . . . . 0.0 110.23 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 100.0 m-20 -62.12 -50.07 73.36 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.015 0.526 . . . . 0.0 110.31 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.3 t -62.37 -46.38 88.89 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.008 0.523 . . . . 0.0 111.176 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -61.32 -49.61 76.29 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.535 1.134 . . . . 0.0 109.006 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -56.55 -47.72 78.83 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 118.503 -0.76 . . . . 0.0 108.968 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -58.7 -54.48 46.6 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.039 0.836 . . . . 0.0 111.207 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -34.4 75.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.7 0.682 . . . . 0.0 112.4 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -74.56 -33.9 62.8 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.148 0.579 . . . . 0.0 110.069 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -61.76 -38.62 88.66 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.151 -1.593 . . . . 0.0 107.55 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.16 -13.4 60.15 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.112 0.565 . . . . 0.0 112.059 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--N 1.341 0.207 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 178.44 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 68.8 tp -86.57 124.23 32.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.87 169.1 10.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -137.97 152.24 48.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -119.43 99.84 49.91 Favored Pre-proline 0 C--O 1.235 0.311 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -80.04 108.15 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.821 3.014 . . . . 0.0 109.582 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.3 t -142.17 147.42 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 O-C-N 121.027 -1.046 . . . . 0.0 110.365 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -126.25 101.97 6.98 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.56 120.82 0.91 Allowed Glycine 0 N--CA 1.459 0.218 0 CA-C-O 116.035 -2.536 . . . . 0.0 108.578 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -66.73 -51.77 52.07 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 122.411 3.106 . . . . 0.0 110.395 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -67.9 -38.12 82.59 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.31 99.11 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.274 0.63 . . . . 0.0 110.691 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 20.9 t80 -68.9 -38.93 79.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 119.742 1.155 . . . . 0.0 108.921 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -60.51 -54.4 45.9 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.353 -0.832 . . . . 0.0 111.497 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 3.8 ptp -61.59 -33.04 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.619 0.645 . . . . 0.0 111.132 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.21 -46.83 66.47 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -43.2 98.31 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 119.467 1.03 . . . . 0.0 109.741 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.74 -48.88 74.47 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.194 0.998 . . . . 0.0 110.624 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 8.6 mt -79.76 -31.53 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.508 0.723 . . . . 0.0 111.837 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -65.86 -56.69 10.55 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.14 -49.27 76.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.896 1.678 . . . . 0.0 113.055 -178.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 13.7 p -61.88 -50.19 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.688 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -65.77 -40.33 91.9 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.035 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.02 -54.53 41.88 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -47.56 78.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 117.916 0.326 . . . . 0.0 111.21 -179.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -54.76 -33.35 61.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.705 1.202 . . . . 0.0 111.297 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 -22.92 18.72 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.073 1.349 . . . . 0.0 111.354 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.48 -34.63 31.24 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.339 1.427 . . . . 0.0 109.752 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 22.6 tp . . . . . 0 C--O 1.237 0.423 0 C-N-CA 126.433 1.893 . . . . 0.0 107.592 179.593 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 84.2 m-70 . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 7.3 m -61.75 -51.55 67.88 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.976 0.91 . . . . 0.0 109.002 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.98 -40.45 85.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 125.787 1.635 . . . . 0.0 109.116 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -65.21 -58.04 7.0 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.434 1.494 . . . . 0.0 112.625 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 26.3 p -59.2 -43.55 92.23 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.73 0.812 . . . . 0.0 110.744 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 6.5 t80 -59.72 -39.62 85.28 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.934 0.494 . . . . 0.0 109.789 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -62.86 -48.81 77.43 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 118.99 0.814 . . . . 0.0 109.653 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -57.83 -56.37 22.86 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.268 0.627 . . . . 0.0 111.009 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -60.47 -45.1 94.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.895 -1.05 . . . . 0.0 111.428 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.89 -33.77 76.44 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.258 0.935 . . . . 0.0 113.297 -178.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -69.33 -50.36 47.26 Favored 'General case' 0 N--CA 1.461 0.084 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 . . . . . 0 CA--C 1.538 0.489 0 C-N-CA 124.054 0.942 . . . . 0.0 110.752 179.104 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 84.2 m . . . . . 0 N--CA 1.465 0.287 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -113.24 130.16 56.31 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -105.69 140.03 39.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.942 2.897 . . . . 0.0 110.141 -177.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 77.5 mt -137.66 144.93 42.09 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.326 -0.859 . . . . 0.0 111.006 -178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.84 101.39 3.94 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.03 1.732 . . . . 0.0 110.377 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D 1103 ' ' VAL . . . . . 0.424 ' CB ' ' HE3' ' B' ' 116' ' ' LYS . 63.9 t -151.25 152.01 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 120.585 -1.322 . . . . 0.0 109.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -115.79 101.47 8.84 Favored 'General case' 0 C--N 1.347 0.497 0 CA-C-N 120.486 1.494 . . . . 0.0 113.547 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.84 118.38 1.24 Allowed Glycine 0 CA--C 1.522 0.494 0 N-CA-C 107.717 -2.153 . . . . 0.0 107.717 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -66.73 -56.65 9.56 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 121.307 2.554 . . . . 0.0 111.014 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -63.38 -45.92 88.87 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.048 0.928 . . . . 0.0 109.328 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -57.99 -51.27 70.34 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 117.205 -1.378 . . . . 0.0 111.763 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.55 -44.97 95.54 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.498 1.499 . . . . 0.0 111.149 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -50.73 -54.1 26.03 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.807 0.843 . . . . 0.0 110.509 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.6 mt -65.88 -52.34 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.822 1.249 . . . . 0.0 110.383 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 18.2 mt -51.73 -52.26 49.92 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.566 1.147 . . . . 0.0 111.974 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 24.0 ttt -64.7 -44.26 90.84 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.25 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1114 ' ' LYS . . . . . 0.422 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 24.7 ttpt -54.99 -52.18 63.93 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.93 -45.8 76.76 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.576 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.6 tptt -53.76 -59.75 4.21 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 118.949 0.795 . . . . 0.0 111.755 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -30.31 71.18 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 18.4 t -60.86 -39.04 87.66 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 120.324 1.42 . . . . 0.0 109.7 178.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.07 -38.6 63.88 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.275 0.489 . . . . 0.0 110.093 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.73 -43.29 96.94 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.93 -48.85 70.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.6 tmt? -59.56 -22.49 61.79 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.752 0.821 . . . . 0.0 110.861 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.71 -46.8 35.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 65.1 tp -71.99 -33.11 67.84 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.864 0.866 . . . . 0.0 113.334 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 23.1 m -92.25 147.5 34.71 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 120.101 1.319 . . . . 0.0 110.4 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -71.45 174.86 10.25 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 N-CA-C 108.398 -1.424 . . . . 0.0 108.398 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -122.74 44.3 0.87 Allowed Pre-proline 0 CA--C 1.555 1.136 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -61.91 -48.72 8.03 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.158 2.572 . . . . 0.0 113.273 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 49.7 tp -65.64 -26.41 67.79 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.453 -0.779 . . . . 0.0 109.689 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 39.7 t -67.27 -46.56 83.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.237 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -56.84 -43.81 81.5 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -64.6 -48.47 74.82 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.137 0.575 . . . . 0.0 109.975 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.36 -41.85 94.54 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.205 1.002 . . . . 0.0 110.166 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.07 -48.44 80.12 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.66 -49.82 69.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 117.893 -1.051 . . . . 0.0 111.89 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -42.46 95.67 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.118 1.326 . . . . 0.0 111.384 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -71.01 -37.55 72.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.157 0.435 . . . . 0.0 111.12 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -65.82 -39.75 91.17 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 119.028 0.831 . . . . 0.0 109.659 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 43.4 mt -66.81 -26.13 66.79 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.887 0.767 . . . . 0.0 110.003 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 124.295 1.038 . . . . 0.0 108.677 178.839 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.87 104.71 1.14 Allowed 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -92.2 169.25 10.75 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -123.93 127.92 48.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 13.5 tp -115.67 93.98 38.98 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 126.022 1.729 . . . . 0.0 107.353 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -77.8 119.92 4.94 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.062 2.508 . . . . 0.0 112.988 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -145.62 155.59 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.04 1.336 . . . . 0.0 108.775 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.0 101.4 4.71 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.2 0.6 . . . . 0.0 111.102 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.48 115.93 0.65 Allowed Glycine 0 CA--C 1.526 0.732 0 C-N-CA 126.805 2.145 . . . . 0.0 107.758 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.07 -51.98 65.92 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.6 2.7 . . . . 0.0 112.286 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -73.42 -32.38 64.38 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 123.27 0.628 . . . . 0.0 110.737 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -61.05 -43.4 98.94 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.123 1.369 . . . . 0.0 108.627 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -67.51 -54.43 20.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -54.64 -54.93 35.12 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.471 0.708 . . . . 0.0 112.909 -178.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 40.0 ttm -53.42 -54.02 42.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.983 0.913 . . . . 0.0 110.349 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.94 -28.73 67.73 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-O 118.014 -0.993 . . . . 0.0 112.911 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.22 -55.8 10.98 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.61 -40.49 72.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.031 0.932 . . . . 0.0 110.349 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.2 mt -67.9 -51.07 53.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.63 -0.7 . . . . 0.0 110.337 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -32.82 74.49 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.108 1.322 . . . . 0.0 110.721 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -66.16 -55.17 17.71 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.031 1.332 . . . . 0.0 110.395 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 p -54.38 -40.63 68.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 117.9 0.318 . . . . 0.0 110.326 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 tt -68.5 -55.43 11.77 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.734 1.214 . . . . 0.0 110.513 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -53.36 -52.78 58.16 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.244 1.817 . . . . 0.0 111.869 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.8 -46.22 90.46 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.993 -1.003 . . . . 0.0 109.641 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.54 -43.03 97.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 119.079 0.854 . . . . 0.0 109.281 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -71.69 -13.17 61.66 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -102.77 -28.96 11.78 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.299 0.954 . . . . 0.0 113.526 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.6 tp . . . . . 0 CA--C 1.531 0.232 0 C-N-CA 125.206 1.402 . . . . 0.0 109.848 -178.43 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.5 m170 . . . . . 0 CA--C 1.536 0.404 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.8 m -67.83 -46.09 72.82 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.777 0.831 . . . . 0.0 108.942 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -65.28 -34.39 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -58.27 8.13 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.0 m -68.29 -49.43 60.5 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -52.2 -51.93 55.19 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 123.924 0.89 . . . . 0.0 111.256 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -69.05 -46.1 68.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.937 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -58.45 -52.99 63.29 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.986 0.514 . . . . 0.0 110.629 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -62.75 -41.18 99.08 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.676 -0.678 . . . . 0.0 109.372 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.78 -39.38 84.69 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.383 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.73 -52.15 61.76 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.187 1.358 . . . . 0.0 108.348 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.2 tm0? . . . . . 0 CA--C 1.538 0.518 0 C-N-CA 124.687 1.195 . . . . 0.0 111.712 -179.52 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 53.1 m . . . . . 0 C--O 1.237 0.44 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . 0.459 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 86.9 m-85 -101.7 128.23 48.1 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.108 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -105.98 161.98 14.0 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 126.026 1.73 . . . . 0.0 109.317 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 93.7 mt -151.0 142.98 23.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 127.441 2.296 . . . . 0.0 106.285 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -144.39 98.87 3.28 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.251 1.42 . . . . 0.0 108.37 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 m -153.63 150.32 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 123.485 0.714 . . . . 0.0 111.682 -177.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -117.54 102.48 9.22 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.043 1.292 . . . . 0.0 114.201 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.31 129.28 3.82 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 106.781 -2.528 . . . . 0.0 106.781 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -66.73 -57.51 6.97 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.202 2.001 . . . . 0.0 110.88 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -70.35 -37.87 74.7 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -54.6 -41.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.233 0.613 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -75.12 -42.68 55.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.257 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -54.15 -54.93 32.88 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.853 1.66 . . . . 0.0 110.273 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.02 -54.92 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.466 1.506 . . . . 0.0 110.423 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -32.18 73.74 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-O 116.711 -1.614 . . . . 0.0 112.89 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 21.3 mtp -68.78 -53.24 22.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 121.019 1.736 . . . . 0.0 107.547 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -52.07 -48.55 64.6 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.297 1.039 . . . . 0.0 109.836 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 50.9 mt -67.46 -54.99 15.47 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.6 -0.715 . . . . 0.0 112.138 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -54.45 -37.85 65.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 120.095 1.316 . . . . 0.0 110.797 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.04 -57.59 8.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.731 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 73.0 m -55.54 -34.12 64.41 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.11 -0.947 . . . . 0.0 111.432 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.45 -40.24 67.17 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.713 1.205 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.77 -47.09 85.01 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.44 1.018 . . . . 0.0 108.478 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 75.5 mt -60.64 -47.3 86.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -26.77 68.02 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.263 1.025 . . . . 0.0 111.807 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -79.64 -54.79 5.54 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.808 0.843 . . . . 0.0 111.868 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -69.6 -32.72 71.61 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.86 148.27 34.49 Favored Pre-proline 0 CA--C 1.534 0.327 0 C-N-CA 125.105 1.362 . . . . 0.0 108.756 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -70.98 169.42 20.52 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 121.077 1.185 . . . . 0.0 109.576 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -115.7 58.88 1.46 Allowed Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.436 1.094 . . . . 0.0 113.207 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.07 -63.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 123.558 2.838 . . . . 0.0 115.645 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.31 -33.33 75.57 Favored 'General case' 0 CA--C 1.513 -0.477 0 O-C-N 121.162 -0.961 . . . . 0.0 108.934 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 15.1 t -50.27 -53.33 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 C-N-CA 125.173 1.389 . . . . 0.0 108.401 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -66.39 -51.4 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.8 m -59.16 -41.13 87.66 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.97 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -67.98 -52.77 32.07 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.019 1.328 . . . . 0.0 110.365 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -59.69 -39.78 85.67 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.401 -1.285 . . . . 0.0 110.129 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -64.28 -55.6 20.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.911 1.232 . . . . 0.0 110.058 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -56.42 -42.48 78.12 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.356 -0.84 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -67.83 -40.72 83.74 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.993 0.917 . . . . 0.0 110.828 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -61.23 -34.32 74.93 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 125.26 1.424 . . . . 0.0 110.567 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -57.73 -14.36 5.6 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.388 0.994 . . . . 0.0 113.128 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 CA--C 1.543 0.683 0 CA-C-N 119.814 1.188 . . . . 0.0 109.693 178.451 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 . . . . . 0 N--CA 1.456 -0.141 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 1.9 tt -69.19 95.9 0.79 Allowed 'General case' 0 C--O 1.236 0.378 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.7 mt -90.28 168.77 11.66 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.784 1.633 . . . . 0.0 107.506 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -126.44 135.23 51.12 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 28.4 tp -111.72 91.97 16.11 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.8 106.65 2.24 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.261 2.641 . . . . 0.0 109.471 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 58.9 t -144.91 153.69 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 119.977 1.262 . . . . 0.0 110.769 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -128.52 102.97 6.85 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.3 110.59 0.39 Allowed Glycine 0 CA--C 1.522 0.469 0 CA-C-O 115.646 -2.752 . . . . 0.0 108.878 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -62.06 -53.15 59.53 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 123.099 3.449 . . . . 0.0 111.962 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 16.7 m -67.92 -45.48 74.26 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.28 -0.887 . . . . 0.0 109.469 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.54 -52.39 61.33 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 124.051 0.94 . . . . 0.0 108.614 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -54.47 -51.39 65.17 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.141 0.976 . . . . 0.0 110.69 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 52.1 ttm -61.49 -53.84 51.1 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.654 0.781 . . . . 0.0 111.377 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.3 -36.54 84.38 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.94 -55.8 15.0 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -57.69 -39.31 76.88 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.513 0.725 . . . . 0.0 111.687 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 22.6 mt -65.15 -52.25 55.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 118.483 -0.77 . . . . 0.0 109.865 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -34.61 75.66 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 118.375 -1.33 . . . . 0.0 110.794 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -61.66 -55.35 31.48 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 110.049 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.2 p -55.32 -49.09 73.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 118.094 0.407 . . . . 0.0 110.911 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.3 tt -62.24 -54.3 42.8 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.843 0.857 . . . . 0.0 111.164 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -53.95 -50.97 65.3 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.613 1.165 . . . . 0.0 110.152 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.35 -48.83 76.33 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 123.774 0.829 . . . . 0.0 110.005 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 2.2 tmt? -58.87 -22.65 59.66 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.45 1.1 . . . . 0.0 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -100.98 -12.77 18.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.058 1.743 . . . . 0.0 112.012 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.3 t80 -101.72 -13.41 17.76 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.003 1.321 . . . . 0.0 110.581 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 41.7 tp . . . . . 0 CA--C 1.536 0.411 0 C-N-CA 126.838 2.055 . . . . 0.0 108.633 -179.36 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 7.2 m170 . . . . . 0 N--CA 1.462 0.15 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 13.3 m -58.78 -51.24 70.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.716 0.807 . . . . 0.0 109.829 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.5 mt -57.03 -46.04 84.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.981 1.712 . . . . 0.0 110.206 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.4 -52.11 66.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 122.872 0.469 . . . . 0.0 111.619 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 27.7 m -63.26 -39.53 94.85 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.706 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 24.7 t80 -57.7 -52.97 63.25 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 178.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 48.0 ttt-85 -63.77 -31.81 73.11 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.665 0.666 . . . . 0.0 111.859 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -57.85 11.07 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -67.98 -37.87 82.01 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.668 1.187 . . . . 0.0 111.633 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -60.24 -47.39 86.17 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.586 -1.197 . . . . 0.0 109.834 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -64.64 -40.43 95.44 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.196 1.362 . . . . 0.0 110.012 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.4 tm0? . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.451 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.2 m . . . . . 0 C--O 1.237 0.435 0 N-CA-C 105.087 -2.19 . . . . 0.0 105.087 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -101.9 130.18 48.32 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.194 -0.942 . . . . 0.0 110.173 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -115.61 150.0 37.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.55 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 70.9 mt -142.53 142.27 32.19 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.82 98.56 3.07 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.281 1.033 . . . . 0.0 108.354 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.39 146.52 18.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 124.958 1.303 . . . . 0.0 110.81 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.88 100.62 9.97 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.662 1.119 . . . . 0.0 113.284 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.09 108.15 0.5 Allowed Glycine 0 C--O 1.226 -0.371 0 N-CA-C 106.385 -2.686 . . . . 0.0 106.385 177.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -51.08 -57.11 9.52 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 122.005 2.903 . . . . 0.0 113.728 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -67.84 -44.25 77.6 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.344 -0.848 . . . . 0.0 110.467 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 3.3 m120 -58.6 -30.05 66.92 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.296 1.439 . . . . 0.0 110.645 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1109 ' ' PHE . . . . . 0.459 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 45.7 t80 -74.82 -55.33 5.93 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 177.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.36 -53.93 38.27 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.497 1.044 . . . . 0.0 113.399 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -60.03 -54.47 34.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 C-N-CA 125.035 1.334 . . . . 0.0 109.119 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -35.8 81.68 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 117.442 -1.266 . . . . 0.0 110.877 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.96 -52.45 62.98 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 119.843 1.202 . . . . 0.0 108.282 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 58.0 tttp -54.96 -46.96 75.1 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.69 0.796 . . . . 0.0 109.81 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 33.0 mt -66.86 -52.0 48.85 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 117.907 0.321 . . . . 0.0 110.649 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -55.03 -44.65 74.82 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.399 1.079 . . . . 0.0 111.438 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.62 -57.5 11.78 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.152 1.781 . . . . 0.0 106.983 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.6 m -53.2 -43.72 67.39 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.506 0.722 . . . . 0.0 112.008 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.82 -31.08 64.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.348 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -65.16 -44.86 87.19 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.504 1.502 . . . . 0.0 107.468 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.74 -43.14 89.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.053 1.341 . . . . 0.0 107.783 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.21 -36.46 79.96 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.019 0.827 . . . . 0.0 110.752 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -45.37 52.79 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.807 0.843 . . . . 0.0 112.288 -179.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -78.42 -32.83 48.85 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -94.31 146.12 30.97 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -67.0 173.97 7.54 Favored 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 122.912 2.408 . . . . 0.0 112.799 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.23 50.85 0.67 Allowed Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 125.059 1.344 . . . . 0.0 113.858 -179.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.09 -69.73 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.213 1.942 . . . . 0.0 112.245 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.87 -32.64 73.01 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.253 0.933 . . . . 0.0 110.007 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.0 t -53.99 -50.47 53.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 124.537 1.135 . . . . 0.0 110.074 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.89 -51.25 50.22 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.482 0.583 . . . . 0.0 111.253 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 49.5 m -54.59 -42.36 70.98 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.032 0.378 . . . . 0.0 110.841 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.03 -52.57 40.72 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 117.29 -1.338 . . . . 0.0 110.282 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.86 -43.4 94.7 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 120.121 1.328 . . . . 0.0 111.331 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -62.39 -54.96 32.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 118.875 0.761 . . . . 0.0 109.841 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -61.52 -27.89 68.93 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.8 tm0? -80.51 -49.71 11.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -55.37 -33.2 63.23 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.801 1.64 . . . . 0.0 109.971 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 9.6 mt -57.12 -13.97 3.49 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.038 0.935 . . . . 0.0 113.442 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.3 tt . . . . . 0 CA--C 1.54 0.59 0 CA-C-N 119.468 1.031 . . . . 0.0 110.731 178.087 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tp -62.85 94.57 0.07 Allowed 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.674 1.19 . . . . 0.0 113.123 -177.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.01 156.2 18.12 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -130.14 142.69 50.56 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.766 1.626 . . . . 0.0 106.738 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 tp -132.12 110.47 14.14 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 119.596 1.089 . . . . 0.0 111.885 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -88.18 113.31 0.78 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.766 3.644 . . . . 0.0 111.07 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.2 t -140.83 148.45 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 119.788 -1.82 . . . . 0.0 107.965 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.58 102.8 5.23 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.466 -0.771 . . . . 0.0 109.924 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.26 118.12 0.79 Allowed Glycine 0 CA--C 1.521 0.424 0 N-CA-C 104.325 -3.51 . . . . 0.0 104.325 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.98 -51.46 64.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.965 1.883 . . . . 0.0 109.878 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.51 -45.74 82.38 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.842 0.857 . . . . 0.0 109.449 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.7 m -55.31 -51.81 65.51 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.794 1.638 . . . . 0.0 110.488 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -62.0 -42.56 99.28 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.424 -0.798 . . . . 0.0 110.278 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -60.46 -42.96 97.26 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.118 1.326 . . . . 0.0 111.697 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.5 ttm -69.98 -53.83 15.96 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.038 0.535 . . . . 0.0 110.911 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.18 -47.02 82.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.654 1.581 . . . . 0.0 111.422 -178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.69 -49.09 78.93 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -57.81 -47.65 81.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.948 0.794 . . . . 0.0 111.814 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.12 -42.12 93.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 123.419 0.688 . . . . 0.0 109.249 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -63.38 -52.41 61.76 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 123.854 0.862 . . . . 0.0 108.756 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.35 -54.69 40.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.929 2.092 . . . . 0.0 110.949 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -53.82 -51.1 64.6 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.908 0.776 . . . . 0.0 109.721 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.14 -48.71 78.88 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -178.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -59.69 -51.83 68.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.145 1.378 . . . . 0.0 111.564 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.05 -42.48 94.23 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.072 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -37.18 67.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -89.66 -17.13 28.97 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.222 1.374 . . . . 0.0 112.91 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -87.56 -57.9 2.78 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 121.149 -0.969 . . . . 0.0 113.234 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.54 0.579 0 O-C-N 121.919 -0.488 . . . . 0.0 110.826 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.2 m -66.72 -51.26 57.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.373 -0.83 . . . . 0.0 109.753 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.0 mt -58.3 -43.89 87.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 125.442 1.497 . . . . 0.0 110.939 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -55.95 -58.96 5.69 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.379 1.872 . . . . 0.0 109.677 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.9 m -62.73 -42.19 99.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.153 0.908 . . . . 0.0 110.071 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -55.3 -54.44 43.56 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.408 1.004 . . . . 0.0 111.223 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 43.3 ttt-85 -75.3 -29.87 60.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.308 -0.87 . . . . 0.0 112.209 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.73 -49.98 47.98 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.096 -1.002 . . . . 0.0 109.008 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -62.28 -44.14 97.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.658 1.183 . . . . 0.0 109.17 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -56.41 -51.9 66.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.369 0.986 . . . . 0.0 110.233 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -62.09 -34.97 77.32 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.984 -0.447 . . . . 0.0 111.241 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 . . . . . 0 CA--C 1.536 0.434 0 C-N-CA 123.859 0.864 . . . . 0.0 110.4 179.42 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 92.3 m . . . . . 0 C--O 1.238 0.495 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . 0.426 ' HB3' ' CE2' ' D' 1109 ' ' PHE . 97.1 m-85 -118.59 131.32 56.2 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -113.1 158.19 20.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.383 1.473 . . . . 0.0 110.396 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 81.3 mt -144.06 135.82 26.12 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.42 98.87 4.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.515 1.526 . . . . 0.0 107.072 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 43.4 t -149.53 141.59 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.338 0.972 . . . . 0.0 109.627 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -92.83 103.98 16.27 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.22 108.44 0.49 Allowed Glycine 0 N--CA 1.465 0.627 0 CA-C-O 114.937 -3.146 . . . . 0.0 112.729 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -67.61 -58.21 5.08 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 123.55 3.675 . . . . 0.0 112.455 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -66.82 -43.08 84.71 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.294 -0.879 . . . . 0.0 110.012 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -57.63 -47.29 82.62 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.346 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -63.39 -41.73 98.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 120.302 1.41 . . . . 0.0 111.706 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -56.67 -52.39 65.11 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.718 1.144 . . . . 0.0 110.437 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.32 -52.6 53.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 C-N-CA 124.772 1.229 . . . . 0.0 110.788 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . 0.413 ' CD1' ' HZ2' ' D' 1116 ' ' LYS . 64.1 mt -61.94 -29.44 70.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 117.564 -1.208 . . . . 0.0 111.77 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 mtp -69.68 -52.33 26.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.69 1.586 . . . . 0.0 107.524 178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -51.7 -51.82 53.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.223 0.952 . . . . 0.0 108.706 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 65.0 mt -68.99 -35.87 77.19 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -61.51 -52.13 65.74 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 120.371 1.442 . . . . 0.0 107.488 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.13 -38.05 89.38 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 124.235 0.959 . . . . 0.0 109.891 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 5.4 t -52.8 -55.05 25.75 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.144 0.978 . . . . 0.0 110.52 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.47 -33.32 71.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.076 -0.964 . . . . 0.0 112.493 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -44.53 92.0 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.852 1.205 . . . . 0.0 108.409 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 54.9 mt -67.07 -48.23 68.86 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 9.6 tpt -58.67 -26.92 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.173 0.897 . . . . 0.0 110.83 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -79.63 -44.69 20.49 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.261 1.024 . . . . 0.0 111.052 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -79.41 -26.1 41.95 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.047 1.294 . . . . 0.0 114.279 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -94.95 148.52 34.85 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.953 1.701 . . . . 0.0 108.916 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -73.36 179.86 5.1 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.735 2.29 . . . . 0.0 110.746 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 16.6 mp0 -121.2 44.27 0.73 Allowed Pre-proline 0 CA--C 1.563 1.47 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -63.4 -48.67 5.59 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.217 2.611 . . . . 0.0 115.284 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 69.4 tp -62.93 -41.86 99.61 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.551 1.068 . . . . 0.0 108.973 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 1.8 t -51.76 -48.68 37.86 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 C-N-CA 125.452 1.501 . . . . 0.0 109.706 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -61.49 -51.11 70.03 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.684 1.193 . . . . 0.0 111.767 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.5 t -62.79 -50.17 72.07 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.946 -0.471 . . . . 0.0 110.595 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -61.91 -36.12 80.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.597 1.559 . . . . 0.0 110.182 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -59.98 -48.63 80.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.31 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -69.13 -49.8 53.76 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.822 0.737 . . . . 0.0 111.706 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -54.15 -46.05 72.16 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.692 1.197 . . . . 0.0 111.185 -178.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -80.25 -27.67 38.62 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.928 0.891 . . . . 0.0 110.843 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -57.64 -39.66 77.48 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.184 1.357 . . . . 0.0 108.625 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.3 mt -58.66 -17.28 21.1 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.123 0.969 . . . . 0.0 112.459 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.541 0.62 0 CA-C-N 119.579 1.081 . . . . 0.0 111.985 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.6 tp10 . . . . . 0 C--O 1.233 0.226 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.01 95.06 0.11 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.56 1.544 . . . . 0.0 110.352 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.6 mt -94.44 135.73 35.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -104.98 152.65 22.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.28 1.032 . . . . 0.0 109.276 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 55.6 tp -146.68 102.75 3.94 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.999 1.32 . . . . 0.0 109.808 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -84.25 129.64 4.51 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.291 2.661 . . . . 0.0 110.979 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.6 t -144.44 150.91 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.816 1.247 . . . . 0.0 107.65 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.66 99.04 3.95 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.771 1.623 . . . . 0.0 109.586 177.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -170.29 137.01 4.23 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 116.773 -2.126 . . . . 0.0 107.875 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -70.62 -52.03 24.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 121.429 2.614 . . . . 0.0 112.076 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.65 -41.41 88.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.893 0.77 . . . . 0.0 110.79 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -51.73 66.95 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 126.006 1.722 . . . . 0.0 108.742 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 36.4 t80 -68.38 -49.6 58.96 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.009 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.41 -56.8 13.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.809 1.244 . . . . 0.0 112.78 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.73 -48.44 81.68 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.236 1.015 . . . . 0.0 110.656 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.88 -39.41 91.83 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 119.09 -0.481 . . . . 0.0 111.058 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.28 -47.4 79.66 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.405 -0.807 . . . . 0.0 109.293 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.51 -49.21 73.19 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.416 0.553 . . . . 0.0 110.88 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 82.4 mt -65.41 -51.24 66.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 123.698 0.799 . . . . 0.0 110.027 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -54.22 -55.55 26.97 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.609 1.164 . . . . 0.0 110.182 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.26 -42.71 95.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.329 -178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 8.3 t -58.09 -51.16 70.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.519 0.6 . . . . 0.0 109.532 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.28 -49.04 71.07 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.13 -53.12 60.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.977 0.911 . . . . 0.0 111.296 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.25 -42.47 93.27 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.015 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 16.0 tmm? -58.12 -47.25 83.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.383 0.673 . . . . 0.0 110.324 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -78.69 -18.97 53.52 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.114 0.87 . . . . 0.0 112.7 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 15.0 t80 -83.63 -53.41 5.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 119.422 1.01 . . . . 0.0 113.178 -177.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.536 0.424 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -177.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 8.4 m-70 . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 14.1 m -67.1 -51.64 51.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.813 1.245 . . . . 0.0 109.767 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 69.9 mt -60.2 -41.93 88.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.599 0.76 . . . . 0.0 109.833 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.2 -58.33 8.41 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 87.4 m -66.15 -37.08 84.8 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.354 1.061 . . . . 0.0 112.225 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.89 -54.3 46.71 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.25 1.02 . . . . 0.0 109.162 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 54.7 ttt-85 -73.43 -31.95 64.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.118 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -63.57 -57.22 10.83 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 109.037 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -65.62 -34.37 78.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.15 -0.929 . . . . 0.0 111.335 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -61.26 -54.95 37.54 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.12 1.327 . . . . 0.0 108.73 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -63.72 -33.18 75.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.853 0.461 . . . . 0.0 111.347 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 . . . . . 0 CA--C 1.528 0.11 0 C-N-CA 124.204 1.002 . . . . 0.0 109.74 179.313 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 3.9 m . . . . . 0 C--O 1.24 0.6 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -109.96 142.28 41.56 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -128.31 152.89 47.61 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.144 0.978 . . . . 0.0 111.033 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.3 mt -146.03 138.7 25.59 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.031 1.333 . . . . 0.0 107.538 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.24 105.59 5.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.816 1.247 . . . . 0.0 108.996 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 94.7 t -152.11 150.65 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 125.221 1.408 . . . . 0.0 108.925 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.15 101.78 10.79 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.743 1.156 . . . . 0.0 109.836 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.33 106.64 0.41 Allowed Glycine 0 N--CA 1.461 0.364 0 CA-C-O 114.922 -3.155 . . . . 0.0 107.034 177.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -59.0 -57.6 12.34 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 122.454 3.127 . . . . 0.0 114.92 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -65.02 -47.02 78.95 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.395 0.678 . . . . 0.0 109.897 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -62.11 -41.57 98.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.221 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1109 ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' B' ' 99' ' ' TYR . 80.2 t80 -66.41 -41.48 89.24 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 119.996 1.271 . . . . 0.0 111.188 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.18 -52.79 63.12 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.7 mt -58.07 -53.64 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 C-N-CA 124.417 1.087 . . . . 0.0 109.162 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 39.1 mt -56.36 -34.82 67.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 117.625 -1.179 . . . . 0.0 111.447 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.3 mtp -70.52 -43.85 68.75 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.815 1.643 . . . . 0.0 108.585 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -55.34 -51.37 66.97 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 54.0 mt -70.07 -33.28 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.335 1.054 . . . . 0.0 112.964 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1116 ' ' LYS . . . . . 0.413 ' HZ2' ' CD1' ' B' ' 112' ' ' LEU . 11.0 tppt? -60.45 -60.15 4.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.246 1.385 . . . . 0.0 108.826 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.58 -38.07 89.72 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 117.402 -1.285 . . . . 0.0 109.116 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.4 t -52.41 -50.16 63.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 121.266 1.848 . . . . 0.0 111.757 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.88 -42.12 73.86 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.41 0.55 . . . . 0.0 111.322 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.47 87.7 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.344 0.658 . . . . 0.0 110.271 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.28 -48.42 34.77 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.826 1.65 . . . . 0.0 109.676 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.6 tpt -59.77 -30.54 68.94 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.938 1.245 . . . . 0.0 110.199 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -75.93 -41.63 51.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.325 1.05 . . . . 0.0 110.454 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.48 -32.45 54.31 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.391 0.996 . . . . 0.0 112.199 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -81.87 147.9 59.62 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.63 1.172 . . . . 0.0 108.723 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.24 172.13 13.68 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 N-CA-C 107.582 -1.738 . . . . 0.0 107.582 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -120.85 58.38 6.75 Favored Pre-proline 0 CA--C 1.546 0.812 0 O-C-N 120.676 -1.265 . . . . 0.0 111.43 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -73.29 -59.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.682 2.921 . . . . 0.0 113.749 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.8 -40.9 85.41 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -51.07 -48.03 30.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 0.0 109.53 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 10.8 t70 -65.32 -46.73 79.16 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -49.51 77.57 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.0 t80 -59.38 -44.18 92.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.346 1.458 . . . . 0.0 109.582 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -54.85 -48.82 72.42 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.269 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -68.84 -48.37 63.67 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 119.609 1.095 . . . . 0.0 111.958 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -57.26 -38.42 73.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.811 0.845 . . . . 0.0 110.283 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -81.34 -28.26 34.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.726 1.611 . . . . 0.0 110.963 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -60.36 -37.24 80.09 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.26 -9.92 5.92 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.543 0.697 0 C-N-CA 125.647 1.579 . . . . 0.0 109.926 178.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 . . . . . 0 CA--C 1.537 0.474 0 CA-C-O 119.423 -0.322 . . . . 0.0 111.556 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 14.4 tp -134.29 108.44 8.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -115.07 168.62 9.76 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 120.226 1.375 . . . . 0.0 110.25 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -145.25 138.18 26.28 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.192 1.397 . . . . 0.0 107.417 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -112.0 97.97 40.38 Favored Pre-proline 0 C--O 1.232 0.165 0 CA-C-O 118.126 -0.94 . . . . 0.0 110.58 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.2 119.76 6.36 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.118 1.878 . . . . 0.0 107.316 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.6 t -143.59 148.57 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.282 1.033 . . . . 0.0 108.77 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.3 100.27 4.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.07 111.27 0.44 Allowed Glycine 0 C--O 1.226 -0.389 0 CA-C-O 116.463 -2.299 . . . . 0.0 108.036 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -59.8 -48.95 79.64 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 122.017 2.908 . . . . 0.0 112.564 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.7 -32.04 67.39 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.056 0.455 . . . . 0.0 109.907 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.6 m -65.26 -45.14 85.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.082 1.353 . . . . 0.0 109.272 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -61.35 -48.59 80.58 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.294 1.837 . . . . 0.0 109.437 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -53.7 -48.2 69.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.437 0.637 . . . . 0.0 110.416 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -67.8 -45.26 75.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.915 -0.491 . . . . 0.0 111.221 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.2 tp -62.65 -47.47 83.59 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 123.566 0.746 . . . . 0.0 112.876 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.44 -47.11 80.29 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.085 0.554 . . . . 0.0 109.987 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.69 -45.92 85.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.625 0.648 . . . . 0.0 111.287 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 65.2 mt -62.36 -52.61 57.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -57.15 -45.74 83.34 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 123.938 0.895 . . . . 0.0 111.47 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -58.9 -51.98 67.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.903 -0.57 . . . . 0.0 110.061 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.0 p -61.15 -40.39 93.67 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -67.25 -55.54 13.57 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.692 0.797 . . . . 0.0 109.481 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -56.94 -40.89 77.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.959 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.27 -47.49 85.77 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 119.903 1.229 . . . . 0.0 111.161 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.7 tmm? -57.69 -27.83 63.26 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.569 0.622 . . . . 0.0 110.164 178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -89.55 -27.11 20.48 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.255 -0.903 . . . . 0.0 110.921 178.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.59 -35.08 46.27 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 120.372 1.442 . . . . 0.0 110.35 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 72.9 mt . . . . . 0 CA--C 1.535 0.381 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 179.16 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.2 t60 . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.7 m -65.21 -46.83 79.08 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.116 1.325 . . . . 0.0 109.867 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.34 -34.75 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.932 1.293 . . . . 0.0 110.733 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -63.24 -51.49 66.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.32 1.048 . . . . 0.0 108.444 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.05 -37.98 84.55 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.35 0.523 . . . . 0.0 111.999 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -53.18 61.26 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -34.98 77.05 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.586 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -57.87 -57.1 14.26 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -54.64 -41.1 69.67 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.455 1.025 . . . . 0.0 110.102 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -57.99 -54.5 46.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.174 0.59 . . . . 0.0 111.519 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -71.94 -35.83 69.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.507 0.594 . . . . 0.0 111.497 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 . . . . . 0 C--O 1.225 -0.218 0 C-N-CA 124.98 1.312 . . . . 0.0 111.031 -179.661 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.538 0.496 0 N-CA-C 105.239 -2.134 . . . . 0.0 105.239 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -100.96 130.11 46.9 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -105.92 129.84 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.938 1.695 . . . . 0.0 107.128 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.08 150.18 48.36 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -146.33 105.65 3.92 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.951 1.3 . . . . 0.0 113.508 -177.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.4 t -150.48 149.76 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.272 1.396 . . . . 0.0 109.401 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.57 99.27 6.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 121.353 1.888 . . . . 0.0 109.241 178.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.16 133.43 5.29 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 108.125 -1.99 . . . . 0.0 108.125 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -67.93 -58.36 4.67 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 119.563 1.681 . . . . 0.0 112.55 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -67.86 -42.48 81.27 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -51.86 -50.37 61.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.973 1.709 . . . . 0.0 111.442 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -69.67 -51.39 35.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 117.774 -1.108 . . . . 0.0 112.0 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.09 -54.45 24.86 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.125 0.97 . . . . 0.0 112.651 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.21 -55.35 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 123.413 0.685 . . . . 0.0 110.804 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 89.6 mt -64.9 -28.49 69.57 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -52.02 20.62 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.86 1.209 . . . . 0.0 108.114 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -52.59 -50.53 62.85 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 19.3 mt -63.19 -36.12 82.58 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.032 -0.985 . . . . 0.0 112.14 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 11.1 tppt? -58.18 -56.59 20.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 120.404 1.456 . . . . 0.0 109.324 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.15 -33.74 76.48 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 119.232 -0.413 . . . . 0.0 110.618 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.3 t -63.69 -47.23 82.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.286 0.948 . . . . 0.0 109.501 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.44 -48.7 71.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.842 -1.075 . . . . 0.0 109.745 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -56.33 -39.37 72.69 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.364 0.984 . . . . 0.0 110.144 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -67.35 -47.66 69.78 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.816 -0.552 . . . . 0.0 110.093 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -68.49 -19.42 64.54 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.308 0.504 . . . . 0.0 111.757 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.68 -43.64 20.05 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.088 -1.007 . . . . 0.0 108.692 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -76.38 -32.41 58.57 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -94.87 147.57 33.33 Favored Pre-proline 0 N--CA 1.467 0.375 0 CA-C-N 119.45 1.023 . . . . 0.0 109.16 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.19 -178.41 3.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.197 1.931 . . . . 0.0 110.905 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.59 48.32 0.35 Allowed Pre-proline 0 CA--C 1.553 1.063 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 -178.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.31 -52.07 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.55 2.167 . . . . 0.0 112.593 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.53 -33.82 73.22 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.502 0.592 . . . . 0.0 109.624 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.14 -43.17 98.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -50.96 71.26 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.721 0.809 . . . . 0.0 111.202 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 74.0 m -66.85 -46.77 74.0 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -58.64 -43.9 89.88 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.733 0.813 . . . . 0.0 109.923 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -48.09 81.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 118.291 -0.861 . . . . 0.0 109.999 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.5 -54.85 40.48 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 118.766 0.712 . . . . 0.0 109.826 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -50.14 66.07 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.435 1.094 . . . . 0.0 111.632 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -65.13 -39.61 93.27 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.337 1.055 . . . . 0.0 110.62 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -56.67 -40.23 75.16 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.183 0.901 . . . . 0.0 109.936 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.4 mt -60.07 -24.39 64.54 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.528 0.731 . . . . 0.0 112.463 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.19 0 C-N-CA 123.854 0.862 . . . . 0.0 112.94 -179.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 CA--C 1.538 0.512 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -90.2 101.72 14.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -105.02 167.26 9.82 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.71 137.66 38.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 94.25 23.41 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.16 122.38 9.22 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.735 2.29 . . . . 0.0 108.508 178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 84.4 t -144.67 148.04 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 125.0 1.32 . . . . 0.0 108.496 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.56 101.86 5.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -169.7 128.28 1.63 Allowed Glycine 0 CA--C 1.524 0.612 0 CA-C-O 115.404 -2.887 . . . . 0.0 109.714 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 36.0 mmm-85 -69.91 -50.3 43.51 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 123.25 3.525 . . . . 0.0 111.45 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -69.25 -36.96 77.7 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -58.19 -52.08 67.05 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 125.455 1.502 . . . . 0.0 110.112 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.2 t80 -63.39 -47.37 82.3 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.276 1.03 . . . . 0.0 110.244 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -53.19 -57.48 10.33 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -40.3 90.42 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.239 0.615 . . . . 0.0 111.566 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.55 -44.01 93.38 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.812 -0.613 . . . . 0.0 110.02 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.02 -48.0 72.57 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.89 0.876 . . . . 0.0 109.813 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.32 -48.63 73.87 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.951 0.5 . . . . 0.0 110.362 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 97.8 mt -65.08 -50.36 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -50.46 -46.55 56.81 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.37 1.068 . . . . 0.0 110.315 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.87 -49.65 67.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.322 -0.847 . . . . 0.0 111.402 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 87.2 p -56.0 -38.87 71.05 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.593 1.088 . . . . 0.0 113.073 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -73.02 -45.83 55.48 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -57.54 -39.15 75.97 Favored 'General case' 0 C--N 1.342 0.265 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -64.04 -45.1 90.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 116.741 -1.6 . . . . 0.0 110.938 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 26.5 ttm -58.49 -43.58 89.07 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.822 1.192 . . . . 0.0 108.381 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -65.67 -34.5 78.35 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.419 0.688 . . . . 0.0 112.251 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -81.09 -36.82 29.9 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.726 1.148 . . . . 0.0 111.806 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 50.1 mt . . . . . 0 CA--C 1.545 0.751 0 C-N-CA 126.016 1.726 . . . . 0.0 111.115 -178.636 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 1.9 t60 . . . . . 0 CA--C 1.537 0.46 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 17.3 m -62.3 -40.53 96.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.391 1.077 . . . . 0.0 110.89 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.92 -43.8 93.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.11 -47.54 84.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.751 -1.118 . . . . 0.0 108.764 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -35.95 64.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.358 1.435 . . . . 0.0 111.929 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -53.91 32.13 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -36.63 84.64 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.727 -0.608 . . . . 0.0 111.06 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -59.31 -48.13 82.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.907 1.283 . . . . 0.0 108.75 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -63.09 -44.31 96.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.514 1.052 . . . . 0.0 109.173 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -55.03 -43.03 73.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.996 0.919 . . . . 0.0 110.623 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.56 -42.75 58.23 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.104 0.962 . . . . 0.0 110.326 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 . . . . . 0 C--O 1.224 -0.262 0 C-N-CA 123.938 0.895 . . . . 0.0 110.777 -179.853 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 17.3 m . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -101.89 128.99 48.04 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -106.58 155.28 19.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -152.48 127.97 10.01 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -119.93 106.2 11.81 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.026 2.13 . . . . 0.0 112.058 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 21.2 t -155.35 150.1 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.962 1.305 . . . . 0.0 110.37 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.44 103.37 11.46 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.7 116.98 1.2 Allowed Glycine 0 CA--C 1.51 -0.23 0 N-CA-C 104.615 -3.394 . . . . 0.0 104.615 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -65.76 -57.7 7.38 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.092 1.946 . . . . 0.0 113.644 -177.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -71.99 -38.85 69.58 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 119.424 1.011 . . . . 0.0 108.414 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -54.73 -50.49 68.24 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.282 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 13.9 t80 -64.69 -42.63 95.2 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 119.562 1.073 . . . . 0.0 110.432 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.12 -54.28 38.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.055 0.843 . . . . 0.0 110.942 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.73 -57.5 10.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 126.668 1.987 . . . . 0.0 111.057 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 57.1 mt -58.89 -36.34 74.51 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.651 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.9 tmt? -70.25 -52.13 25.37 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.755 1.161 . . . . 0.0 108.778 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.1 ttmm -51.97 -51.88 54.19 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 65.7 mt -65.7 -32.34 73.84 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.152 -0.928 . . . . 0.0 112.146 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -63.33 -48.29 78.62 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.586 1.539 . . . . 0.0 108.719 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -66.67 -41.53 88.0 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.77 -42.2 75.15 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.513 0.725 . . . . 0.0 110.267 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.88 -52.45 50.07 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.093 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.01 -43.01 86.44 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.588 1.086 . . . . 0.0 110.355 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.5 mm? -61.42 -48.97 78.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.44 0.696 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.45 -28.0 67.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.063 -0.398 . . . . 0.0 111.585 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -80.31 -23.29 40.76 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 126.693 1.997 . . . . 0.0 113.129 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -94.64 -27.51 15.84 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.287 0.635 . . . . 0.0 110.41 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 81.2 t -95.2 147.46 33.07 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 124.936 1.294 . . . . 0.0 109.111 179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -71.3 -173.11 0.86 Allowed 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.926 2.417 . . . . 0.0 110.432 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.27 35.71 0.11 Allowed Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 117.749 2.5 . . . . 0.0 117.749 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.73 -51.41 4.97 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 123.446 2.267 . . . . 0.0 114.281 -178.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.26 -40.14 92.97 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.0 t -57.56 -47.77 84.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.434 0 C-N-CA 123.668 0.787 . . . . 0.0 109.406 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 44.5 t0 -60.58 -52.01 66.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.509 1.124 . . . . 0.0 110.465 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 41.3 m -60.9 -42.36 97.88 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.905 -0.497 . . . . 0.0 111.743 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.69 -52.33 39.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.914 0.886 . . . . 0.0 109.517 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.5 69.15 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.262 1.425 . . . . 0.0 111.193 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -67.32 -47.98 68.95 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.492 1.042 . . . . 0.0 110.86 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -58.86 -42.53 89.64 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.224 0.92 . . . . 0.0 109.692 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -65.18 -32.68 74.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.312 1.445 . . . . 0.0 109.2 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -59.54 -44.3 93.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.7 mt -64.39 -11.22 30.58 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.482 1.113 . . . . 0.0 113.577 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 13.2 tp . . . . . 0 CA--C 1.535 0.393 0 CA-C-N 119.726 1.148 . . . . 0.0 110.167 178.853 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 121.151 0.5 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tp -73.12 106.18 4.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.48 161.08 15.38 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -136.32 116.41 13.37 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.425 2.29 . . . . 0.0 105.797 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.82 105.16 15.4 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -75.23 117.13 4.75 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.325 2.683 . . . . 0.0 110.272 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.7 t -145.11 150.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 123.563 0.745 . . . . 0.0 109.532 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -135.11 102.21 5.12 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.862 -1.149 . . . . 0.0 109.837 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.0 135.2 3.53 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 107.529 -2.229 . . . . 0.0 107.529 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -70.78 -52.25 21.85 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.561 2.181 . . . . 0.0 110.419 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -30.81 64.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.68 1.192 . . . . 0.0 108.888 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.4 m -60.89 -49.92 75.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.74 1.216 . . . . 0.0 107.739 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -62.86 -39.9 95.84 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.264 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.46 -57.41 11.31 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.013 0.824 . . . . 0.0 111.704 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 35.6 ttm -57.71 -44.7 86.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.597 0.635 . . . . 0.0 110.359 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.6 mt -59.54 -48.57 81.15 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.382 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.76 -40.95 88.46 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.576 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.18 -49.45 76.99 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.247 1.385 . . . . 0.0 109.56 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.5 mt -67.15 -51.57 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.701 -0.625 . . . . 0.0 109.769 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -56.69 -48.56 77.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 117.814 -1.089 . . . . 0.0 112.146 -178.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.19 -55.79 30.37 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.4 m -56.74 -36.36 69.66 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.49 -37.89 50.29 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.981 0.81 . . . . 0.0 111.925 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -63.8 -50.36 69.27 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.269 -0.895 . . . . 0.0 108.692 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.3 mt -61.08 -52.08 66.44 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.861 1.265 . . . . 0.0 111.376 -179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.3 ppp? -56.93 -45.9 82.42 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.267 0.939 . . . . 0.0 111.854 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -74.34 -29.37 61.56 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.254 0.934 . . . . 0.0 112.879 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -71.03 -47.15 60.25 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.955 0.798 . . . . 0.0 110.425 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.1 tp . . . . . 0 CA--C 1.54 0.574 0 C-N-CA 124.855 1.262 . . . . 0.0 108.741 -179.337 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 . . . . . 0 C--O 1.224 -0.284 0 CA-C-O 118.52 -0.752 . . . . 0.0 112.267 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -58.2 -51.26 70.5 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.485 1.039 . . . . 0.0 110.766 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.32 -42.26 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.904 1.682 . . . . 0.0 109.704 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.56 -42.82 67.35 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.417 0.687 . . . . 0.0 111.535 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.281 1.433 . . . . 0.0 109.912 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.67 -51.11 70.76 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -55.23 -48.51 73.81 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.412 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -56.91 -42.07 79.26 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.75 0.82 . . . . 0.0 110.818 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -55.04 -54.76 38.95 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.777 1.231 . . . . 0.0 111.497 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -78.23 -40.76 36.37 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.339 0.518 . . . . 0.0 111.709 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -55.61 -41.09 72.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.51 1.124 . . . . 0.0 111.713 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 . . . . . 0 CA--C 1.534 0.33 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.159 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -102.4 130.28 49.11 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.59 116.94 27.06 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.567 1.147 . . . . 0.0 108.4 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.52 141.34 35.51 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -140.47 104.35 4.75 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.0 m -155.49 150.57 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 112.011 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -110.75 101.92 10.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.214 1.37 . . . . 0.0 108.187 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.66 116.13 0.91 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-O 116.763 -2.132 . . . . 0.0 108.916 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -66.88 -57.14 7.57 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 121.717 2.759 . . . . 0.0 113.425 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -66.29 -44.63 82.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . 0.501 ' HB3' ' HZ2' ' D' 1116 ' ' LYS . 16.1 m-20 -52.12 -50.51 61.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 125.756 1.622 . . . . 0.0 110.908 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -63.97 -47.07 81.85 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.942 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -51.21 -53.87 30.97 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 124.063 0.852 . . . . 0.0 110.427 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.7 mt -60.17 -58.22 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 125.251 1.42 . . . . 0.0 110.494 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mp -55.62 -44.24 76.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 117.824 -1.084 . . . . 0.0 113.232 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 22.4 ttp -62.73 -48.07 80.84 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 119.907 1.231 . . . . 0.0 109.961 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -55.76 -50.94 69.06 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 118.428 0.558 . . . . 0.0 110.274 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 mt -65.51 -30.73 71.53 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 24.8 tptt -64.51 -60.0 3.66 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.65 -44.6 81.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.194 0.998 . . . . 0.0 110.896 -179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 31.0 t -52.55 -46.45 66.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.041 0.937 . . . . 0.0 110.33 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.67 -45.88 56.66 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.984 0.514 . . . . 0.0 111.204 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -56.34 -39.88 73.56 Favored 'General case' 0 C--O 1.238 0.473 0 O-C-N 121.672 -0.642 . . . . 0.0 110.343 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.75 -53.88 23.75 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.137 0.975 . . . . 0.0 108.523 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.31 -39.69 67.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.833 0.742 . . . . 0.0 112.401 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -73.3 -29.27 62.6 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.372 1.069 . . . . 0.0 110.4 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 20.8 tp -86.31 -33.23 20.67 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.853 -1.154 . . . . 0.0 113.643 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 12.4 m -94.97 148.27 34.43 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 120.019 1.281 . . . . 0.0 110.883 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.62 -174.93 1.19 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.187 1.925 . . . . 0.0 109.066 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -113.58 82.13 6.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 O-C-N 121.614 -0.678 . . . . 0.0 112.244 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -80.86 -102.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.494 0 C-N-CA 124.181 3.254 . . . . 0.0 111.873 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.27 -35.7 65.31 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.541 -1.35 . . . . 0.0 109.99 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.7 m -56.39 -37.03 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 C-N-CA 124.351 1.06 . . . . 0.0 112.581 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.29 -46.67 22.27 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 6.1 m -56.23 -42.46 77.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 123.385 0.428 . . . . 0.0 110.329 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -67.78 -50.53 56.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 126.168 1.787 . . . . 0.0 108.315 178.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -52.85 -47.74 67.55 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.601 1.091 . . . . 0.0 111.134 -178.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.85 -42.2 86.12 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.172 0.897 . . . . 0.0 112.559 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.84 -38.28 82.97 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.525 -0.734 . . . . 0.0 110.517 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -46.81 78.0 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.53 -35.11 65.31 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.55 1.54 . . . . 0.0 110.975 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.32 -24.47 29.07 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.356 1.434 . . . . 0.0 111.832 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.4 tt . . . . . 0 CA--C 1.532 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 110.265 179.222 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.1 tp -69.19 95.53 0.76 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.85 0.86 . . . . 0.0 109.247 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.21 170.97 9.02 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.739 1.216 . . . . 0.0 109.519 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -146.12 154.62 42.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.973 1.309 . . . . 0.0 108.532 179.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -125.36 91.97 47.91 Favored Pre-proline 0 N--CA 1.45 -0.439 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.94 112.4 3.28 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.592 2.194 . . . . 0.0 107.033 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 46.7 t -144.83 155.7 14.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -135.44 103.76 5.59 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.67 112.69 0.51 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 105.62 -2.992 . . . . 0.0 105.62 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -59.49 -51.91 67.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 122.172 2.986 . . . . 0.0 108.615 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -71.04 -39.95 72.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.221 1.009 . . . . 0.0 111.145 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -63.51 -42.16 98.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.45 0.7 . . . . 0.0 110.261 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 71.2 t80 -61.68 -45.14 95.29 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.769 1.228 . . . . 0.0 108.89 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -56.64 -50.43 72.08 Favored 'General case' 0 N--CA 1.462 0.161 0 O-C-N 123.28 0.363 . . . . 0.0 110.857 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.3 ttm -64.79 -46.08 83.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.117 0.567 . . . . 0.0 111.293 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 46.9 mt -60.46 -46.48 89.91 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.403 -178.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.69 -49.04 70.0 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.265 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.91 -49.7 70.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.388 0.675 . . . . 0.0 111.468 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 79.2 mt -70.17 -39.27 76.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.647 -0.658 . . . . 0.0 110.372 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -61.26 -45.47 94.37 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.56 0.744 . . . . 0.0 110.752 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -52.26 65.89 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.0 0.92 . . . . 0.0 108.654 -179.112 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 26.7 m -58.1 -45.87 86.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 123.479 0.712 . . . . 0.0 112.33 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.43 -36.39 81.14 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.869 0.758 . . . . 0.0 111.099 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.59 -48.49 66.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 121.638 -0.664 . . . . 0.0 111.421 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.47 -40.66 70.13 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.071 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 5.2 ppp? -62.49 -40.22 95.99 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.316 0.962 . . . . 0.0 109.928 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -76.21 -34.89 59.27 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 118.961 0.8 . . . . 0.0 111.438 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 59.9 t80 -69.56 -40.06 77.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.088 0.858 . . . . 0.0 112.626 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 28.4 tp . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.735 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 5.9 m-70 . . . . . 0 N--CA 1.466 0.352 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.0 m -56.31 -52.23 65.28 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.697 1.135 . . . . 0.0 110.22 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.96 -46.21 92.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 128.243 2.617 . . . . 0.0 111.424 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -69.87 -47.5 62.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.809 -0.615 . . . . 0.0 111.642 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.7 m -55.12 -39.28 69.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.81 0.844 . . . . 0.0 109.062 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -53.58 49.23 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.272 0.629 . . . . 0.0 110.695 178.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -57.49 -44.27 84.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 118.795 -0.621 . . . . 0.0 110.046 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -54.61 -44.09 72.77 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.147 0.579 . . . . 0.0 110.208 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -61.83 -55.29 31.41 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.0 -44.06 73.55 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.86 0.755 . . . . 0.0 112.602 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -55.99 -36.36 67.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.521 1.529 . . . . 0.0 112.308 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 . . . . . 0 CA--C 1.536 0.429 0 CA-C-N 118.635 0.652 . . . . 0.0 110.862 -179.744 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.236 0.349 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -102.38 157.23 17.06 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -137.27 158.02 45.35 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.96 0.504 . . . . 0.0 109.728 -179.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 1.3 mt -152.51 108.68 3.39 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -102.08 98.74 8.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.13 2.572 . . . . 0.0 105.874 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.3 m -151.86 151.43 12.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 C-N-CA 124.783 1.233 . . . . 0.0 110.046 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -122.26 102.35 8.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 118.994 0.815 . . . . 0.0 112.056 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.42 113.37 0.79 Allowed Glycine 0 CA--C 1.504 -0.621 0 N-CA-C 105.179 -3.168 . . . . 0.0 105.179 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.39 -56.85 16.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 119.667 1.734 . . . . 0.0 110.623 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 37.9 mttp -62.62 -49.31 75.69 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.289 1.036 . . . . 0.0 108.624 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -52.46 -49.54 64.44 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.89 1.276 . . . . 0.0 111.251 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.5 t80 -65.12 -39.92 93.76 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 119.412 1.005 . . . . 0.0 111.77 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -54.57 -53.56 52.91 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.209 0.913 . . . . 0.0 108.805 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 37.8 mt -62.38 -57.79 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.998 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.66 -45.38 81.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 116.953 -1.499 . . . . 0.0 113.81 -178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 2.0 ttt -61.79 -49.0 78.09 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 120.851 1.66 . . . . 0.0 109.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -57.31 -52.06 66.87 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.47 -25.89 66.93 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.778 -0.576 . . . . 0.0 112.122 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1116 ' ' LYS . . . . . 0.501 ' HZ2' ' HB3' ' B' ' 108' ' ' ASN . 12.4 tptt -63.06 -60.54 3.3 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 118.901 0.773 . . . . 0.0 109.303 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.98 -31.95 73.44 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 124.679 1.237 . . . . 0.0 111.459 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 33.4 t -55.16 -51.99 64.72 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.016 0.826 . . . . 0.0 109.173 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.22 -42.89 79.12 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 122.197 0.199 . . . . 0.0 110.878 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -59.19 -45.0 92.22 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.531 -0.73 . . . . 0.0 110.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 30.6 mt -65.78 -53.82 35.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.189 0.995 . . . . 0.0 109.773 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.66 -34.24 69.17 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.885 0.766 . . . . 0.0 110.834 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -79.04 -22.21 45.74 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.712 1.142 . . . . 0.0 110.369 178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 48.9 tp -90.48 -34.3 15.63 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 120.688 -1.257 . . . . 0.0 113.124 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 13.8 m -95.28 147.45 33.04 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 119.763 1.165 . . . . 0.0 110.832 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.0 178.04 5.78 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.075 1.85 . . . . 0.0 108.721 178.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -108.89 87.85 4.93 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -84.98 -100.45 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.327 0 C-N-CA 124.048 3.165 . . . . 0.0 108.884 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.8 -32.99 64.0 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 126.545 1.938 . . . . 0.0 111.269 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.1 m -56.9 -41.33 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 118.869 0.758 . . . . 0.0 110.755 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -74.68 -45.45 44.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.416 1.086 . . . . 0.0 109.425 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 43.5 m -61.31 -38.47 86.98 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 20.2 t80 -67.28 -52.58 38.97 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.911 1.285 . . . . 0.0 107.699 178.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -48.24 69.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.394 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -61.71 -53.9 49.79 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.819 0.736 . . . . 0.0 111.42 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -58.14 -40.51 81.52 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.806 -0.558 . . . . 0.0 111.425 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.69 -33.61 71.1 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.852 0.861 . . . . 0.0 110.144 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.64 -32.86 73.97 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.912 1.285 . . . . 0.0 108.912 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 77.3 mt -54.75 -25.31 26.95 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.112 0.869 . . . . 0.0 112.387 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.535 0.375 0 C-N-CA 125.219 1.408 . . . . 0.0 111.054 -179.94 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 . . . . . 0 CA--C 1.534 0.344 0 CA-C-O 120.04 -0.028 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 47.6 tp -72.0 118.01 14.34 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.832 0.853 . . . . 0.0 108.777 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.2 mp -113.92 162.45 16.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.369 1.867 . . . . 0.0 107.388 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -135.23 124.25 24.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.13 96.05 1.13 Allowed Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.49 1.516 . . . . 0.0 108.782 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.31 103.51 1.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.489 2.793 . . . . 0.0 112.021 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -138.61 156.16 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.514 -1.366 . . . . 0.0 109.14 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -135.31 103.11 5.39 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 104.743 -2.317 . . . . 0.0 104.743 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 114.53 0.59 Allowed Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 106.716 -2.554 . . . . 0.0 106.716 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.0 tpt85 -64.52 -51.04 64.95 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 120.519 2.16 . . . . 0.0 110.535 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.46 -32.47 71.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.805 0.73 . . . . 0.0 110.684 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -66.64 -50.93 61.35 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 110.28 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -56.87 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.877 0.871 . . . . 0.0 109.015 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -55.65 -49.5 72.74 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.418 0.287 . . . . 0.0 110.587 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.6 ttm -61.17 -47.25 87.04 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.67 0.668 . . . . 0.0 111.281 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.64 -32.07 73.44 Favored 'General case' 0 C--O 1.227 -0.099 0 CA-C-O 118.53 -0.748 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -71.23 -53.97 12.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.468 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.05 -48.83 77.59 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.121 0.968 . . . . 0.0 111.181 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.0 mt -71.98 -36.96 59.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 O-C-N 121.527 -0.733 . . . . 0.0 111.574 -178.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -66.31 -52.44 47.21 Favored 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 121.063 -1.023 . . . . 0.0 109.228 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.64 -37.31 87.14 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.938 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -56.13 -52.11 65.5 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.289 0.95 . . . . 0.0 109.459 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -65.98 -48.43 71.27 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.11 0.564 . . . . 0.0 111.666 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -50.59 73.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-N 118.416 0.553 . . . . 0.0 111.149 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.11 -38.86 92.6 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 117.692 -1.147 . . . . 0.0 109.786 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.43 -28.94 67.41 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.22 1.008 . . . . 0.0 110.208 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -90.98 -30.79 16.62 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.468 -0.77 . . . . 0.0 111.018 178.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -78.67 -25.32 44.87 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 118.149 -0.929 . . . . 0.0 113.206 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 179.309 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.0 m170 . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.2 m -66.6 -32.58 74.01 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.55 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.0 mm -62.27 -47.42 93.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.99 -53.94 51.86 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.661 0.785 . . . . 0.0 110.909 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.6 m -58.08 -50.17 74.38 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.384 1.874 . . . . 0.0 110.51 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.97 -49.41 77.96 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.507 0.723 . . . . 0.0 110.014 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.0 mtp85 -58.92 -43.19 91.05 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -61.32 -55.06 36.02 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.317 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -53.19 -54.31 37.76 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.924 0.89 . . . . 0.0 110.381 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -53.6 -47.92 69.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.037 1.335 . . . . 0.0 111.153 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -67.42 -46.09 74.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.71 0.804 . . . . 0.0 111.484 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 . . . . . 0 CA--C 1.528 0.1 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.023 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 N--CA 1.465 0.321 0 N-CA-C 107.977 -1.119 . . . . 0.0 107.977 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -111.0 139.57 46.24 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -124.75 144.1 50.42 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.874 1.67 . . . . 0.0 110.691 -177.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.6 mp -131.17 145.77 52.08 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.487 1.515 . . . . 0.0 108.872 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -145.64 107.4 4.28 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.133 1.773 . . . . 0.0 108.357 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 70.7 t -155.63 151.16 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 127.306 2.242 . . . . 0.0 108.498 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -107.51 101.71 11.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 177.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.73 114.54 0.87 Allowed Glycine 0 CA--C 1.523 0.563 0 CA-C-O 116.851 -2.083 . . . . 0.0 108.092 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -68.17 -58.48 4.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.854 2.827 . . . . 0.0 113.963 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -62.74 -46.44 88.07 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -54.97 -44.53 74.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 124.302 1.001 . . . . 0.0 112.031 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -65.21 -48.58 72.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 120.078 1.308 . . . . 0.0 110.789 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -58.7 -49.44 77.58 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.645 1.111 . . . . 0.0 110.816 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 68.8 mt -61.51 -53.68 45.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.312 1.445 . . . . 0.0 111.311 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 8.8 mt -63.58 -35.83 81.79 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 117.476 -1.25 . . . . 0.0 110.573 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 30.5 mtp -62.13 -46.66 88.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 120.491 1.496 . . . . 0.0 110.87 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -64.21 -51.83 61.78 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.924 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 85.3 mt -60.68 -34.82 74.91 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.5 tppt? -63.73 -53.83 44.91 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -62.51 -45.75 91.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.7 0.625 . . . . 0.0 111.95 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 22.5 m -57.09 -38.53 73.5 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.524 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -45.28 72.59 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.851 0.751 . . . . 0.0 109.77 179.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -58.84 -44.54 90.97 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.85 -32.82 69.96 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.535 -0.728 . . . . 0.0 110.086 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 27.0 ttt -66.97 -40.99 87.6 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.73 -31.37 72.33 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 118.46 0.573 . . . . 0.0 110.638 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 tp -71.53 -34.28 69.91 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.341 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.2 m -94.51 148.95 35.82 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 119.424 1.011 . . . . 0.0 112.636 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.5 -91.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.918 0 N-CA-C 107.395 -1.809 . . . . 0.0 107.395 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -160.96 57.82 0.91 Allowed Pre-proline 0 CA--C 1.546 0.793 0 CA-C-N 120.99 1.723 . . . . 0.0 111.341 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.37 -88.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.868 2.379 . . . . 0.0 112.365 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.91 -25.77 67.3 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.365 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.6 t -56.83 -55.0 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.521 1.129 . . . . 0.0 108.712 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.16 -42.1 84.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.405 1.002 . . . . 0.0 110.53 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.6 -49.76 69.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.889 0.476 . . . . 0.0 111.256 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -70.36 -48.62 55.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.681 1.592 . . . . 0.0 110.344 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -56.54 -41.44 76.83 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.289 0.95 . . . . 0.0 110.47 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -63.58 -51.74 64.03 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.275 0.943 . . . . 0.0 108.823 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -55.3 -41.92 72.98 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.492 0.717 . . . . 0.0 109.602 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.54 -28.12 63.65 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.386 -0.821 . . . . 0.0 110.475 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -63.05 -36.36 83.32 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 34.1 mt -66.48 -2.74 4.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.798 0.839 . . . . 0.0 111.861 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 126.726 2.01 . . . . 0.0 110.11 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.8 tp10 . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 103.083 -2.932 . . . . 0.0 103.083 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.59 106.9 0.72 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.64 165.58 12.64 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 125.145 1.378 . . . . 0.0 108.973 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -135.06 149.66 50.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.251 1.421 . . . . 0.0 107.481 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.6 89.73 45.0 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.05 111.28 3.24 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.6 2.867 . . . . 0.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 50.2 t -145.61 162.28 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 124.123 0.969 . . . . 0.0 109.03 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1011 ' ' ARG . . . . . 0.414 HH11 ' HG2' ' C' 1011 ' ' ARG . 8.7 ptt-85 -134.91 104.76 6.1 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 103.438 -2.801 . . . . 0.0 103.438 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.04 108.94 0.33 Allowed Glycine 0 C--O 1.227 -0.292 0 CA-C-O 117.206 -1.886 . . . . 0.0 109.15 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 26.8 tpt85 -61.03 -52.76 63.61 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.818 2.309 . . . . 0.0 112.565 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.52 -30.83 53.06 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.348 -0.845 . . . . 0.0 112.192 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -40.29 76.82 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 41.3 t80 -62.33 -51.33 68.05 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -49.84 -57.36 7.56 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.011 0.924 . . . . 0.0 110.952 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 7.9 tmm? -60.39 -49.06 79.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.7 -34.42 78.26 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 119.15 0.886 . . . . 0.0 111.267 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.0 mm? -68.14 -48.28 65.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.542 1.065 . . . . 0.0 109.613 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -58.8 -48.78 80.08 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.317 0.647 . . . . 0.0 110.447 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.4 mt -67.79 -44.33 85.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 118.191 0.45 . . . . 0.0 111.292 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -63.08 -46.07 89.13 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 119.003 0.82 . . . . 0.0 109.028 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -60.37 -48.74 80.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.893 0.877 . . . . 0.0 108.773 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1025 ' ' SER . . . . . 0.45 ' HG ' ' HB2' ' D' 1122 ' ' MET . 20.4 t -53.45 -52.07 60.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.718 0.807 . . . . 0.0 111.247 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.44 -58.06 6.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.289 1.435 . . . . 0.0 112.831 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -46.67 88.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -177.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.29 -39.59 92.74 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 117.69 -1.148 . . . . 0.0 109.684 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -59.12 -31.75 69.22 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.034 0.833 . . . . 0.0 109.322 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -80.68 -30.56 36.48 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.846 0.748 . . . . 0.0 110.842 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -75.88 -45.63 34.49 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.318 1.047 . . . . 0.0 113.135 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 4.6 pp . . . . . 0 C--O 1.24 0.558 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -177.369 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 11.5 m170 . . . . . 0 CA--C 1.536 0.424 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 1.9 m -65.41 -36.2 83.21 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.52 -1.362 . . . . 0.0 110.948 -179.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.4 mm -59.47 -44.26 92.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 119.613 1.097 . . . . 0.0 108.209 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.29 -58.32 9.14 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.455 1.102 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 53.1 m -61.33 -31.34 71.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.609 0.764 . . . . 0.0 111.924 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.11 -53.72 18.75 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.73 -41.25 81.44 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 122.993 0.517 . . . . 0.0 110.46 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -55.67 -57.54 11.54 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.253 1.021 . . . . 0.0 110.557 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -68.2 -35.78 78.52 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.887 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -57.79 -48.6 79.23 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.391 0.996 . . . . 0.0 109.545 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -68.27 -29.81 68.69 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.492 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 . . . . . 0 CA--C 1.538 0.514 0 CA-C-N 120.248 1.386 . . . . 0.0 109.494 177.976 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 79.6 m . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.09 144.46 49.3 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.56 161.12 32.22 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.822 1.249 . . . . 0.0 112.248 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.0 mp -145.36 133.07 21.01 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.34 106.75 9.73 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 104.351 -2.463 . . . . 0.0 104.351 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 40.1 t -152.49 142.25 14.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 118.52 0.6 . . . . 0.0 109.601 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.8 100.62 9.82 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.39 115.06 0.84 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.365 -2.694 . . . . 0.0 106.365 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -57.77 10.68 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.682 2.741 . . . . 0.0 111.823 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 22.0 mmtt -63.31 -48.55 77.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -52.16 -44.17 64.48 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 123.929 0.892 . . . . 0.0 111.71 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 27.8 t80 -67.08 -50.08 62.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.061 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.33 -49.28 74.8 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.169 0.895 . . . . 0.0 110.945 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.79 -53.43 48.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 124.79 1.236 . . . . 0.0 109.61 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.75 -28.03 68.74 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.162 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 7.7 mtp -64.89 -51.8 60.0 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 120.401 1.455 . . . . 0.0 109.834 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -48.22 82.58 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 123.412 0.445 . . . . 0.0 110.245 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.211 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -55.78 -54.93 38.41 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.733 0.813 . . . . 0.0 108.896 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -58.74 -53.83 53.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.764 1.226 . . . . 0.0 110.425 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 38.2 m -56.78 -42.71 79.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.323 -0.846 . . . . 0.0 112.575 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.81 -34.8 78.98 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.761 1.164 . . . . 0.0 110.367 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -68.2 -40.35 82.21 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.85 -35.34 74.64 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.28 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1122 ' ' MET . . . . . 0.45 ' HB2' ' HG ' ' C' 1025 ' ' SER . 8.2 ttt -61.27 -49.98 74.87 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.2 -28.84 68.41 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.011 0.823 . . . . 0.0 111.301 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.8 tm? -68.97 -32.91 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.387 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 32.3 m -91.08 147.04 34.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 119.897 1.226 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -72.32 -79.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.927 2.418 . . . . 0.0 111.058 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -165.44 64.24 0.98 Allowed Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.003 1.321 . . . . 0.0 109.834 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -80.78 -106.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 123.664 2.909 . . . . 0.0 113.264 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.62 -32.12 68.73 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.757 1.223 . . . . 0.0 110.145 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 14.1 t -54.24 -53.79 26.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.124 1.37 . . . . 0.0 109.277 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.32 -40.41 95.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.795 1.638 . . . . 0.0 110.981 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -61.91 -50.6 71.54 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.67 -33.39 74.83 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.197 0.599 . . . . 0.0 109.945 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -59.17 -47.23 86.06 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -60.58 -51.99 67.05 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -53.75 -44.71 70.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.794 1.238 . . . . 0.0 112.509 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.23 -29.16 57.45 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.245 -0.909 . . . . 0.0 111.055 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 30.7 tp60 -63.89 -35.3 80.2 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.258 -0.901 . . . . 0.0 109.312 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.14 -31.94 61.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.446 0.699 . . . . 0.0 111.357 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 C-N-CA 123.405 0.682 . . . . 0.0 112.49 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 . . . . . 0 N--CA 1.453 -0.275 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.6 tp -76.7 101.58 5.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 124.206 1.002 . . . . 0.0 108.771 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.6 mt -94.53 158.67 15.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 106.76 -1.571 . . . . 0.0 106.76 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -129.69 123.04 30.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -98.07 99.34 6.81 Favored Pre-proline 0 N--CA 1.447 -0.586 0 C-N-CA 124.033 0.933 . . . . 0.0 109.346 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.06 126.85 10.19 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.383 2.056 . . . . 0.0 107.259 177.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.3 t -146.05 146.27 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 119.203 0.911 . . . . 0.0 109.825 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.6 ptt85 -135.97 101.17 4.64 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.44 130.96 2.22 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 105.209 -3.156 . . . . 0.0 105.209 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.6 tpp85 -70.18 -52.07 26.23 Favored 'General case' 0 CA--C 1.524 -0.047 0 CA-C-N 120.869 2.334 . . . . 0.0 111.08 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -70.37 -34.72 72.93 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -57.28 -42.66 82.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.825 0.85 . . . . 0.0 108.717 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -67.0 -53.13 34.27 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 118.521 -0.752 . . . . 0.0 109.115 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -52.84 -57.23 10.91 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.162 0.985 . . . . 0.0 111.798 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -57.76 -53.6 56.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.594 0.758 . . . . 0.0 111.683 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -46.81 83.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.946 0.899 . . . . 0.0 112.119 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tt -67.79 -55.5 12.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.809 1.643 . . . . 0.0 111.275 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.26 -48.44 74.0 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 118.505 -0.76 . . . . 0.0 111.548 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.9 mt -61.37 -46.32 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 119.289 0.95 . . . . 0.0 108.913 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.3 tmtt? -55.9 -39.24 71.31 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-O 116.889 -1.529 . . . . 0.0 110.087 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.638 ' HG2' ' HH ' ' B' ' 133' ' ' TYR . 79.0 mt-10 -64.98 -39.5 93.58 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.71 1.141 . . . . 0.0 111.316 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.64 -52.03 66.88 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.787 0.722 . . . . 0.0 110.996 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -70.09 -37.74 75.49 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.183 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -61.77 -54.14 46.47 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-O 117.879 -1.057 . . . . 0.0 109.136 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.43 -38.98 91.52 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.577 1.08 . . . . 0.0 110.566 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.3 ttt -58.05 -32.93 68.48 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.387 0.54 . . . . 0.0 109.8 178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -88.91 -39.37 13.83 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.296 1.038 . . . . 0.0 111.468 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.438 1.095 . . . . 0.0 111.402 -179.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp . . . . . 0 CA--C 1.535 0.377 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 179.018 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.1 t60 . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.72 -44.18 77.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 119.19 0.904 . . . . 0.0 112.747 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.8 mm -66.37 -43.62 91.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 124.831 1.252 . . . . 0.0 110.337 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.01 -52.81 63.97 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.208 2.203 . . . . 0.0 108.488 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.9 m -65.18 -39.47 92.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.947 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.08 -46.78 87.4 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 119.974 1.261 . . . . 0.0 108.977 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -48.35 69.26 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.165 0.986 . . . . 0.0 109.258 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -64.04 -55.68 20.5 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.201 1.4 . . . . 0.0 111.531 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -58.33 -38.19 76.64 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.919 1.236 . . . . 0.0 112.346 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -63.37 -51.2 66.86 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.01 -41.24 97.85 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.276 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 . . . . . 0 CA--C 1.531 0.236 0 C-N-CA 124.919 1.288 . . . . 0.0 112.491 -179.451 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 5.1 m . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -101.37 144.84 29.7 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -126.16 159.03 34.02 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.52 0.728 . . . . 0.0 109.802 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.0 mp -139.69 152.28 46.57 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -142.89 98.49 3.29 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.167 1.787 . . . . 0.0 107.968 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.53 150.81 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.496 0.719 . . . . 0.0 111.074 -178.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -116.66 102.77 9.73 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.81 124.36 2.35 Favored Glycine 0 C--N 1.331 0.257 0 N-CA-C 107.564 -2.214 . . . . 0.0 107.564 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -67.62 -58.08 5.3 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 120.481 2.14 . . . . 0.0 110.424 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.9 -40.92 91.96 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 121.533 -0.729 . . . . 0.0 109.579 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -55.27 -50.55 69.22 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.437 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.62 -47.39 86.41 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.671 -178.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -53.86 49.82 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.764 0.793 . . . . 0.0 111.092 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 89.9 mt -61.01 -56.06 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.104 1.761 . . . . 0.0 111.506 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -61.6 -39.53 91.55 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 118.469 -0.777 . . . . 0.0 111.219 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 15.3 ttt -66.96 -52.33 44.2 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.168 0.895 . . . . 0.0 108.873 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -52.32 -52.05 55.26 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.183 0.593 . . . . 0.0 110.466 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.85 -38.38 79.74 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.207 -0.901 . . . . 0.0 112.859 -178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.3 tptp -66.36 -41.84 88.91 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 120.525 1.511 . . . . 0.0 110.232 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.43 -44.36 97.26 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.803 1.241 . . . . 0.0 107.831 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 24.7 t -61.12 -44.9 96.63 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.999 1.32 . . . . 0.0 109.799 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -68.42 -31.83 71.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 117.223 -1.37 . . . . 0.0 110.319 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -60.91 -43.13 99.0 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 121.222 1.828 . . . . 0.0 107.723 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.24 -53.95 41.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.823 0.849 . . . . 0.0 110.373 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 17.2 tpt -62.36 -30.25 71.04 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -77.38 -29.19 53.13 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.921 -1.112 . . . . 0.0 110.032 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.94 -33.45 22.68 Favored 'General case' 0 C--N 1.344 0.349 0 O-C-N 121.241 -0.912 . . . . 0.0 113.34 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -95.83 148.83 35.17 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 126.59 1.956 . . . . 0.0 112.184 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -70.49 -179.54 3.32 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.423 2.082 . . . . 0.0 111.037 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -113.21 46.91 0.35 Allowed Pre-proline 0 CA--C 1.557 1.232 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -64.4 -65.99 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.879 2.386 . . . . 0.0 113.036 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.48 -26.69 68.04 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.298 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.25 -56.74 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.595 1.089 . . . . 0.0 109.092 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -65.91 -31.95 73.17 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.805 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -51.15 43.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.589 -0.72 . . . . 0.0 111.479 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . 0.638 ' HH ' ' HG2' ' A' ' 24' ' ' GLU . 0.2 OUTLIER -66.63 -34.09 77.11 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.744 1.156 . . . . 0.0 109.811 -179.466 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -60.32 -48.65 80.85 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.745 0.818 . . . . 0.0 109.225 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.44 -41.6 65.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 123.048 0.539 . . . . 0.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -58.13 -46.08 86.24 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.928 0.891 . . . . 0.0 109.471 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -76.1 -28.59 57.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.59 0.756 . . . . 0.0 110.084 179.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -61.74 -31.6 71.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.259 0.936 . . . . 0.0 109.12 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -6.52 0.98 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.982 1.313 . . . . 0.0 113.272 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 18.2 tp . . . . . 0 CA--C 1.546 0.824 0 C-N-CA 125.018 1.327 . . . . 0.0 109.963 177.919 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 CA--C 1.534 0.361 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 24.6 tp -72.42 102.53 3.21 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.123 0.969 . . . . 0.0 109.384 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 59.4 mt -109.42 170.85 7.8 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 124.293 1.037 . . . . 0.0 109.436 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -138.05 152.73 49.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.37 100.04 17.0 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -79.6 115.66 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.567 2.845 . . . . 0.0 110.138 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 78.1 t -144.74 152.11 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 119.649 1.113 . . . . 0.0 110.194 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.15 102.51 5.21 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.17 113.66 0.55 Allowed Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 104.107 -3.597 . . . . 0.0 104.107 179.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -51.13 69.08 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 120.057 1.928 . . . . 0.0 113.048 -177.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -75.34 -34.14 61.16 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.299 1.039 . . . . 0.0 109.358 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 5.5 m -59.28 -50.21 74.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.962 1.305 . . . . 0.0 107.963 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.0 t80 -58.7 -51.21 70.91 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.857 1.663 . . . . 0.0 109.404 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.4 -42.33 99.35 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.49 1.041 . . . . 0.0 112.752 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.0 ttm -60.64 -50.59 72.89 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.76 -44.69 93.74 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.215 1.406 . . . . 0.0 111.569 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.42 -55.75 30.73 Favored 'General case' 0 CA--C 1.512 -0.486 0 C-N-CA 124.322 1.049 . . . . 0.0 111.482 -179.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -41.38 79.29 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.982 0.356 . . . . 0.0 111.543 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 81.2 mt -66.99 -43.18 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 121.655 0.74 . . . . 0.0 110.3 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -66.51 -44.83 81.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 120.794 -1.191 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -62.97 -39.61 95.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 117.997 -1.002 . . . . 0.0 111.169 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 55.4 p -61.18 -50.44 73.13 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.08 0.855 . . . . 0.0 110.409 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -68.82 -42.47 77.2 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.911 -178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.62 -51.0 71.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 42.7 tp -62.25 -43.78 98.05 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.786 0.721 . . . . 0.0 109.744 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 22.3 ttt -57.89 -35.26 70.77 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.642 0.777 . . . . 0.0 111.137 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -79.28 -49.14 12.93 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.311 1.444 . . . . 0.0 111.14 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 24.2 t80 -71.63 -23.87 61.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.749 2.02 . . . . 0.0 113.862 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 8.4 tp . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 179.461 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -50.07 74.3 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 120.978 1.717 . . . . 0.0 111.552 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.8 mm -63.82 -34.99 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -61.19 -53.4 57.43 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.861 0.755 . . . . 0.0 109.005 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 13.2 m -67.33 -35.48 79.5 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.864 -0.522 . . . . 0.0 110.793 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.3 t80 -58.77 -52.68 64.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -37.31 81.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 123.979 0.912 . . . . 0.0 109.728 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -53.5 57.15 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.078 0.951 . . . . 0.0 109.472 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -67.02 -46.08 75.57 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.19 0.996 . . . . 0.0 111.032 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -42.23 85.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.317 1.047 . . . . 0.0 109.21 179.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -65.7 -51.47 59.1 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 . . . . . 0 C--N 1.339 0.143 0 C-N-CA 124.338 1.055 . . . . 0.0 113.429 -179.422 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 C--O 1.234 0.242 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -102.23 142.12 33.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -122.94 151.17 42.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 7.3 mp -128.33 150.06 50.24 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 105.62 -1.992 . . . . 0.0 105.62 178.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tm0? -145.33 98.37 3.14 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 125.897 1.679 . . . . 0.0 106.975 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.83 140.66 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 119.074 0.852 . . . . 0.0 111.573 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -103.91 103.95 13.87 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 105.165 -2.161 . . . . 0.0 105.165 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.16 114.08 0.86 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 104.301 -3.52 . . . . 0.0 104.301 178.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -61.95 -57.52 11.4 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.491 2.145 . . . . 0.0 111.901 -178.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mttp -72.22 -35.52 68.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.494 -0.754 . . . . 0.0 109.081 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.16 -51.32 69.79 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.013 -0.994 . . . . 0.0 111.035 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.8 t80 -66.71 -43.24 84.82 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.429 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.76 -54.0 40.09 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.407 1.003 . . . . 0.0 111.817 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.06 -54.07 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 125.614 1.565 . . . . 0.0 111.657 -178.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -37.54 87.68 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 117.719 -1.134 . . . . 0.0 111.873 -178.084 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 15.1 ttt -65.3 -51.26 61.83 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -52.32 -51.74 57.01 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 123.454 0.702 . . . . 0.0 109.664 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 68.1 mt -65.23 -36.54 84.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.397 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.6 tptp -64.98 -48.4 74.16 Favored 'General case' 0 C--O 1.228 -0.079 0 CA-C-N 120.123 1.328 . . . . 0.0 109.449 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -59.02 -46.6 87.8 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.96 1.304 . . . . 0.0 108.047 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 40.7 t -57.09 -45.95 82.96 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.53 1.132 . . . . 0.0 109.97 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 2.6 mm? -70.89 -30.52 66.9 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.578 -1.201 . . . . 0.0 111.059 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -62.88 -42.6 99.83 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 121.529 1.968 . . . . 0.0 107.982 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -54.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.105 0.962 . . . . 0.0 109.567 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 13.7 tpt -60.12 -30.09 69.05 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.307 0.643 . . . . 0.0 112.711 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -76.38 -35.45 58.64 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 119.084 0.856 . . . . 0.0 110.207 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.21 -31.71 33.81 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.801 1.038 . . . . 0.0 113.801 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.2 t -94.61 147.93 34.04 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 125.378 1.471 . . . . 0.0 112.934 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -67.31 -173.09 0.4 Allowed 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 123.674 2.916 . . . . 0.0 110.818 178.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -122.92 43.48 0.76 Allowed Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -65.62 -47.16 4.31 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.106 1.871 . . . . 0.0 113.09 -178.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 26.0 tp -68.89 -39.7 79.59 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 119.372 0.987 . . . . 0.0 109.217 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -59.26 -50.41 79.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.39 0 CA-C-O 117.377 -1.296 . . . . 0.0 109.722 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -55.09 -51.56 65.99 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.343 1.429 . . . . 0.0 109.758 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 5.3 t -57.26 -49.88 74.66 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.161 1.384 . . . . 0.0 111.549 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.6 t80 -68.95 -41.95 77.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.336 1.455 . . . . 0.0 112.041 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 10.1 tmm_? -53.3 -47.5 69.19 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.087 1.355 . . . . 0.0 109.885 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -70.82 -53.93 13.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.125 0.97 . . . . 0.0 110.125 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -51.48 -47.27 63.26 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.656 0.782 . . . . 0.0 112.658 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -73.57 -31.62 63.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.313 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -61.81 -34.02 75.17 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.674 1.124 . . . . 0.0 109.687 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.13 -14.68 1.74 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 48.7 tp . . . . . 0 CA--C 1.546 0.82 0 C-N-CA 125.8 1.64 . . . . 0.0 111.14 177.826 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.01 108.65 1.26 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.589 0.631 . . . . 0.0 110.272 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.78 168.33 10.56 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.43 1.109 . . . . 0.0 109.643 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -135.99 142.3 44.49 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.384 1.873 . . . . 0.0 106.999 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 39.3 tp -130.5 96.04 25.2 Favored Pre-proline 0 CA--C 1.539 0.527 0 C-N-CA 123.989 0.916 . . . . 0.0 108.747 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.46 116.76 3.62 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.537 2.825 . . . . 0.0 108.799 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.9 t -145.48 160.83 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.885 1.674 . . . . 0.0 109.804 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -134.4 105.02 6.37 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.9 104.88 0.23 Allowed Glycine 0 C--O 1.227 -0.334 0 N-CA-C 106.403 -2.679 . . . . 0.0 106.403 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -64.24 -52.96 56.18 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 121.196 2.498 . . . . 0.0 113.021 -177.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.91 -30.71 69.24 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.47 -0.769 . . . . 0.0 110.864 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -43.34 81.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 126.115 1.766 . . . . 0.0 109.299 -179.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -61.85 -49.05 77.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.138 0.975 . . . . 0.0 108.533 178.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -60.61 -43.14 97.78 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.744 0.247 . . . . 0.0 111.423 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 8.8 tmm? -63.73 -49.95 71.05 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.841 0.857 . . . . 0.0 110.359 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 mp -61.65 -52.24 65.15 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.191 -0.909 . . . . 0.0 112.179 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -42.14 94.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.463 1.029 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -59.94 -48.61 81.0 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.205 0.526 . . . . 0.0 110.48 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.3 mt -73.62 -32.15 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.021 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -59.23 -57.54 12.57 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -36.54 73.05 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 117.054 -1.45 . . . . 0.0 109.309 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 p -55.8 -48.0 76.15 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.285 1.402 . . . . 0.0 111.327 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -42.37 62.48 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.306 1.842 . . . . 0.0 113.716 -178.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -68.88 -52.47 29.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.609 -0.682 . . . . 0.0 109.988 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.94 -39.57 92.53 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.607 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.25 66.37 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.083 0.856 . . . . 0.0 109.703 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.02 -23.99 66.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.66 -23.46 29.45 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.446 1.099 . . . . 0.0 111.523 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp . . . . . 0 CA--C 1.535 0.369 0 C-N-CA 127.776 2.431 . . . . 0.0 105.909 179.909 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.5 m170 . . . . . 0 N--CA 1.465 0.282 0 CA-C-O 118.224 -0.893 . . . . 0.0 113.296 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.7 m -56.91 -50.03 73.79 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.555 1.07 . . . . 0.0 108.952 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.8 mt -65.78 -53.64 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 126.108 1.763 . . . . 0.0 108.826 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -52.43 -53.3 47.13 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.202 1.001 . . . . 0.0 111.721 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.1 m -64.83 -47.06 79.36 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.887 0.875 . . . . 0.0 110.494 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -61.35 -41.39 96.98 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 118.965 0.802 . . . . 0.0 111.28 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -60.37 -48.55 81.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.441 1.019 . . . . 0.0 110.171 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.79 -46.04 89.84 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 123.176 0.59 . . . . 0.0 110.083 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -62.02 -47.65 83.81 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 124.451 1.1 . . . . 0.0 110.821 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -54.88 -44.52 74.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.556 1.142 . . . . 0.0 110.512 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -57.4 -50.78 71.91 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.538 0.503 0 CA-C-N 117.86 0.3 . . . . 0.0 111.268 179.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 7.1 m . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.03 129.91 48.46 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -104.31 159.41 15.73 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.841 1.656 . . . . 0.0 109.466 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.9 mt -149.12 142.51 25.23 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.871 1.668 . . . . 0.0 107.831 179.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -146.03 108.21 4.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.5 m -154.51 150.18 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.106 1.362 . . . . 0.0 109.488 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.87 101.57 8.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.225 1.375 . . . . 0.0 108.916 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.0 115.85 0.88 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-O 115.887 -2.618 . . . . 0.0 109.918 178.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -65.24 -56.91 10.09 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 122.364 3.082 . . . . 0.0 111.023 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -63.55 -47.75 80.3 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 -52.64 -48.81 66.17 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.326 -0.845 . . . . 0.0 111.349 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.94 -43.74 94.93 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.954 1.252 . . . . 0.0 112.074 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.48 -48.82 79.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.863 1.21 . . . . 0.0 110.332 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 85.0 mt -61.23 -53.71 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 124.43 1.092 . . . . 0.0 110.757 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.66 -31.69 73.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 117.911 -1.042 . . . . 0.0 111.601 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 16.2 mtp -64.41 -52.38 58.42 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.265 1.393 . . . . 0.0 109.468 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -58.14 -43.23 87.18 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.6 mt -63.2 -50.67 69.38 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.419 0.688 . . . . 0.0 111.941 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . 0.443 ' O ' ' HE2' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -69.69 -50.84 39.96 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 119.447 1.021 . . . . 0.0 112.669 -178.52 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -56.64 -46.78 80.81 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 118.909 0.777 . . . . 0.0 110.443 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.8 t -64.21 -36.17 83.18 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.721 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -69.83 -43.31 72.26 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -60.25 -33.98 73.06 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.898 1.226 . . . . 0.0 109.784 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -73.15 -44.05 60.62 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.2 tpt -63.98 -25.77 68.28 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.465 1.106 . . . . 0.0 109.7 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.5 -46.32 17.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.665 1.986 . . . . 0.0 109.606 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -75.4 -32.33 60.72 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.098 0.863 . . . . 0.0 113.118 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -91.63 147.85 36.06 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.46 -176.8 1.52 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.367 2.045 . . . . 0.0 110.429 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.96 56.58 0.37 Allowed Pre-proline 0 CA--C 1.551 1.006 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.36 -74.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.263 2.642 . . . . 0.0 113.109 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.8 tt -56.12 -44.35 79.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 25.5 t -50.97 -53.79 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 126.959 2.104 . . . . 0.0 112.103 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.52 -42.66 91.75 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.307 0.958 . . . . 0.0 111.421 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 29.5 m -64.39 -44.34 91.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.464 0.575 . . . . 0.0 109.727 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -56.92 -51.93 67.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.829 1.652 . . . . 0.0 108.78 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -54.18 -46.96 72.51 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 117.48 -1.248 . . . . 0.0 111.245 -178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -68.56 -49.83 56.46 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 120.997 1.726 . . . . 0.0 112.086 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -56.98 -37.67 71.95 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.837 0.455 . . . . 0.0 110.975 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -77.57 -41.98 36.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 110.051 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -54.23 -32.52 56.14 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.912 1.233 . . . . 0.0 110.442 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.28 -19.64 55.74 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.854 -0.529 . . . . 0.0 111.828 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 N--CA 1.463 0.2 0 O-C-N 120.727 -1.233 . . . . 0.0 110.308 178.93 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.0 tt -68.05 120.08 13.69 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.34 167.55 10.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 123.373 1.558 . . . . 0.0 109.702 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -136.12 148.01 48.04 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 126.905 2.082 . . . . 0.0 106.287 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 9.0 tp -137.11 94.57 12.43 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.38 111.17 3.22 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.209 3.273 . . . . 0.0 109.035 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 54.0 t -145.35 156.01 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -135.65 105.04 6.01 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.132 -0.98 . . . . 0.0 109.869 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.7 114.96 0.6 Allowed Glycine 0 CA--C 1.529 0.919 0 N-CA-C 106.503 -2.639 . . . . 0.0 106.503 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -67.86 -50.68 55.16 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 122.73 3.265 . . . . 0.0 111.086 -179.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -41.49 85.86 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -48.72 79.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 124.518 1.127 . . . . 0.0 110.055 -179.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 55.0 t80 -57.26 -54.74 43.38 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.921 0.889 . . . . 0.0 110.864 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -62.57 -37.52 86.5 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 12.0 tmm? -66.14 -49.8 66.19 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.627 -0.671 . . . . 0.0 109.444 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.21 -45.2 93.99 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.494 0.717 . . . . 0.0 110.308 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -61.69 -54.37 43.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.022 0.929 . . . . 0.0 111.327 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -54.97 -48.37 73.33 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.809 0.844 . . . . 0.0 111.238 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 96.7 mt -71.46 -40.59 72.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 119.113 -0.47 . . . . 0.0 111.011 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -47.4 85.83 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 119.532 1.06 . . . . 0.0 108.16 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.03 -46.39 85.41 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.517 1.136 . . . . 0.0 108.754 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 34.1 p -54.39 -50.06 68.41 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 118.398 0.544 . . . . 0.0 111.656 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -46.47 89.14 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 122.114 0.959 . . . . 0.0 111.57 -178.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -52.64 64.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.834 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.86 -48.56 71.17 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.154 1.781 . . . . 0.0 112.937 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -41.38 63.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.845 1.658 . . . . 0.0 109.185 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -87.72 -25.09 23.63 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 118.16 -0.924 . . . . 0.0 111.671 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -75.69 -23.04 56.15 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.89 1.677 . . . . 0.0 111.15 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 39.5 tp . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 125.837 1.655 . . . . 0.0 106.907 -179.952 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 50.7 m170 . . . . . 0 N--CA 1.462 0.147 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 3.0 m -56.63 -47.44 79.67 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.2 mt -69.58 -49.94 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 C-N-CA 126.534 1.933 . . . . 0.0 109.783 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -55.02 -54.45 42.87 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.809 0.844 . . . . 0.0 111.252 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.9 m -59.92 -46.09 90.48 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.336 0.655 . . . . 0.0 109.741 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 23.0 t80 -59.1 -45.3 91.21 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.632 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -48.82 80.1 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.654 0.782 . . . . 0.0 110.435 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -44.03 91.54 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 121.876 -0.515 . . . . 0.0 110.541 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -64.44 -42.44 95.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.539 -0.743 . . . . 0.0 110.727 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -60.74 -35.19 75.74 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.644 1.178 . . . . 0.0 110.744 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -64.95 -54.42 30.92 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.531 0.247 0 O-C-N 122.4 -0.188 . . . . 0.0 110.629 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 65.6 m . . . . . 0 C--O 1.237 0.439 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -111.09 140.69 45.43 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.845 0.831 . . . . 0.0 108.78 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.56 159.71 31.39 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.474 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.9 mt -146.23 146.95 30.97 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 177.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -143.63 112.84 6.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 17.4 m -155.47 151.33 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 C-N-CA 125.806 1.642 . . . . 0.0 109.258 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 102.19 11.73 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.71 108.97 0.53 Allowed Glycine 0 C--N 1.335 0.499 0 CA-C-O 117.043 -1.976 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -58.02 9.01 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 121.425 2.613 . . . . 0.0 112.573 -179.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -71.16 -42.77 68.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.575 -0.703 . . . . 0.0 109.144 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -54.05 -49.29 69.32 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.596 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 78.1 t80 -62.31 -44.65 96.01 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.335 0.97 . . . . 0.0 110.901 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.7 -45.31 94.67 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.836 0.744 . . . . 0.0 112.4 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.9 mt -66.97 -50.9 60.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.768 1.627 . . . . 0.0 109.457 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.59 -36.94 82.11 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 118.257 -0.878 . . . . 0.0 109.985 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 22.7 mtp -60.59 -52.55 64.7 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 119.464 1.029 . . . . 0.0 109.162 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -60.77 -42.01 96.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.486 -0.769 . . . . 0.0 111.229 -179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.1 mt -66.25 -46.61 76.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.601 0.637 . . . . 0.0 111.911 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.8 tptt -69.3 -54.04 16.63 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 117.122 -1.418 . . . . 0.0 111.328 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -53.17 -47.59 68.69 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 108.376 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 30.9 t -55.15 -54.28 45.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.334 0.654 . . . . 0.0 110.43 179.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -30.76 71.79 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 118.86 -0.591 . . . . 0.0 110.741 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.27 -49.07 79.07 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 120.075 1.307 . . . . 0.0 108.093 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.59 -41.18 80.0 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.124 -0.941 . . . . 0.0 108.525 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.8 tpt -64.37 -20.9 66.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.702 1.137 . . . . 0.0 111.402 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -83.12 -37.36 23.87 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.151 0.98 . . . . 0.0 108.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.22 -32.82 17.24 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 67.1 t -89.84 141.16 28.03 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 126.16 1.784 . . . . 0.0 109.35 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.78 177.25 5.07 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 123.332 2.688 . . . . 0.0 112.28 179.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -111.31 53.2 0.36 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.81 -70.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.482 2.121 . . . . 0.0 112.666 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.39 -39.07 82.21 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.5 t -52.16 -56.34 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.033 1.733 . . . . 0.0 110.654 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.43 -44.02 75.87 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.516 1.053 . . . . 0.0 111.84 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 36.8 m -57.13 -42.15 80.37 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 47.7 t80 -69.82 -44.37 70.11 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.651 1.581 . . . . 0.0 109.012 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -54.5 -48.83 71.4 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 117.911 -1.043 . . . . 0.0 110.362 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -66.48 -53.9 29.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.952 0.796 . . . . 0.0 110.992 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -54.86 -38.83 67.96 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.779 0.832 . . . . 0.0 113.203 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.47 -37.39 31.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.422 0.689 . . . . 0.0 109.966 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -57.74 -38.05 74.65 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.667 0.667 . . . . 0.0 110.049 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.4 mt -59.48 -15.23 16.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.895 0.878 . . . . 0.0 113.194 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.542 0.651 0 C-N-CA 124.171 0.988 . . . . 0.0 110.365 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 103.768 -2.678 . . . . 0.0 103.768 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.12 101.08 0.26 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.188 0.995 . . . . 0.0 109.895 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mp -92.74 173.73 7.62 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -133.35 120.31 20.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.11 0.964 . . . . 0.0 108.902 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.6 tp -104.22 101.21 25.2 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 124.178 0.991 . . . . 0.0 109.442 179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -80.8 118.92 3.52 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.312 2.675 . . . . 0.0 110.248 178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -144.64 156.49 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 125.483 1.513 . . . . 0.0 107.03 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.6 103.67 5.53 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.082 -1.011 . . . . 0.0 109.497 178.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.11 125.19 1.29 Allowed Glycine 0 C--O 1.226 -0.349 0 N-CA-C 106.013 -2.835 . . . . 0.0 106.013 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -51.26 59.79 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 121.129 2.465 . . . . 0.0 109.642 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -72.63 -30.77 64.6 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.211 1.004 . . . . 0.0 110.559 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 m -66.83 -51.56 54.14 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.297 1.439 . . . . 0.0 109.277 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -63.69 -50.37 69.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.478 0.711 . . . . 0.0 109.774 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -57.99 -57.54 12.38 Favored 'General case' 0 C--O 1.231 0.1 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -63.16 -39.29 94.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.697 0.681 . . . . 0.0 112.751 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.2 mt -72.85 -35.1 67.16 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 118.134 -0.936 . . . . 0.0 111.125 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -69.71 -41.47 75.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.095 1.316 . . . . 0.0 107.765 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -56.38 -48.75 76.22 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.473 1.109 . . . . 0.0 109.713 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.69 -46.76 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.482 0.713 . . . . 0.0 109.983 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -53.94 -50.18 67.02 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 124.003 0.921 . . . . 0.0 110.103 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -71.57 -42.89 67.25 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.77 -1.11 . . . . 0.0 111.623 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.8 t -53.7 -51.48 63.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.573 1.078 . . . . 0.0 108.79 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.47 -56.91 14.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 124.695 1.247 . . . . 0.0 110.553 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -56.24 -43.24 78.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.972 0.806 . . . . 0.0 112.58 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.62 -43.91 75.34 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.85 1.204 . . . . 0.0 110.454 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.54 -38.5 84.69 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.029 0.932 . . . . 0.0 109.258 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.99 -37.72 84.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.689 1.196 . . . . 0.0 110.214 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -79.72 -24.04 41.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.556 1.142 . . . . 0.0 112.92 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 27.6 tp . . . . . 0 CA--C 1.538 0.489 0 CA-C-N 120.297 1.408 . . . . 0.0 112.439 -178.944 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.0 m -55.83 -43.84 77.35 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.104 1.32 . . . . 0.0 110.808 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.07 -55.03 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.039 1.335 . . . . 0.0 109.594 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.3 -42.85 99.36 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 m -65.72 -31.9 73.16 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -49.98 70.43 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 178.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -55.87 -48.5 75.44 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.003 0.921 . . . . 0.0 109.862 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -64.07 -41.81 97.21 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.63 0.772 . . . . 0.0 111.24 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.332 -0.162 0 O-C-N 121.137 -0.977 . . . . 0.0 110.66 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -66.5 -35.53 80.48 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -69.76 -31.22 69.05 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.532 1.133 . . . . 0.0 111.525 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? . . . . . 0 N--CA 1.464 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 111.979 -179.562 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.238 0.481 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -102.02 137.02 40.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.626 1.171 . . . . 0.0 108.901 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -114.15 149.83 35.08 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.931 1.693 . . . . 0.0 108.466 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mt -144.91 145.87 31.76 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.126 1.37 . . . . 0.0 108.041 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -151.73 110.76 3.88 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.413 0.685 . . . . 0.0 111.514 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -154.02 150.87 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.246 1.818 . . . . 0.0 107.704 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 24.2 ptt85 -99.18 101.86 13.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.79 1.177 . . . . 0.0 110.092 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.35 114.55 0.81 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 116.128 -2.484 . . . . 0.0 113.323 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 tpp85 -67.35 -56.77 8.37 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 122.751 3.275 . . . . 0.0 111.052 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -64.99 -50.62 65.61 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.996 1.718 . . . . 0.0 108.503 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -47.35 64.73 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.743 2.817 . . . . 0.0 109.393 -178.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -66.64 -47.39 72.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.157 0.89 . . . . 0.0 111.187 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -57.04 -43.08 81.61 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.342 0.973 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 60.2 mt -61.25 -54.69 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.813 1.245 . . . . 0.0 107.727 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.81 -37.36 76.21 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 117.871 -1.061 . . . . 0.0 112.524 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 60.0 mtp -65.44 -54.23 31.52 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 119.921 1.237 . . . . 0.0 111.298 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 13.9 ptpt -61.85 -43.0 99.72 Favored 'General case' 0 C--N 1.34 0.175 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.74 -51.48 58.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.427 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -54.84 -58.86 5.87 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.466 0.707 . . . . 0.0 110.672 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -52.68 -49.22 65.73 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.659 1.984 . . . . 0.0 111.432 -179.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 12.4 t -62.07 -43.58 98.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.086 0.403 . . . . 0.0 110.987 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 11.7 tp -62.98 -40.15 96.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.587 -0.721 . . . . 0.0 109.149 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -47.06 86.91 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -59.35 -52.3 66.22 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.717 0.807 . . . . 0.0 111.692 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 8.0 tmm? -62.73 -28.22 69.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.678 0.791 . . . . 0.0 111.349 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.78 -22.18 22.27 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.302 1.441 . . . . 0.0 113.214 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.93 -33.73 17.16 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.39 1.45 . . . . 0.0 111.145 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 3.7 t -94.94 147.5 33.17 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -65.79 -170.83 0.19 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.604 2.869 . . . . 0.0 111.182 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -112.19 78.0 2.32 Favored Pre-proline 0 CA--C 1.544 0.738 0 O-C-N 120.214 -1.554 . . . . 0.0 113.226 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -77.97 -97.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.73 2.953 . . . . 0.0 112.483 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.1 tt -55.76 -40.73 72.98 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.744 1.218 . . . . 0.0 109.881 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -53.37 -46.11 57.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.48 1.112 . . . . 0.0 111.238 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.15 -42.05 73.03 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 121.1 -1.0 . . . . 0.0 110.36 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.5 t -57.83 -46.62 84.47 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -67.29 -39.48 85.98 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.623 1.569 . . . . 0.0 111.11 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -47.8 70.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 119.311 0.96 . . . . 0.0 109.024 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.44 -50.96 61.61 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -51.22 -44.15 61.59 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.309 1.043 . . . . 0.0 112.422 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.1 tm0? -76.59 -40.68 48.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.85 0.86 . . . . 0.0 110.666 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -53.64 -34.84 59.96 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.885 0.874 . . . . 0.0 111.435 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.02 -10.21 3.98 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 126.439 1.895 . . . . 0.0 109.94 178.765 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 CA--C 1.523 -0.08 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 5.0 tp -61.49 105.08 0.48 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.0 1.32 . . . . 0.0 111.366 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 14.4 mt -93.36 133.73 36.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -103.45 103.34 13.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.937 1.295 . . . . 0.0 107.824 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.6 tp -97.79 111.8 59.89 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 117.609 -1.186 . . . . 0.0 110.586 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -81.89 115.74 2.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.504 2.803 . . . . 0.0 111.686 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 37.6 t -143.88 148.97 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 120.039 1.291 . . . . 0.0 109.357 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.42 102.74 5.05 Favored 'General case' 0 C--N 1.346 0.428 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.06 136.36 4.06 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-O 115.104 -3.053 . . . . 0.0 105.475 176.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -53.46 14.69 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 122.991 3.396 . . . . 0.0 106.96 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.62 -30.23 66.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 2.4 m -66.58 -52.23 47.73 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.14 0.882 . . . . 0.0 108.947 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.48 -52.65 62.65 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -57.27 -56.54 20.53 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 124.025 0.93 . . . . 0.0 112.829 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ttm -60.53 -34.8 74.64 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.165 1.348 . . . . 0.0 112.045 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.1 mt -68.66 -53.06 24.73 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -50.09 74.85 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 124.131 0.972 . . . . 0.0 111.523 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -55.59 -48.45 74.82 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.885 1.274 . . . . 0.0 110.243 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 54.7 mt -70.09 -37.25 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 121.695 -0.628 . . . . 0.0 109.963 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -62.64 -51.64 66.47 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.247 1.019 . . . . 0.0 110.791 179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.63 -36.99 76.63 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.368 1.067 . . . . 0.0 108.617 -178.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 42.4 t -56.5 -48.6 76.83 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.829 1.195 . . . . 0.0 107.854 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tm? -67.55 -54.05 23.18 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.479 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.26 -52.26 63.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.692 0.678 . . . . 0.0 112.644 -178.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 85.3 mt -64.9 -47.7 76.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.233 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -57.59 -41.7 81.69 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.38 -33.46 74.3 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.085 -1.01 . . . . 0.0 110.004 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -72.16 -18.61 61.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.072 0.949 . . . . 0.0 109.766 178.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 45.6 tp . . . . . 0 CA--C 1.54 0.59 0 C-N-CA 124.842 1.257 . . . . 0.0 109.11 178.018 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 CA--C 1.531 0.24 0 CA-C-O 116.087 -1.911 . . . . 0.0 114.171 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 85.5 m -57.64 -45.2 85.76 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 122.29 2.314 . . . . 0.0 109.534 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.86 -54.59 32.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 C-N-CA 125.297 1.439 . . . . 0.0 108.623 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.31 -33.88 73.0 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 51.5 m -69.92 -52.56 23.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -47.3 76.9 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.699 0.682 . . . . 0.0 110.397 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -61.42 -49.36 77.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.626 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -68.97 -29.28 67.47 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 118.943 0.792 . . . . 0.0 112.939 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -66.97 -35.69 80.52 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.324 0.965 . . . . 0.0 108.584 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -78.61 -40.93 33.07 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -54.81 -40.93 70.01 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.803 1.241 . . . . 0.0 110.357 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.0 tm0? . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 125.047 1.339 . . . . 0.0 112.193 -179.68 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 30.1 m . . . . . 0 C--O 1.237 0.434 0 N-CA-C 110.805 -0.072 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -107.83 130.28 55.0 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.127 0.971 . . . . 0.0 110.913 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -109.96 144.02 39.08 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 127.584 2.354 . . . . 0.0 107.636 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 12.5 mt -140.98 143.48 34.51 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.267 1.427 . . . . 0.0 109.211 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -145.37 110.32 5.16 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.773 1.229 . . . . 0.0 110.21 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 26.2 t -151.11 151.27 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.492 1.517 . . . . 0.0 110.316 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -110.9 101.89 10.43 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 120.346 1.43 . . . . 0.0 107.312 176.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.55 108.93 0.51 Allowed Glycine 0 CA--C 1.521 0.451 0 CA-C-O 116.607 -2.219 . . . . 0.0 109.649 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -59.91 -58.2 9.58 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 121.697 2.749 . . . . 0.0 115.434 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.76 -47.47 66.15 Favored 'General case' 0 CA--C 1.508 -0.649 0 O-C-N 121.124 -0.985 . . . . 0.0 108.927 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -53.96 -43.4 69.87 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.998 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.6 t80 -66.12 -49.22 68.26 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.377 0.99 . . . . 0.0 110.886 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -52.76 -49.64 65.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.877 0.846 . . . . 0.0 110.625 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 64.4 mt -57.8 -53.78 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 126.058 1.743 . . . . 0.0 107.994 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.1 mp -59.0 -40.5 85.08 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.659 -1.162 . . . . 0.0 112.279 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 58.2 mtp -58.68 -53.22 60.79 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 120.442 1.474 . . . . 0.0 110.577 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -64.15 -40.57 96.43 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 119.981 -0.688 . . . . 0.0 112.313 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 55.3 mt -70.95 -33.39 70.43 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.705 -0.622 . . . . 0.0 112.518 -178.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 23.9 tptt -64.88 -58.6 5.74 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -49.74 -48.76 49.97 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 127.693 2.397 . . . . 0.0 110.93 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 20.7 t -56.3 -54.05 50.02 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.474 1.11 . . . . 0.0 111.695 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.19 -42.61 91.27 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.862 0.465 . . . . 0.0 110.842 -178.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.05 -41.24 91.89 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.223 1.009 . . . . 0.0 110.988 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 1.1 mm? -65.24 -53.63 41.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.854 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 55.8 mmm -57.8 -27.62 63.29 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -85.12 -36.71 20.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.67 -32.14 28.29 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.275 0.943 . . . . 0.0 113.19 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.37 149.22 40.69 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 126.446 1.898 . . . . 0.0 108.134 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -65.44 174.09 5.65 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.993 2.462 . . . . 0.0 111.036 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -112.51 61.89 0.65 Allowed Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.359 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.68 -86.87 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.1 3.2 . . . . 0.0 111.408 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.1 -43.53 82.32 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.131 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.0 m -51.24 -40.86 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-O 118.213 -0.898 . . . . 0.0 112.124 -177.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.45 -41.84 45.99 Favored 'General case' 0 C--N 1.338 0.102 0 CA-C-N 118.748 0.704 . . . . 0.0 110.165 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -49.91 73.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 77.3 t80 -64.91 -40.01 94.4 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 127.028 2.131 . . . . 0.0 108.813 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -43.51 67.84 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.599 1.091 . . . . 0.0 108.238 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -77.62 -44.92 26.69 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.86 0.864 . . . . 0.0 111.867 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -56.79 -49.85 74.09 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.53 1.132 . . . . 0.0 110.441 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -64.02 -46.58 83.82 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.425 2.29 . . . . 0.0 108.787 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -55.32 -32.02 62.15 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.22 1.008 . . . . 0.0 111.57 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -2.42 1.37 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.546 0.804 0 C-N-CA 126.044 1.738 . . . . 0.0 108.854 177.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.567 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.2 tp -65.68 94.88 0.21 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.935 1.694 . . . . 0.0 108.847 -179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.76 137.25 36.91 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.754 1.221 . . . . 0.0 112.182 -178.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -104.19 159.23 15.87 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -142.08 101.04 5.82 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.36 125.88 10.55 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.256 1.971 . . . . 0.0 110.105 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.2 t -144.99 134.95 18.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 123.237 0.615 . . . . 0.0 110.179 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 ptt85 -136.91 102.85 4.99 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.92 117.63 0.75 Allowed Glycine 0 N--CA 1.45 -0.427 1 N-CA-C 102.786 -4.126 . . . . 0.0 102.786 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmm-85 -57.89 -51.37 69.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 121.359 2.58 . . . . 0.0 111.457 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -66.48 -40.82 89.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.906 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.86 -45.64 92.92 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.46 -0.775 . . . . 0.0 111.361 -179.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -58.93 -47.49 84.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.71 1.204 . . . . 0.0 109.814 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.67 -57.16 12.58 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.933 0.77 . . . . 0.0 110.736 179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.0 ptm -65.16 -42.84 93.36 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.26 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.01 -45.29 87.09 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.21 0.913 . . . . 0.0 111.175 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.5 -53.39 58.12 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 123.611 0.764 . . . . 0.0 109.496 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -40.91 97.17 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -178.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 91.5 mt -67.91 -45.33 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -63.96 -44.35 93.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.281 -0.636 . . . . 0.0 109.281 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -61.03 -50.87 71.56 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.146 -0.93 . . . . 0.0 109.428 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.3 p -53.19 -40.0 64.09 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.84 1.2 . . . . 0.0 111.177 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.09 -49.96 25.56 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.475 0.58 . . . . 0.0 111.664 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.44 -53.76 53.62 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.889 1.676 . . . . 0.0 110.61 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.96 -43.33 95.11 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.499 1.519 . . . . 0.0 109.718 -179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.8 ttt -63.47 -35.82 81.73 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.413 0.685 . . . . 0.0 110.55 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -78.29 -31.14 48.77 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.347 -0.845 . . . . 0.0 111.57 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -76.46 -35.04 58.66 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.424 0.69 . . . . 0.0 111.252 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 tp . . . . . 0 C--O 1.234 0.244 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.534 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 119.082 -0.485 . . . . 0.0 109.927 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.2 m -63.91 -52.4 60.06 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 117.988 -1.006 . . . . 0.0 111.065 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 35.7 mm -71.68 -42.04 71.1 Favored 'Isoleucine or valine' 0 C--N 1.346 0.413 0 CA-C-N 120.134 1.334 . . . . 0.0 108.934 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -57.1 -42.26 80.44 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.347 0.522 . . . . 0.0 111.071 -178.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.3 m -64.28 -52.44 58.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 109.667 178.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -50.75 71.25 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 123.628 0.771 . . . . 0.0 111.738 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 18.4 ttp85 -62.6 -38.6 90.81 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 118.2 -0.905 . . . . 0.0 109.777 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -56.62 -52.81 63.45 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 119.63 1.104 . . . . 0.0 110.564 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -65.28 -41.73 93.87 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 123.339 0.399 . . . . 0.0 110.635 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -61.77 -41.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.989 0.813 . . . . 0.0 110.254 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -66.0 -29.96 70.42 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.099 0.96 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.475 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -129.56 129.64 44.71 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -114.38 167.81 10.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.339 1.055 . . . . 0.0 109.567 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 20.1 tp -149.22 154.71 39.51 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.882 178.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -150.41 98.81 2.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.957 1.703 . . . . 0.0 110.342 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.9 t -146.74 150.05 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 119.899 -1.751 . . . . 0.0 108.62 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -116.34 100.24 7.75 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 122.284 1.04 . . . . 0.0 108.701 177.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.38 107.79 0.46 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 106.819 -2.513 . . . . 0.0 106.819 177.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -56.78 15.16 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 121.512 2.656 . . . . 0.0 111.932 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -67.01 -47.0 72.79 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -52.06 -45.51 64.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.017 1.327 . . . . 0.0 112.269 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -69.96 -43.44 71.52 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.238 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -56.74 -48.18 78.37 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.948 0.88 . . . . 0.0 110.42 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 63.9 mt -65.12 -52.35 54.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 125.29 1.436 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -36.02 82.29 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.392 -1.766 . . . . 0.0 112.269 -178.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 9.5 mtm -64.12 -52.29 59.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.86 1.664 . . . . 0.0 108.55 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -48.24 -52.13 22.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.039 0.936 . . . . 0.0 109.423 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 80.6 mt -68.33 -32.8 73.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -70.35 -52.08 25.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.32 -1.487 . . . . 0.0 109.451 -178.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -54.45 -52.34 62.15 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 127.783 2.433 . . . . 0.0 106.165 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 29.3 t -52.76 -48.11 66.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.733 1.213 . . . . 0.0 112.595 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -52.47 57.73 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.66 -37.96 83.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.332 0.969 . . . . 0.0 111.263 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.49 -40.82 93.53 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 117.983 -1.008 . . . . 0.0 109.486 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 54.3 ttp -66.46 -28.94 68.98 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.868 0.758 . . . . 0.0 109.546 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.18 -32.75 65.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.462 1.028 . . . . 0.0 112.075 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 -32.76 26.08 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 4.0 p -85.26 148.1 49.1 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.08 0.952 . . . . 0.0 109.664 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -63.31 173.6 4.07 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.939 1.371 . . . . 0.0 110.133 178.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.43 55.16 1.71 Allowed Pre-proline 0 CA--C 1.548 0.877 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.73 -49.61 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 123.116 2.544 . . . . 0.0 114.35 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -28.51 69.55 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.118 -0.989 . . . . 0.0 108.46 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 11.4 t -61.4 -49.84 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -55.2 -51.36 66.78 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.602 1.561 . . . . 0.0 111.152 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 m -67.91 -46.31 71.91 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -57.98 -49.22 77.57 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.244 0.617 . . . . 0.0 109.409 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -43.26 67.87 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.903 1.681 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.09 -57.08 5.37 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.122 0.487 . . . . 0.0 111.844 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -61.09 -29.72 69.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.309 0.643 . . . . 0.0 112.094 -178.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.22 -37.73 52.73 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 178.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -58.55 -33.07 69.5 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.741 1.155 . . . . 0.0 109.395 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.43 -21.02 49.48 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 119.11 -0.471 . . . . 0.0 111.243 178.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.54 0.584 0 C-N-CA 125.144 1.378 . . . . 0.0 112.075 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.9 tp10 . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 18.9 tp -67.37 108.99 2.97 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.838 0.855 . . . . 0.0 109.283 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.4 mt -104.42 153.3 21.27 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -126.08 101.4 6.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.43 1.092 . . . . 0.0 109.175 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.03 113.0 40.05 Favored Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -91.49 122.44 0.71 Allowed 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 123.21 2.607 . . . . 0.0 109.751 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.1 t -142.27 154.59 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 125.834 1.653 . . . . 0.0 109.398 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 26.0 ptt180 -136.73 101.81 4.72 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 121.399 1.909 . . . . 0.0 111.034 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.18 138.28 5.05 Favored Glycine 0 N--CA 1.46 0.235 0 CA-C-O 116.326 -2.374 . . . . 0.0 107.645 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -52.1 27.62 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 121.008 2.404 . . . . 0.0 111.294 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.46 -41.9 92.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.364 0.529 . . . . 0.0 109.796 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -47.63 84.87 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.415 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 52.8 t80 -65.11 -40.81 95.04 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.439 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -55.11 -57.68 10.73 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.986 0.812 . . . . 0.0 108.994 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 24.6 ptm -67.65 -35.42 78.86 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.8 -41.63 91.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.533 1.061 . . . . 0.0 110.844 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.33 -47.93 58.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 178.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -56.6 -48.61 77.05 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.128 0.971 . . . . 0.0 112.888 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 93.3 mt -70.33 -35.89 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 119.304 0.956 . . . . 0.0 110.242 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -36.34 83.46 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.6 -54.84 10.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 117.871 -1.062 . . . . 0.0 110.607 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.5 p -53.51 -43.59 68.43 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.363 1.438 . . . . 0.0 113.856 -178.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.98 -47.52 51.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.812 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -64.35 -46.09 84.94 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 67.5 mt -62.16 -44.9 95.6 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.963 0.905 . . . . 0.0 109.909 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -59.25 -41.68 89.34 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.755 0.822 . . . . 0.0 109.079 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -75.08 -25.28 58.47 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.784 0.434 . . . . 0.0 111.169 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.56 -39.17 58.57 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.373 0.988 . . . . 0.0 110.849 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 C--O 1.236 0.347 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.069 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.25 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.828 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.41 58.25 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.448 1.022 . . . . 0.0 111.883 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 47.6 mm -73.25 -40.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-O 118.548 -0.739 . . . . 0.0 110.51 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -58.98 -49.2 78.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.874 0.761 . . . . 0.0 110.474 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.0 m -61.45 -40.16 93.46 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.972 0.509 . . . . 0.0 110.965 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -53.83 26.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.825 0.45 . . . . 0.0 111.196 -179.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 16.7 ttp85 -62.26 -40.71 97.09 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.212 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -59.05 -47.87 83.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.646 0.657 . . . . 0.0 109.334 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -65.09 -45.54 84.79 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.612 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -56.37 -48.32 77.07 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.71 0.804 . . . . 0.0 110.0 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -58.49 -40.36 82.55 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.978 0.911 . . . . 0.0 110.22 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 CA--C 1.534 0.343 0 C-N-CA 123.976 0.91 . . . . 0.0 110.771 179.605 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.242 0.658 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -131.74 129.74 41.02 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -112.43 174.11 6.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.258 0.623 . . . . 0.0 112.317 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 17.4 tp -150.32 153.35 35.95 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.713 178.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.15 98.82 2.74 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.88 2.072 . . . . 0.0 109.065 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 60.9 t -153.18 147.03 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.384 -0.823 . . . . 0.0 108.861 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -103.98 102.84 12.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.659 -1.276 . . . . 0.0 108.406 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.13 110.53 0.63 Allowed Glycine 0 C--O 1.223 -0.586 0 CA-C-O 117.289 -1.839 . . . . 0.0 111.695 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -67.42 -57.17 7.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 121.225 2.512 . . . . 0.0 110.189 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -69.79 -42.57 73.59 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 122.143 0.973 . . . . 0.0 109.538 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.05 -43.06 99.45 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.764 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 10.2 t80 -69.99 -37.96 75.88 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 120.086 1.312 . . . . 0.0 110.829 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -56.17 -47.49 78.16 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.425 1.011 . . . . 0.0 109.493 178.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 22.5 mt -62.42 -50.16 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.826 1.25 . . . . 0.0 109.15 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -49.04 77.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 125.457 1.503 . . . . 0.0 112.082 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.31 -52.16 63.09 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 120.957 1.708 . . . . 0.0 109.114 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -48.79 -51.82 27.23 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.157 0.583 . . . . 0.0 111.12 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 41.8 mt -71.25 -39.67 71.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 33.6 tptt -65.27 -46.1 81.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 120.121 1.328 . . . . 0.0 110.161 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -57.18 -54.92 41.36 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.856 1.662 . . . . 0.0 106.691 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 5.5 t -52.74 -43.93 66.07 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.081 0.952 . . . . 0.0 111.765 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.81 -49.01 62.06 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -63.07 -42.05 99.57 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 5.3 mp -65.42 -45.66 83.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.846 -1.074 . . . . 0.0 108.852 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 22.7 ttp -64.35 -22.57 67.0 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.749 1.613 . . . . 0.0 111.362 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -72.25 -40.36 67.75 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.71 -33.08 35.56 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.53 147.98 68.89 Favored Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 124.752 1.221 . . . . 0.0 109.867 -179.204 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.92 -174.16 1.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.543 2.162 . . . . 0.0 110.162 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.253 13.3 pt20 -126.63 54.04 10.84 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.48 -52.51 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.935 2.423 . . . . 0.0 112.51 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.45 -41.78 85.9 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.4 t -53.74 -50.27 52.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 C-N-CA 124.401 1.08 . . . . 0.0 110.529 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.29 70.22 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.491 0.662 . . . . 0.0 111.606 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 27.8 t -60.46 -46.28 90.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.792 0.837 . . . . 0.0 110.786 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.25 -45.24 81.29 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 124.716 1.206 . . . . 0.0 110.926 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.74 -45.26 66.92 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 124.5 1.12 . . . . 0.0 108.747 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -65.75 -55.96 14.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.229 0.468 . . . . 0.0 111.02 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.74 -30.88 64.0 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.579 -0.701 . . . . 0.0 112.408 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 -35.58 34.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.103 0.961 . . . . 0.0 108.772 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -58.12 -33.17 68.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.45 1.023 . . . . 0.0 108.935 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.42 -17.68 59.86 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.191 0.451 . . . . 0.0 112.135 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tt . . . . . 0 CA--C 1.538 0.51 0 C-N-CA 125.411 1.484 . . . . 0.0 108.912 179.036 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 . . . . . 0 N--CA 1.449 -0.482 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.5 tp -64.13 102.74 0.53 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.6 mt -112.77 167.71 10.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.833 2.053 . . . . 0.0 107.709 -179.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -130.26 159.43 36.92 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.808 0.843 . . . . 0.0 109.799 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.4 tp -140.39 94.72 8.41 Favored Pre-proline 0 CA--C 1.538 0.482 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.115 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.85 110.3 3.0 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 124.303 3.336 . . . . 0.0 111.653 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -139.32 151.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.535 1.134 . . . . 0.0 109.215 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -135.98 101.81 4.84 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.3 115.79 0.64 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 106.269 -2.732 . . . . 0.0 106.269 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.55 -52.01 66.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 121.315 2.558 . . . . 0.0 109.828 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -68.96 -30.72 69.2 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.4 m -63.39 -53.13 57.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.068 0.947 . . . . 0.0 109.182 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -64.87 -47.6 77.28 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.73 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -53.41 -44.87 69.07 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.422 0.556 . . . . 0.0 111.722 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.5 mtp -73.79 -43.78 57.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.554 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mp -55.24 -50.88 68.33 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.058 0.845 . . . . 0.0 109.186 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -52.71 63.2 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 126.759 2.023 . . . . 0.0 111.289 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -55.5 -49.38 72.71 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.005 0.821 . . . . 0.0 112.225 -178.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.9 mt -66.12 -48.84 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -55.13 -47.21 75.36 Favored 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.06 0.944 . . . . 0.0 111.0 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -59.03 -50.14 75.2 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.047 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.8 p -53.81 -51.44 63.5 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.937 1.244 . . . . 0.0 112.936 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -62.57 -49.74 74.06 Favored 'General case' 0 C--N 1.345 0.41 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.47 -43.31 94.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.638 -178.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.87 -36.71 85.22 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.634 -0.666 . . . . 0.0 109.778 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -60.26 -44.39 95.34 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -78.69 -17.33 56.08 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.987 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -81.46 -24.13 37.0 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.003 1.274 . . . . 0.0 109.735 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.8 tp . . . . . 0 CA--C 1.534 0.339 0 C-N-CA 124.14 0.976 . . . . 0.0 109.006 -179.963 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 120.302 0.096 . . . . 0.0 111.098 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.3 m -57.08 -51.13 70.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.234 1.414 . . . . 0.0 109.905 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 66.8 mt -59.1 -45.19 92.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 124.99 1.316 . . . . 0.0 108.92 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -60.23 -45.46 93.14 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.4 m -61.26 -48.19 82.58 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.109 0.963 . . . . 0.0 108.525 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.4 -50.42 71.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.784 0.833 . . . . 0.0 109.179 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttt-85 -56.09 -47.04 78.8 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 119.221 -0.419 . . . . 0.0 110.985 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -56.93 15.03 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.429 1.092 . . . . 0.0 110.423 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -55.76 -35.86 66.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.357 1.063 . . . . 0.0 111.352 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -69.51 -48.74 59.52 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -60.26 -38.8 84.65 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.59 1.156 . . . . 0.0 111.183 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 C-N-CA 124.037 0.935 . . . . 0.0 110.715 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 51.7 m . . . . . 0 N--CA 1.447 -0.614 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -120.68 130.58 54.15 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 121.675 0.75 . . . . 0.0 109.445 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -112.26 159.12 18.93 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 127.529 2.332 . . . . 0.0 109.846 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.431 ' HB3' ' HE2' ' D' 1116 ' ' LYS . 28.5 mt -150.65 142.27 23.59 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 179.082 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -147.69 106.92 3.87 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.117 1.767 . . . . 0.0 112.068 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . 0.433 ' HB ' ' HE3' ' D' 1116 ' ' LYS . 53.2 t -155.22 149.75 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 120.39 1.45 . . . . 0.0 110.425 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.1 102.42 14.95 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 102.575 -3.12 . . . . 0.0 102.575 176.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.65 109.78 0.56 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 115.671 -2.738 . . . . 0.0 106.44 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -68.32 -56.98 6.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 121.873 2.837 . . . . 0.0 112.002 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -64.31 -46.55 83.06 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.29 -51.19 60.0 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 125.062 1.345 . . . . 0.0 110.781 -178.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -65.78 -45.74 81.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 119.753 1.161 . . . . 0.0 112.497 -178.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -55.55 -53.65 53.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.964 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.0 -57.17 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 124.902 1.281 . . . . 0.0 109.452 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 49.6 mt -57.08 -27.99 62.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.823 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.5 mmm -72.39 -52.16 17.25 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.35 -45.44 69.13 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.6 mt -67.03 -31.47 72.02 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -68.01 -56.55 8.51 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -52.89 -57.0 11.72 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 128.64 2.776 . . . . 0.0 110.319 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 11.6 t -54.47 -52.12 62.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.083 1.353 . . . . 0.0 111.6 -179.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.99 -30.75 70.95 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.485 1.039 . . . . 0.0 111.161 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -65.8 -45.43 82.41 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 120.998 1.726 . . . . 0.0 108.347 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 30.1 mt -63.14 -49.86 72.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.13 0.972 . . . . 0.0 109.582 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 ttt -56.86 -35.49 68.95 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.654 0.782 . . . . 0.0 110.605 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -72.43 -33.03 66.8 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.383 1.073 . . . . 0.0 112.458 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.1 pp -93.15 -31.37 14.81 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 66.3 t -84.32 145.68 46.03 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 125.476 1.51 . . . . 0.0 108.392 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.74 -176.7 1.01 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.549 2.833 . . . . 0.0 111.959 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.78 34.76 0.21 Allowed Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.1 -44.87 21.85 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 122.857 2.056 . . . . 0.0 112.766 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.5 -26.17 67.04 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 13.9 t -72.23 -47.76 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -59.24 -51.7 68.84 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.785 1.234 . . . . 0.0 111.319 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 19.4 m -62.08 -49.15 77.09 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 122.358 -0.214 . . . . 0.0 110.822 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -63.09 -38.37 90.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.306 -0.246 . . . . 0.0 110.996 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -44.69 87.57 Favored 'General case' 0 C--N 1.337 0.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -66.18 -44.44 83.98 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.244 0.618 . . . . 0.0 109.996 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -59.66 -55.29 36.29 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.172 0.989 . . . . 0.0 111.233 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -37.49 84.8 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -58.21 -34.84 70.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.719 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.86 -25.33 68.23 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 120.314 1.415 . . . . 0.0 111.457 178.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp . . . . . 0 N--CA 1.464 0.265 0 CA-C-N 119.461 1.028 . . . . 0.0 112.911 -179.903 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.73 109.32 0.9 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.14 151.36 34.5 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 105.709 -1.96 . . . . 0.0 105.709 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -117.83 101.28 8.18 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.36 0.982 . . . . 0.0 109.461 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 10.3 tp -75.52 112.04 17.22 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 117.154 -1.403 . . . . 0.0 109.845 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -88.84 117.46 0.88 Allowed 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 124.46 3.44 . . . . 0.0 111.514 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.8 t -145.75 149.24 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.129 0.877 . . . . 0.0 112.981 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -133.64 100.41 4.78 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 175.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.57 104.19 0.22 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 105.633 -2.987 . . . . 0.0 105.633 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 24.2 tpt180 -57.27 -51.43 69.41 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 121.122 2.461 . . . . 0.0 111.8 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.7 -41.5 87.92 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 118.593 0.633 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -62.53 -35.98 81.14 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.131 0.972 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 35.0 t80 -69.45 -50.45 45.47 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.825 -1.172 . . . . 0.0 109.298 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -56.33 -54.51 44.65 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.502 1.121 . . . . 0.0 110.297 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 45.9 mtp -63.45 -38.05 89.64 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.506 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.88 -46.15 86.18 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.106 1.321 . . . . 0.0 110.021 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.33 -48.21 76.42 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 123.924 0.89 . . . . 0.0 111.431 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -55.65 -49.09 73.82 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.612 0.765 . . . . 0.0 110.783 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 95.6 mt -66.54 -49.62 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -53.38 -44.43 68.61 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 124.132 0.973 . . . . 0.0 111.164 -179.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -62.65 -48.67 78.32 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.42 -179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 86.4 p -53.64 -46.85 70.66 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.822 1.192 . . . . 0.0 112.781 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.93 -58.08 5.14 Favored 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 123.331 0.652 . . . . 0.0 112.552 -179.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.94 -52.47 62.89 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.372 1.069 . . . . 0.0 111.398 -178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.9 -43.33 94.88 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.496 -0.752 . . . . 0.0 111.757 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 17.0 tmm? -62.95 -43.76 97.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 118.72 0.691 . . . . 0.0 110.956 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -67.51 -23.45 65.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.684 0.675 . . . . 0.0 111.02 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.93 -23.01 39.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.282 0.633 . . . . 0.0 110.407 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 24.5 tp . . . . . 0 CA--C 1.537 0.453 0 C-N-CA 124.687 1.195 . . . . 0.0 110.609 179.899 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 14.9 m-70 . . . . . 0 CA--C 1.534 0.344 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 57.0 m -61.63 -50.62 71.81 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 72.1 mt -59.79 -47.12 92.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 126.341 1.856 . . . . 0.0 108.726 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -54.51 -48.22 72.17 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.779 1.632 . . . . 0.0 111.033 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.0 m -66.3 -46.13 78.02 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.122 0.969 . . . . 0.0 108.87 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -42.72 81.11 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 124.011 0.925 . . . . 0.0 110.192 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -58.54 -46.76 86.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.51 -41.81 96.2 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.643 -1.17 . . . . 0.0 111.0 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.34 -49.46 72.16 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.951 1.25 . . . . 0.0 109.111 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -60.33 -47.25 86.82 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.072 0.949 . . . . 0.0 110.28 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -64.65 -29.73 70.73 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.73 0.812 . . . . 0.0 111.977 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.336 0 C-N-CA 124.685 1.194 . . . . 0.0 110.764 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 29.0 m . . . . . 0 C--O 1.235 0.32 0 CA-C-O 121.448 0.642 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -107.16 134.8 49.73 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.59 144.67 47.99 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 128.206 2.602 . . . . 0.0 112.437 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 62.2 mt -147.57 155.16 41.55 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.353 1.461 . . . . 0.0 110.145 178.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -152.16 108.84 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.565 1.546 . . . . 0.0 111.927 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 95.0 t -153.19 150.15 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-N 120.344 1.429 . . . . 0.0 109.757 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.54 102.92 12.82 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.2 113.68 0.79 Allowed Glycine 0 N--CA 1.454 -0.141 0 N-CA-C 106.65 -2.58 . . . . 0.0 106.65 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -64.92 -57.03 9.86 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 121.265 2.533 . . . . 0.0 110.538 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 19.8 mttp -63.18 -42.5 99.37 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.965 0.802 . . . . 0.0 108.98 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -60.03 -40.75 90.42 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.296 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 28.8 t80 -65.25 -43.7 90.51 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 120.372 1.442 . . . . 0.0 109.23 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -58.37 -53.75 54.82 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.113 0.87 . . . . 0.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.75 -57.91 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.197 1.399 . . . . 0.0 110.132 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 66.8 mt -59.47 -35.85 74.87 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 117.15 -1.405 . . . . 0.0 111.309 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -49.46 74.42 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 120.557 1.526 . . . . 0.0 108.602 178.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 51.8 mttm -53.57 -50.94 64.47 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.29 -33.01 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1116 ' ' LYS . . . . . 0.433 ' HE3' ' HB ' ' B' ' 103' ' ' VAL . 27.8 tptt -64.79 -57.96 7.52 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -52.28 -49.39 64.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.487 1.915 . . . . 0.0 108.319 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 28.7 t -52.96 -55.02 26.54 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.238 1.815 . . . . 0.0 114.281 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.56 -36.47 82.73 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.473 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -68.81 -38.1 79.68 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.738 1.154 . . . . 0.0 110.222 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 46.7 mt -65.33 -44.93 86.24 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.923 -0.486 . . . . 0.0 109.882 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttt -61.86 -38.32 87.8 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.244 1.018 . . . . 0.0 110.693 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.47 -44.08 79.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.749 -0.594 . . . . 0.0 110.643 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.3 pp -75.65 -31.78 59.95 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.42 147.37 34.28 Favored Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 120.105 1.32 . . . . 0.0 110.064 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -73.2 177.48 7.78 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.057 1.838 . . . . 0.0 108.95 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.61 47.12 0.28 Allowed Pre-proline 0 CA--C 1.556 1.178 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -178.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.45 -48.03 0.64 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.091 1.861 . . . . 0.0 112.981 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.92 -25.89 68.35 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 17.2 t -72.12 -48.15 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 126.22 1.808 . . . . 0.0 108.755 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.67 -41.41 81.48 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.505 0.722 . . . . 0.0 110.145 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 50.8 m -70.84 -50.23 37.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.352 1.061 . . . . 0.0 110.877 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.53 -35.59 78.16 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.323 0.965 . . . . 0.0 110.368 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.61 -47.16 86.68 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -60.84 -48.12 83.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.499 1.045 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -56.57 -57.86 10.56 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.312 1.045 . . . . 0.0 111.448 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -34.86 78.95 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.859 -0.526 . . . . 0.0 111.976 -178.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.87 -27.53 68.29 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.42 -38.75 85.05 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.714 0 C-N-CA 126.581 1.952 . . . . 0.0 112.338 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 121.917 0.865 . . . . 0.0 111.574 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 13.0 tp -73.16 94.7 1.98 Allowed 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mt -93.32 161.24 14.48 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.029 0.931 . . . . 0.0 110.761 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -134.16 118.61 17.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.627 1.571 . . . . 0.0 108.756 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 43.6 tp -108.96 100.2 38.87 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 123.796 0.838 . . . . 0.0 110.532 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.74 125.42 7.45 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.202 2.601 . . . . 0.0 111.16 178.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.2 t -145.15 146.18 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.788 1.635 . . . . 0.0 107.919 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -126.01 100.19 6.25 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.4 126.14 1.37 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -66.99 -52.68 39.75 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 120.781 2.291 . . . . 0.0 109.712 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.95 -33.72 75.2 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 122.4 0.28 . . . . 0.0 110.751 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -45.87 92.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -67.03 -40.05 87.11 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.089 0.404 . . . . 0.0 111.435 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -60.48 -57.36 13.07 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.588 0.755 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.4 ppp? -62.87 -38.94 92.88 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.822 -0.608 . . . . 0.0 110.591 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.38 -50.6 72.24 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mt -59.51 -47.31 86.03 Favored 'General case' 0 C--O 1.23 0.066 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.298 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -62.59 -47.37 84.11 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.489 1.04 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.5 mt -65.03 -41.03 90.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 123.707 0.803 . . . . 0.0 110.371 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -62.47 -60.07 4.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.569 1.148 . . . . 0.0 108.726 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.19 -47.14 84.35 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.192 0.932 . . . . 0.0 110.557 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.7 t -52.46 -51.61 58.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.287 0.949 . . . . 0.0 112.631 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.46 -47.67 69.44 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.462 0.574 . . . . 0.0 109.484 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -55.25 -49.44 72.03 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 118.203 0.456 . . . . 0.0 111.665 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.26 -46.23 67.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 117.541 -1.219 . . . . 0.0 110.112 -178.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -36.02 72.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 120.134 1.334 . . . . 0.0 110.596 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -69.64 -35.59 75.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.104 1.362 . . . . 0.0 110.678 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -83.72 -36.86 23.36 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.673 0.789 . . . . 0.0 113.016 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 CA--C 1.536 0.406 0 CA-C-N 119.228 0.922 . . . . 0.0 108.55 179.549 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 83.0 t60 . . . . . 0 CA--C 1.535 0.38 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.9 m -59.84 -38.24 81.51 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.751 0.705 . . . . 0.0 110.963 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.58 -42.45 96.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.95 0.9 . . . . 0.0 109.16 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -62.82 -50.08 72.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.557 0.743 . . . . 0.0 109.132 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.46 -37.52 83.87 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.265 0.555 . . . . 0.0 110.191 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -66.73 -54.08 26.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.318 1.047 . . . . 0.0 111.362 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -63.94 -33.23 75.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.845 1.202 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -61.32 -57.99 10.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.678 -1.231 . . . . 0.0 107.678 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -65.17 -30.71 71.64 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.205 0.911 . . . . 0.0 113.206 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -58.17 -46.72 85.24 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -76.11 -51.34 12.43 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 111.593 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 . . . . . 0 C--O 1.222 -0.376 0 CA-C-O 116.698 -1.62 . . . . 0.0 113.649 -177.922 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.445 0 CA-C-O 121.051 0.453 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -122.65 148.75 44.91 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.094 0.957 . . . . 0.0 109.425 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -134.3 160.18 38.69 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 124.603 1.161 . . . . 0.0 109.292 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 79.1 mt -144.3 161.19 39.57 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -150.57 110.11 4.02 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.287 1.835 . . . . 0.0 106.954 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . 0.413 ' HB ' ' HE3' ' D' 1116 ' ' LYS . 1.9 m -155.89 151.32 9.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.115 0.966 . . . . 0.0 111.473 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 -117.6 100.62 7.75 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 119.744 1.156 . . . . 0.0 111.682 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.4 119.65 1.25 Allowed Glycine 0 CA--C 1.521 0.427 0 CA-C-O 116.429 -2.317 . . . . 0.0 109.058 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -61.55 -56.89 15.09 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 121.451 2.626 . . . . 0.0 109.298 178.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -58.59 -47.13 85.33 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.23 0.612 . . . . 0.0 109.652 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -58.89 -44.71 91.22 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 112.525 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -64.13 -44.92 90.72 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 120.645 1.566 . . . . 0.0 110.596 -178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -56.37 -54.16 48.78 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 122.016 0.912 . . . . 0.0 111.694 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 57.6 mt -69.1 -49.18 64.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -177.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 76.7 mt -61.44 -38.17 86.2 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 119.75 1.159 . . . . 0.0 110.657 -179.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 69.4 mtp -61.42 -52.89 62.71 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.316 0.962 . . . . 0.0 110.032 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -63.34 -40.73 98.11 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.379 -178.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.84 -36.45 78.17 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.547 1.067 . . . . 0.0 111.207 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 7.2 tptp -70.66 -47.34 60.45 Favored 'General case' 0 N--CA 1.462 0.152 0 O-C-N 120.343 -1.473 . . . . 0.0 108.484 178.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -58.16 -51.59 69.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.411 1.485 . . . . 0.0 110.233 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.3 m -61.0 -39.94 91.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.509 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -41.96 89.92 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 119.128 0.876 . . . . 0.0 109.122 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.16 -36.72 84.97 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.48 0.582 . . . . 0.0 111.149 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -68.17 -47.97 66.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 33.1 ttp -65.9 -27.97 68.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 118.728 0.695 . . . . 0.0 109.993 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -68.63 -39.57 80.69 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.061 -0.971 . . . . 0.0 109.191 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.9 -24.23 44.3 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.993 1.27 . . . . 0.0 111.55 179.072 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.54 145.05 66.64 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.21 -84.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.841 0 N-CA-C 108.377 -1.432 . . . . 0.0 108.377 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -167.65 63.04 0.63 Allowed Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 125.013 1.325 . . . . 0.0 110.14 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -70.93 -106.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 124.049 3.166 . . . . 0.0 112.178 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.41 -25.6 66.06 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 120.906 -1.122 . . . . 0.0 109.168 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 t -54.98 -45.15 76.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.509 1.124 . . . . 0.0 108.559 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -74.9 -44.17 50.3 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.861 0.865 . . . . 0.0 110.998 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 22.9 t -61.96 -51.55 67.63 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.288 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.6 -39.5 93.83 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.072 0.949 . . . . 0.0 110.488 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -55.83 -46.98 77.99 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-N 118.999 0.818 . . . . 0.0 109.152 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -65.36 -51.89 57.44 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.89 -47.69 70.84 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.148 0.979 . . . . 0.0 112.996 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.98 -34.5 75.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.576 1.08 . . . . 0.0 109.053 179.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -28.05 69.2 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.039 -1.038 . . . . 0.0 109.536 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 58.9 mt -63.45 -15.65 58.34 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.087 0.858 . . . . 0.0 112.235 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.8 tt . . . . . 0 CA--C 1.536 0.428 0 C-N-CA 124.917 1.287 . . . . 0.0 110.302 178.822 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 7.3 tp10 . . . . . 0 N--CA 1.441 -0.923 0 CA-C-O 121.969 0.89 . . . . 0.0 112.673 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.5 tp -72.86 95.91 2.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.881 1.672 . . . . 0.0 106.787 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 46.3 mt -100.31 168.81 9.54 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -140.23 147.23 39.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.878 1.271 . . . . 0.0 108.743 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 33.3 tp -124.02 94.5 45.48 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.037 1.335 . . . . 0.0 108.02 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.56 121.48 5.59 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.764 2.309 . . . . 0.0 109.505 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.9 t -144.94 159.92 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.298 1.039 . . . . 0.0 109.674 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 12.7 ptt-85 -136.52 102.9 5.08 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.988 1.267 . . . . 0.0 109.186 176.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.97 139.01 5.5 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 117.613 -1.66 . . . . 0.0 110.274 178.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -71.03 -52.09 21.55 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.618 2.209 . . . . 0.0 106.901 177.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.3 -46.5 67.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.669 1.188 . . . . 0.0 107.817 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -56.41 -44.93 80.83 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.217 0.462 . . . . 0.0 111.308 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.2 t80 -65.29 -51.57 59.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.765 0.712 . . . . 0.0 111.0 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -54.97 -57.11 12.99 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.477 1.111 . . . . 0.0 111.414 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ppp? -61.02 -46.78 89.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.513 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 33.9 mt -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 117.747 -1.121 . . . . 0.0 110.427 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.63 -53.14 61.11 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 120.048 1.295 . . . . 0.0 110.632 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -55.58 -48.62 74.52 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.69 -43.07 86.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 122.996 0.518 . . . . 0.0 112.264 -178.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -66.57 -48.92 68.08 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 118.159 -0.924 . . . . 0.0 109.817 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.83 -44.86 91.96 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.238 -0.887 . . . . 0.0 108.611 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 16.2 t -56.97 -38.09 72.52 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.661 1.119 . . . . 0.0 111.737 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.5 tm? -71.09 -57.75 4.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.195 0.598 . . . . 0.0 110.743 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -56.35 -48.04 77.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.875 0.47 . . . . 0.0 110.119 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.14 -47.04 86.75 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 118.279 -0.867 . . . . 0.0 109.523 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.3 68.66 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.372 0.987 . . . . 0.0 110.907 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -71.58 -34.59 70.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.663 0.785 . . . . 0.0 111.734 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -77.84 -27.51 49.91 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.887 1.221 . . . . 0.0 110.637 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 CA--C 1.537 0.454 0 C-N-CA 123.946 0.898 . . . . 0.0 109.357 178.95 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.5 t-160 . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 23.8 m -65.49 -34.1 77.47 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.981 -1.074 . . . . 0.0 111.123 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.91 -44.94 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.268 1.427 . . . . 0.0 109.921 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.77 -56.75 13.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.584 1.153 . . . . 0.0 108.759 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 83.0 m -59.24 -36.43 75.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.339 -0.838 . . . . 0.0 110.67 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 32.0 t80 -61.09 -53.89 51.46 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.293 0.951 . . . . 0.0 109.158 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -41.67 94.47 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.975 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.58 -46.58 89.69 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.061 0.846 . . . . 0.0 110.708 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -66.41 -40.23 89.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.957 0.799 . . . . 0.0 110.625 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -57.74 -52.62 64.72 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.701 1.2 . . . . 0.0 108.822 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -64.15 -43.86 93.92 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.069 0.948 . . . . 0.0 111.017 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 . . . . . 0 C--N 1.339 0.121 0 CA-C-O 117.078 -1.439 . . . . 0.0 113.108 -179.125 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 40.6 m . . . . . 0 C--O 1.233 0.199 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -115.69 158.27 23.03 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -138.13 161.26 37.26 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.973 0.909 . . . . 0.0 108.961 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 69.3 mt -139.08 153.36 48.03 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -146.94 99.49 3.19 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 127.861 2.465 . . . . 0.0 105.798 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.49 151.09 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 124.467 1.107 . . . . 0.0 111.146 -178.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.49 102.06 8.01 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 122.212 1.006 . . . . 0.0 110.266 178.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.63 110.02 0.57 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.848 -2.501 . . . . 0.0 106.848 178.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 -55.53 -57.46 11.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 121.358 2.579 . . . . 0.0 112.43 -179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 98.7 mttt -66.37 -39.51 89.16 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.001 -0.437 . . . . 0.0 110.026 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -56.5 -50.71 71.0 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.976 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.08 -43.88 97.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.15 0.886 . . . . 0.0 111.464 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.33 -51.62 69.01 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.551 0.614 . . . . 0.0 110.823 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 83.9 mt -66.9 -54.53 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.58 1.152 . . . . 0.0 110.742 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.34 -32.66 68.73 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.189 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 31.4 mtp -66.3 -52.08 50.92 Favored 'General case' 0 C--N 1.345 0.383 0 CA-C-N 119.764 1.166 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -60.69 -41.56 95.4 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 119.303 -0.959 . . . . 0.0 110.712 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.07 -60.79 2.64 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.659 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1116 ' ' LYS . . . . . 0.413 ' HE3' ' HB ' ' B' ' 103' ' ' VAL . 15.7 tptp -53.88 -45.11 70.94 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.298 0.954 . . . . 0.0 112.724 -178.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.05 -49.75 74.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.661 0.6 . . . . 0.0 109.481 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.9 m -61.71 -34.84 76.5 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.85 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -66.07 -42.07 89.91 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.928 1.291 . . . . 0.0 108.508 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.32 -44.01 89.19 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.83 -38.02 89.09 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.424 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttp -77.26 -20.05 55.69 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 120.548 1.522 . . . . 0.0 109.957 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -81.89 -26.07 34.45 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.077 -1.014 . . . . 0.0 111.079 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -92.08 -33.55 14.74 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.316 -0.865 . . . . 0.0 110.441 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 80.5 t -85.32 147.14 46.47 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.93 -88.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.018 3.145 . . . . 0.0 114.818 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -170.64 58.64 0.29 Allowed Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.341 1.456 . . . . 0.0 110.864 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.3 -90.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.421 2.747 . . . . 0.0 113.39 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.6 -25.1 67.24 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.7 t -54.61 -56.4 10.54 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.675 1.19 . . . . 0.0 108.937 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 13.2 t0 -69.4 -44.64 71.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.683 0.674 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 7.6 t -55.82 -50.44 70.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.118 0.567 . . . . 0.0 111.621 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 17.9 t80 -69.08 -43.75 73.92 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -45.58 69.51 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 119.411 1.005 . . . . 0.0 110.56 179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -64.76 -53.12 52.15 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 119.623 1.101 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.5 -40.89 75.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.44 1.496 . . . . 0.0 111.39 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.04 -32.29 39.5 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.341 1.856 . . . . 0.0 110.251 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -57.08 -39.25 74.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 58.0 mt -53.62 -21.44 6.74 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.565 0 C-N-CA 124.489 1.116 . . . . 0.0 111.99 179.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 . . . . . 0 C--O 1.233 0.225 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.94 127.29 32.12 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 43.0 mt -120.47 173.91 6.87 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.297 1.439 . . . . 0.0 109.634 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -139.84 149.82 43.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.12 96.55 47.57 Favored Pre-proline 0 CA--C 1.536 0.439 0 C-N-CA 124.772 1.229 . . . . 0.0 108.653 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.71 110.97 1.69 Allowed 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.3 3.333 . . . . 0.0 112.9 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.9 t -144.84 158.77 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.849 1.204 . . . . 0.0 110.46 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 50.0 ttt-85 -135.05 103.44 5.56 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.062 1.345 . . . . 0.0 108.651 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.22 132.6 2.65 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 108.181 -1.968 . . . . 0.0 108.181 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt85 -70.63 -51.35 28.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 121.132 2.466 . . . . 0.0 109.885 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.09 -36.3 77.43 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 m -63.29 -52.22 62.86 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.218 -0.896 . . . . 0.0 109.787 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -58.17 -47.79 82.3 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 119.719 1.145 . . . . 0.0 110.337 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -54.15 -57.19 12.07 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.803 0.69 . . . . 0.0 112.319 -179.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -66.95 -43.8 82.22 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.076 0.55 . . . . 0.0 111.929 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.2 tp -55.83 -49.21 73.89 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.785 0.834 . . . . 0.0 110.016 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 tt -70.48 -47.87 58.5 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.032 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -55.35 -44.84 76.33 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.887 1.221 . . . . 0.0 113.657 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -75.4 -32.17 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -68.29 -41.88 80.32 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.462 -1.399 . . . . 0.0 109.252 178.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.34 -55.5 17.88 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 125.653 1.581 . . . . 0.0 110.791 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 p -54.16 -43.41 70.59 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.626 0.648 . . . . 0.0 110.594 179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.01 -56.49 8.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.808 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -53.71 -43.39 68.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.406 1.003 . . . . 0.0 111.743 -178.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.9 -53.68 19.79 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.165 -0.922 . . . . 0.0 108.842 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -54.93 -49.08 72.19 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.122 1.328 . . . . 0.0 110.835 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -64.03 -27.18 68.94 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.047 0.84 . . . . 0.0 110.995 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -77.39 -49.26 15.26 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.516 1.053 . . . . 0.0 110.687 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.537 0 C-N-CA 125.084 1.353 . . . . 0.0 113.027 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 t60 . . . . . 0 CA--C 1.534 0.36 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.74 -49.12 78.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.331 1.452 . . . . 0.0 111.813 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.6 mm -60.68 -43.51 95.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 124.924 1.289 . . . . 0.0 109.699 -178.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.62 -53.16 61.44 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 125.524 1.53 . . . . 0.0 108.407 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.6 m -63.3 -34.67 78.2 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.085 -0.96 . . . . 0.0 110.96 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -61.53 -49.16 77.81 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 120.618 1.554 . . . . 0.0 107.942 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.61 -45.86 92.28 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.238 1.015 . . . . 0.0 109.093 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -60.34 -44.8 95.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.543 1.537 . . . . 0.0 111.93 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.24 -45.89 91.29 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.076 1.351 . . . . 0.0 110.528 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -60.05 -50.95 71.7 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.05 -0.66 . . . . 0.0 110.635 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.52 -35.27 80.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 118.505 -0.759 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 . . . . . 0 C--O 1.225 -0.221 0 CA-C-N 119.293 0.951 . . . . 0.0 111.022 179.759 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.239 0.521 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -113.16 131.08 55.99 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -107.22 159.74 16.12 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.016 0.926 . . . . 0.0 112.574 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 mp -143.65 156.17 44.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 126.004 1.722 . . . . 0.0 106.97 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 100.85 2.86 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.452 1.901 . . . . 0.0 106.574 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 3.6 m -149.22 151.55 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -178.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt85 -118.52 101.7 8.34 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 122.68 1.228 . . . . 0.0 109.066 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.13 106.59 0.42 Allowed Glycine 0 N--CA 1.451 -0.366 1 N-CA-C 102.924 -4.07 . . . . 0.0 102.924 176.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -60.26 -56.69 18.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.099 2.949 . . . . 0.0 111.353 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -62.93 -39.9 95.98 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -61.99 -52.38 64.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.019 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.5 -51.39 59.73 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 120.206 1.366 . . . . 0.0 111.819 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -58.36 -53.49 57.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.671 0.668 . . . . 0.0 111.03 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.2 mt -61.3 -54.11 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 O-C-N 121.438 -0.789 . . . . 0.0 110.731 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 82.8 mt -54.97 -41.7 71.49 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.384 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 14.2 mtp -57.2 -51.26 70.05 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 120.928 1.695 . . . . 0.0 108.848 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.33 -52.33 66.1 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 122.611 0.365 . . . . 0.0 110.291 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 43.2 mt -58.6 -42.89 89.17 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 122.775 0.43 . . . . 0.0 111.12 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -62.5 -57.43 11.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.6 1.16 . . . . 0.0 110.889 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -60.45 -41.17 93.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 118.649 0.658 . . . . 0.0 110.016 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 2.9 t -61.02 -42.24 98.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.986 -0.446 . . . . 0.0 109.874 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.26 -35.92 71.57 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 117.351 -1.309 . . . . 0.0 109.92 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -63.52 -40.01 95.91 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.252 1.387 . . . . 0.0 108.931 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 36.3 mt -66.89 -53.35 33.07 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 5.7 tpt -56.89 -34.66 68.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.041 0.936 . . . . 0.0 110.355 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.43 -41.73 84.32 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.485 1.514 . . . . 0.0 110.857 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.45 -33.03 64.68 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.529 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 20.3 m -86.79 148.7 46.52 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-N 119.521 1.055 . . . . 0.0 111.831 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -75.94 -106.1 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.05 2.5 . . . . 0.0 106.875 178.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.73 74.44 7.12 Favored Pre-proline 0 CA--C 1.542 0.638 0 O-C-N 119.71 -1.869 . . . . 0.0 111.431 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -81.12 -100.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 124.725 3.617 . . . . 0.0 111.539 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.7 tt -56.11 -34.71 66.3 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 120.724 -1.235 . . . . 0.0 109.499 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 73.5 t -51.83 -54.44 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 126.114 1.765 . . . . 0.0 109.698 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.09 -49.52 77.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.036 0.934 . . . . 0.0 110.007 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 25.9 t -56.03 -50.54 70.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.363 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -67.01 -35.01 78.97 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.541 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -58.08 -48.53 79.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.643 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.75 -42.6 70.27 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.078 0.854 . . . . 0.0 111.763 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -57.17 -45.42 83.69 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 118.64 0.655 . . . . 0.0 111.233 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -77.32 -31.72 54.8 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.092 0.957 . . . . 0.0 110.773 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -57.72 -37.78 74.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 119.792 1.178 . . . . 0.0 109.188 178.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.8 -18.21 53.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.737 0.815 . . . . 0.0 112.237 179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 19.9 tp . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 124.461 1.104 . . . . 0.0 111.141 179.074 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 26.9 tp -78.22 108.29 11.43 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.99 165.04 11.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.288 0.949 . . . . 0.0 111.456 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -142.58 156.67 45.12 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.455 1.502 . . . . 0.0 108.17 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -135.0 105.79 10.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.393 -179.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -79.58 116.5 3.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.437 2.758 . . . . 0.0 110.941 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.8 t -145.03 147.13 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.593 1.088 . . . . 0.0 111.039 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -133.97 101.61 5.12 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.5 126.97 1.49 Allowed Glycine 0 CA--C 1.519 0.315 0 N-CA-C 105.447 -3.061 . . . . 0.0 105.447 177.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -65.68 -51.57 58.4 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 121.54 2.67 . . . . 0.0 108.791 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.22 -42.82 83.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.338 0.655 . . . . 0.0 109.758 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 8.0 m -55.78 -47.71 76.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.213 1.405 . . . . 0.0 108.785 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.0 t80 -69.32 -50.48 46.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.515 1.126 . . . . 0.0 111.068 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.68 -51.0 66.88 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.952 1.301 . . . . 0.0 112.761 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.4 ttm -65.6 -51.3 60.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.804 0.442 . . . . 0.0 110.147 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -41.54 95.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.253 -178.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.79 -38.25 79.84 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.502 1.501 . . . . 0.0 108.85 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -59.38 -42.14 90.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.164 0.893 . . . . 0.0 108.735 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 94.1 mt -72.66 -38.28 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.797 0.839 . . . . 0.0 110.016 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -61.45 -54.43 43.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 O-C-N 121.071 -1.018 . . . . 0.0 109.492 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -53.08 60.86 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.132 1.373 . . . . 0.0 111.058 -178.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 35.7 p -55.24 -51.56 66.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.99 -41.58 82.06 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 118.774 -0.632 . . . . 0.0 112.439 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.33 -44.93 95.36 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.59 -48.86 65.62 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.665 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 7.7 tmm? -55.36 -44.64 76.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.587 0.63 . . . . 0.0 109.977 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -79.9 -19.9 47.1 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 118.122 -0.942 . . . . 0.0 113.43 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 72.1 t80 -86.3 -27.73 24.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.437 1.017 . . . . 0.0 110.169 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 25.3 tp . . . . . 0 CA--C 1.541 0.614 0 C-N-CA 125.548 1.539 . . . . 0.0 110.177 179.541 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 71.2 t60 . . . . . 0 C--O 1.224 -0.242 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -45.19 83.73 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.113 -0.992 . . . . 0.0 111.686 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 9.4 mm -64.13 -34.45 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 124.908 1.283 . . . . 0.0 110.037 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -69.77 -56.69 6.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 14.0 m -54.01 -40.87 67.38 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.571 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 3.7 t80 -60.25 -54.41 46.11 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.69 1.586 . . . . 0.0 109.819 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -34.72 78.03 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.518 0.727 . . . . 0.0 111.908 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -72.29 -46.64 54.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.811 1.244 . . . . 0.0 109.841 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -60.01 -42.12 93.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.336 1.054 . . . . 0.0 110.937 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -67.31 -47.59 70.12 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.136 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -57.74 -40.83 80.6 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.124 0.57 . . . . 0.0 110.493 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 . . . . . 0 C--O 1.225 -0.185 0 C-N-CA 124.036 0.934 . . . . 0.0 111.623 179.568 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.38 0 CA-C-O 120.785 0.326 . . . . 0.0 110.914 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -101.58 128.45 47.83 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.903 -2.629 . . . . 0.0 103.903 178.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -103.59 145.04 30.63 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.984 1.314 . . . . 0.0 108.874 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.6 mp -140.1 151.39 45.31 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -139.95 111.1 6.99 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.712 1.605 . . . . 0.0 108.861 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.82 150.86 10.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 124.485 1.114 . . . . 0.0 111.805 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -124.53 99.73 6.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 122.093 0.949 . . . . 0.0 108.501 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.43 119.76 1.4 Allowed Glycine 0 CA--C 1.509 -0.318 0 N-CA-C 105.932 -2.867 . . . . 0.0 105.932 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -63.52 -56.91 12.29 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 121.533 2.666 . . . . 0.0 108.426 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -69.36 -38.29 78.0 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.155 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.63 -52.57 65.1 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.709 -178.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.39 -41.86 98.97 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.149 -0.969 . . . . 0.0 111.832 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -60.66 -53.94 51.33 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.507 0.723 . . . . 0.0 111.555 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 55.1 mt -70.32 -45.92 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 118.459 -0.782 . . . . 0.0 109.679 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.66 -44.71 81.62 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 119.576 1.08 . . . . 0.0 110.363 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 27.1 mtp -60.53 -45.98 91.83 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.008 1.276 . . . . 0.0 109.736 178.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -56.63 -49.63 74.41 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 34.1 mt -60.17 -48.46 81.63 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.58 0.752 . . . . 0.0 111.243 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 24.3 ttpt -54.62 -59.62 4.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 110.653 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.54 -47.97 75.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.008 0.923 . . . . 0.0 110.07 -179.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 34.4 t -53.35 -53.22 54.21 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.005 0.922 . . . . 0.0 111.119 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.82 -30.94 66.02 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 117.614 -1.184 . . . . 0.0 111.89 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -62.41 -41.65 98.84 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.969 1.713 . . . . 0.0 108.384 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 35.8 mt -67.95 -47.04 69.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.6 tpt -57.01 -35.84 69.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.377 0.671 . . . . 0.0 111.639 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.23 -43.08 74.77 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.872 1.669 . . . . 0.0 110.438 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.33 -25.32 60.58 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 33.5 m -92.65 148.85 36.97 Favored Pre-proline 0 CA--C 1.537 0.474 0 CA-C-N 119.226 0.921 . . . . 0.0 108.992 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -74.13 -105.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.059 2.506 . . . . 0.0 108.041 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -151.07 66.04 7.05 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 120.239 -1.538 . . . . 0.0 106.946 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.22 -103.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.427 2.751 . . . . 0.0 113.064 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.3 tt -62.52 -25.73 68.18 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.96 -1.088 . . . . 0.0 109.438 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 45.8 t -53.86 -56.96 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 C-N-CA 125.69 1.596 . . . . 0.0 109.192 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.22 -39.12 86.23 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.08 0.237 . . . . 0.0 111.08 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 1.9 t -60.12 -50.9 71.87 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.609 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.23 -33.09 74.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.097 0.959 . . . . 0.0 109.345 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -48.5 80.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 117.089 -1.434 . . . . 0.0 110.009 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -72.13 -46.42 56.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 120.052 1.296 . . . . 0.0 110.918 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -46.54 64.72 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.497 0.719 . . . . 0.0 110.324 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . 0.295 1.7 tp60 -81.08 -26.03 36.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -59.46 -36.2 75.51 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 120.403 1.456 . . . . 0.0 107.183 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 31.0 mt -61.97 -18.08 59.17 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.103 0.961 . . . . 0.0 112.243 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 8.3 tp . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 125.239 1.415 . . . . 0.0 111.635 179.625 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 . . . . . 0 C--O 1.233 0.2 0 N-CA-C 111.233 0.086 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -84.74 121.52 27.8 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 45.2 mt -108.15 161.94 14.52 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -140.5 104.89 4.85 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tp -87.87 110.22 33.42 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.362 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -87.04 123.26 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.424 3.416 . . . . 0.0 112.045 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 t -146.1 154.81 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 O-C-N 120.546 -1.346 . . . . 0.0 107.682 178.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 -135.08 100.67 4.63 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 134.72 3.37 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 106.674 -2.571 . . . . 0.0 106.674 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -69.87 -52.76 22.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 121.397 2.599 . . . . 0.0 110.595 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -66.43 -42.94 86.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.598 0.759 . . . . 0.0 110.004 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 62.8 m -65.32 -34.04 77.39 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.213 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -73.07 -48.35 36.67 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.96 1.709 . . . . 0.0 108.774 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -53.43 -56.08 19.78 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 123.936 0.894 . . . . 0.0 110.553 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 20.9 ptm -60.85 -42.68 98.28 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.127 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.07 -47.01 81.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 119.989 1.268 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -55.84 19.81 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.538 0.608 . . . . 0.0 110.278 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.68 -47.7 79.27 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 125.614 1.566 . . . . 0.0 112.828 -178.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.42 -36.18 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.333 0.653 . . . . 0.0 109.89 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.7 -48.89 65.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.17 -1.581 . . . . 0.0 108.197 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -55.22 -52.03 64.68 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.426 1.49 . . . . 0.0 110.327 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.2 p -56.72 -41.53 77.63 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.7 0.682 . . . . 0.0 111.572 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.1 -48.72 61.82 Favored 'General case' 0 CA--C 1.521 -0.163 0 O-C-N 121.412 -0.805 . . . . 0.0 111.432 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.39 -53.98 51.08 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 126.762 2.025 . . . . 0.0 111.928 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.53 -38.72 90.47 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 117.303 -1.332 . . . . 0.0 110.184 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 10.8 tmm? -63.44 -45.17 92.13 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.034 1.288 . . . . 0.0 107.792 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.89 -22.41 66.99 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.59 0.632 . . . . 0.0 110.508 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.82 -25.7 22.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.478 -1.389 . . . . 0.0 111.132 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 mt . . . . . 0 C--O 1.236 0.351 0 C-N-CA 126.926 2.09 . . . . 0.0 107.722 -179.24 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.43 -48.46 77.67 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.815 -0.553 . . . . 0.0 111.768 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.2 mm -62.52 -34.43 64.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.732 0.813 . . . . 0.0 111.203 -179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -61.72 -56.73 16.56 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.583 1.553 . . . . 0.0 108.472 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.7 m -61.35 -42.26 98.39 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -56.69 -53.42 57.94 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.438 0.695 . . . . 0.0 111.982 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -65.17 -39.62 93.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 118.762 -0.637 . . . . 0.0 110.821 -178.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.26 -49.26 78.33 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.34 -48.79 79.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.2 1.8 . . . . 0.0 110.559 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.16 -46.06 79.42 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 123.898 0.879 . . . . 0.0 110.148 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 tt0 -69.18 -42.64 75.58 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.021 1.328 . . . . 0.0 111.114 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 . . . . . 0 N--CA 1.465 0.316 0 C-N-CA 125.69 1.596 . . . . 0.0 108.864 179.523 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -109.45 143.79 38.57 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -117.48 161.64 19.25 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.175 1.39 . . . . 0.0 110.23 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 12.0 tp -161.22 117.32 2.18 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.16 103.17 9.29 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.214 1.406 . . . . 0.0 109.367 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . 0.442 HG12 ' HE2' ' D' 1116 ' ' LYS . 93.4 t -150.03 150.62 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.29 1.036 . . . . 0.0 110.318 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -108.44 102.67 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.806 1.242 . . . . 0.0 108.673 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.5 122.16 1.72 Allowed Glycine 0 N--CA 1.467 0.723 0 CA-C-O 115.802 -2.665 . . . . 0.0 109.067 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -68.03 -59.62 3.12 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 122.504 3.152 . . . . 0.0 113.387 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -73.24 -43.86 60.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -51.39 -51.0 58.52 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.799 1.639 . . . . 0.0 110.471 -178.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -72.11 -39.77 68.63 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.764 1.165 . . . . 0.0 111.411 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.53 -53.48 50.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.871 0.843 . . . . 0.0 109.544 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 12.5 mt -61.6 -48.27 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.752 1.621 . . . . 0.0 109.427 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -57.49 -41.04 79.94 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 117.983 -1.008 . . . . 0.0 111.311 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 20.2 mtp -66.25 -44.73 82.86 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.357 1.435 . . . . 0.0 110.179 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -55.63 -45.98 77.5 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 73.3 mt -72.59 -27.39 62.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.032 1.333 . . . . 0.0 112.84 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -60.68 2.92 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.46 1.104 . . . . 0.0 109.032 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -63.09 -38.14 90.01 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 124.403 1.065 . . . . 0.0 108.755 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 41.9 t -52.78 -54.25 36.64 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.922 0.783 . . . . 0.0 112.219 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.15 -33.09 72.88 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.036 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.7 -43.08 97.68 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.02 1.282 . . . . 0.0 109.601 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.26 -50.22 66.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.742 1.217 . . . . 0.0 109.566 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 10.4 tpt -62.77 -29.94 71.08 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.668 0.387 . . . . 0.0 110.936 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -76.13 -41.7 49.21 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.637 0.775 . . . . 0.0 110.714 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 pp -78.12 -33.47 50.53 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -86.74 146.63 41.66 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 119.298 0.954 . . . . 0.0 109.208 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.31 -172.74 0.37 Allowed 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.2 2.6 . . . . 0.0 109.575 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -107.64 62.51 0.22 Allowed Pre-proline 0 CA--C 1.548 0.876 0 O-C-N 120.288 -1.507 . . . . 0.0 113.519 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.37 -87.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.757 2.304 . . . . 0.0 112.792 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.3 -39.48 83.14 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 121.486 -0.759 . . . . 0.0 110.239 -178.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 m -56.05 -48.02 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 117.051 -1.452 . . . . 0.0 111.716 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -75.39 -32.22 60.71 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 120.869 1.668 . . . . 0.0 111.795 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 t -65.41 -46.89 78.21 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -69.35 -39.39 78.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.168 0.987 . . . . 0.0 109.459 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.02 -48.68 77.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 119.24 0.927 . . . . 0.0 110.122 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -68.85 -46.53 68.26 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -57.89 -44.17 86.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.393 0.542 . . . . 0.0 111.404 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -72.99 -33.61 65.91 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.864 1.666 . . . . 0.0 110.626 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -61.8 -37.24 83.65 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 119.524 1.056 . . . . 0.0 110.08 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.79 -24.21 63.92 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.675 0.39 . . . . 0.0 110.474 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 11.8 tp . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.623 1.169 . . . . 0.0 110.959 179.316 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 16.3 tp10 . . . . . 0 N--CA 1.452 -0.372 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 58.1 tp -73.39 112.84 9.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 177.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.3 mt -107.43 162.18 14.16 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.067 1.347 . . . . 0.0 108.783 -179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -137.71 144.35 41.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.202 1.001 . . . . 0.0 108.544 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 13.8 tp -118.57 96.25 49.73 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.79 115.27 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 123.298 2.665 . . . . 0.0 109.452 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.7 t -143.51 153.14 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 123.677 0.791 . . . . 0.0 110.462 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 41.5 ttt-85 -132.93 101.79 5.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 103.92 -2.622 . . . . 0.0 103.92 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.66 121.94 1.0 Allowed Glycine 0 CA--C 1.516 0.155 0 N-CA-C 105.479 -3.048 . . . . 0.0 105.479 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -66.43 -52.32 47.71 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 121.913 2.856 . . . . 0.0 109.801 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.37 -47.76 75.29 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -55.26 -41.47 72.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.343 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 29.8 t80 -73.9 -50.0 22.22 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.799 1.181 . . . . 0.0 111.095 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -54.47 -50.71 67.1 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.87 0.759 . . . . 0.0 110.707 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 25.7 ptm -65.52 -43.06 91.22 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.433 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.66 -42.08 99.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 120.014 1.279 . . . . 0.0 109.804 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.48 -56.46 21.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -56.74 -48.8 76.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.247 0.619 . . . . 0.0 112.5 -178.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 97.9 mt -67.36 -36.32 76.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.362 1.065 . . . . 0.0 112.143 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -48.8 46.33 Favored 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 120.44 -1.412 . . . . 0.0 108.267 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.14 -41.94 97.65 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.727 0.811 . . . . 0.0 109.298 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 95.4 p -59.97 -46.38 89.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.495 1.043 . . . . 0.0 110.818 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 8.1 tt -67.89 -51.07 52.29 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.745 0.818 . . . . 0.0 111.647 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -59.91 -53.73 54.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 124.009 0.924 . . . . 0.0 111.513 -178.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.72 -31.65 72.77 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 119.112 0.869 . . . . 0.0 111.581 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -69.01 -45.57 70.19 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 178.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -65.34 -29.85 70.63 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.611 -0.68 . . . . 0.0 110.222 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.9 t80 -80.28 -31.87 38.24 Favored 'General case' 0 C--N 1.339 0.116 0 C-N-CA 124.193 0.997 . . . . 0.0 111.267 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.999 1.32 . . . . 0.0 110.812 -178.062 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 77.8 m80 . . . . . 0 CA--C 1.534 0.35 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.87 -51.6 66.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.882 0.765 . . . . 0.0 111.573 -178.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.48 -37.75 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 124.254 1.021 . . . . 0.0 112.35 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -69.21 -53.84 17.86 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.285 0.948 . . . . 0.0 109.076 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.2 m -52.61 -43.69 65.53 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.447 0.567 . . . . 0.0 110.425 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 3.5 t80 -61.68 -54.27 44.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.306 1.442 . . . . 0.0 111.049 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -62.74 -33.46 75.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.959 0.345 . . . . 0.0 110.487 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -65.3 -44.93 86.35 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -59.14 -48.72 80.59 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 119.78 1.173 . . . . 0.0 109.535 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -53.81 -51.61 62.98 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.386 0.674 . . . . 0.0 111.16 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.84 -41.64 82.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.061 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 15.0 mm100 . . . . . 0 N--CA 1.462 0.137 0 CA-C-N 119.1 0.864 . . . . 0.0 109.307 179.182 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -102.64 145.42 29.68 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.918 -1.114 . . . . 0.0 108.894 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -124.58 143.64 50.59 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 125.274 1.43 . . . . 0.0 107.324 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 9.4 tp -144.9 142.26 29.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 118.327 -0.844 . . . . 0.0 108.928 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -139.51 107.97 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.031 1.332 . . . . 0.0 109.138 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 82.7 t -149.81 147.12 16.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 119.001 0.818 . . . . 0.0 109.095 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -102.19 103.61 14.14 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.775 0.83 . . . . 0.0 111.598 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.82 117.34 1.06 Allowed Glycine 0 N--CA 1.464 0.52 0 CA-C-O 115.994 -2.559 . . . . 0.0 108.125 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -67.48 -57.07 7.19 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 122.827 3.314 . . . . 0.0 111.452 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 30.7 mttp -68.44 -44.8 74.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -51.76 -50.88 59.8 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.025 1.33 . . . . 0.0 110.265 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.68 -45.91 77.36 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.88 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -58.42 -48.37 80.91 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.881 1.219 . . . . 0.0 109.931 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 65.7 mt -56.34 -53.95 33.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 C-N-CA 124.858 1.263 . . . . 0.0 108.658 179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.85 -39.44 81.32 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.927 -179.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.6 mtp -65.21 -49.54 69.31 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 120.607 1.548 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -53.8 -46.6 71.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.88 0.848 . . . . 0.0 109.433 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.8 -27.2 61.01 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.404 0.682 . . . . 0.0 112.215 -179.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1116 ' ' LYS . . . . . 0.442 ' HE2' HG12 ' B' ' 103' ' ' VAL . 0.1 OUTLIER -63.04 -60.01 4.03 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.555 1.07 . . . . 0.0 109.696 -179.776 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.12 -42.74 99.08 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 31.1 t -52.76 -52.36 56.88 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.69 0.677 . . . . 0.0 112.55 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.21 -35.46 76.23 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.665 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -64.37 -48.39 75.65 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.013 1.279 . . . . 0.0 109.183 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 59.3 mt -58.16 -52.34 65.95 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.078 1.351 . . . . 0.0 111.548 178.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.9 tpt -64.16 -26.34 68.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.146 0.979 . . . . 0.0 111.392 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.86 -40.47 28.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.179 0.9 . . . . 0.0 109.85 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1124 ' ' LEU . . . . . . . . . . . . 0.32 2.0 pp -73.71 -32.42 63.89 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.2 t -94.31 148.39 34.97 Favored Pre-proline 0 CA--C 1.537 0.455 0 CA-C-N 119.068 0.849 . . . . 0.0 108.81 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.17 -164.21 0.09 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 123.715 2.944 . . . . 0.0 110.747 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -116.14 66.2 3.0 Favored Pre-proline 0 CA--C 1.547 0.851 0 O-C-N 120.183 -1.573 . . . . 0.0 113.737 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -79.96 -85.62 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 121.813 1.675 . . . . 0.0 112.662 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 7.9 tt -64.86 -38.12 89.93 Favored 'General case' 0 C--N 1.347 0.497 0 O-C-N 121.095 -1.003 . . . . 0.0 109.721 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 m -54.71 -36.06 35.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.542 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.39 -41.95 38.22 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 119.06 0.845 . . . . 0.0 109.433 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.95 -47.64 82.33 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.08 -51.38 68.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.985 0.914 . . . . 0.0 108.561 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -43.55 67.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 123.651 0.78 . . . . 0.0 110.447 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -62.84 -54.06 44.69 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 118.493 0.588 . . . . 0.0 110.031 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 10.0 tp60 -59.63 -37.28 78.2 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -40.82 43.94 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.082 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -58.91 -39.49 81.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.344 1.429 . . . . 0.0 107.397 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.03 -15.23 55.77 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.187 -0.946 . . . . 0.0 112.75 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 15.5 tp . . . . . 0 CA--C 1.538 0.49 0 C-N-CA 125.094 1.358 . . . . 0.0 110.855 179.171 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -67.05 -55.64 13.48 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 178.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -72.54 24.9 0.05 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.999 2.12 . . . . 0.0 114.257 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -55.16 106.51 0.23 Allowed 'General case' 0 C--O 1.233 0.211 0 C-N-CA 126.006 1.722 . . . . 0.0 109.5 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.5 tp -74.02 94.32 2.36 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.3 mt -93.03 167.45 11.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -134.0 159.58 40.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.44 90.29 49.04 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -71.28 108.27 2.32 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 125.249 3.966 . . . . 0.0 108.645 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.0 t -138.5 148.64 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 124.338 1.055 . . . . 0.0 110.516 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.2 102.06 4.88 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 175.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.46 124.49 1.25 Allowed Glycine 0 CA--C 1.522 0.472 0 N-CA-C 104.955 -3.258 . . . . 0.0 104.955 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -52.19 26.84 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 120.34 2.07 . . . . 0.0 111.476 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.84 -42.17 95.14 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -56.9 -47.79 79.7 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.24 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.93 -53.99 51.74 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.835 0.743 . . . . 0.0 111.211 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -55.33 -47.59 75.45 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -69.68 -44.16 71.02 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 118.237 0.472 . . . . 0.0 112.267 -179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.88 -44.11 94.04 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.22 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -50.36 63.27 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.947 0.794 . . . . 0.0 109.757 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.59 -50.1 73.95 Favored 'General case' 0 C--O 1.225 -0.202 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.83 -32.25 57.35 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 CA-C-N 119.672 1.124 . . . . 0.0 110.155 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HE2' HG13 ' C' 1010 ' ' VAL . 19.3 tptp -66.59 -46.55 75.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.69 -54.24 34.73 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.786 1.234 . . . . 0.0 110.924 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 m -53.61 -44.72 69.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 119.941 1.246 . . . . 0.0 112.086 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.53 -50.95 48.18 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.616 0.644 . . . . 0.0 110.017 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -54.42 -47.88 72.27 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.386 1.074 . . . . 0.0 110.817 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -64.62 -43.77 92.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.907 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 54.2 ttp -55.61 -48.19 75.3 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.115 0.87 . . . . 0.0 109.676 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -76.54 -14.39 60.02 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -86.33 -54.26 4.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 119.631 1.105 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 pp -65.85 151.34 95.21 Favored Pre-proline 0 CA--C 1.534 0.35 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.98 111.97 2.81 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.478 2.119 . . . . 0.0 107.036 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -66.61 37.76 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.494 2.317 . . . . 0.0 114.054 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -53.51 -57.82 9.34 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.361 -1.462 . . . . 0.0 111.837 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.0 m -59.79 -47.52 85.35 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 123.417 0.687 . . . . 0.0 111.006 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 8.3 mt -60.3 -44.55 95.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 126.395 1.878 . . . . 0.0 111.933 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.07 -58.72 7.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.5 m -55.83 -41.01 73.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.622 0.769 . . . . 0.0 111.162 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -65.34 -53.93 36.43 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.986 0.914 . . . . 0.0 110.993 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -61.73 -41.58 97.82 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.582 -0.699 . . . . 0.0 110.502 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.94 -54.24 33.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.014 0.926 . . . . 0.0 109.415 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -58.5 -44.39 89.42 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 119.649 1.113 . . . . 0.0 110.707 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -58.03 -36.39 72.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.441 1.019 . . . . 0.0 109.662 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.27 -53.73 33.35 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -57.64 -35.72 70.88 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.815 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -60.43 -33.33 72.38 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-O 118.436 -0.793 . . . . 0.0 111.069 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -44.03 78.48 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.306 0.957 . . . . 0.0 111.238 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -70.13 -26.3 63.88 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.648 0.779 . . . . 0.0 112.364 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -88.24 -21.56 24.44 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.611 0.765 . . . . 0.0 110.937 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -16.6 15.37 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.648 1.979 . . . . 0.0 112.902 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.7 mp -64.69 -24.31 67.53 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 95.09 106.47 0.02 OUTLIER 'General case' 0 C--N 1.342 0.273 1 C-N-CA 132.052 4.141 . . . . 0.0 108.08 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -143.29 -13.03 0.71 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -90.84 155.97 18.37 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 120.088 1.313 . . . . 0.0 109.09 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 12.5 t -71.01 -38.46 72.64 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 122.735 0.414 . . . . 0.0 110.285 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.7 m -146.87 139.03 24.67 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.414 1.086 . . . . 0.0 109.172 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.9 mt -141.66 146.97 22.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 126.813 2.045 . . . . 0.0 105.576 178.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -146.71 158.57 43.94 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.95 1.3 . . . . 0.0 109.016 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.254 1.313 0 C-N-CA 125.041 1.336 . . . . 0.0 108.649 179.589 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.89 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 17.4 m 145.45 -166.25 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.644 1 C-N-CA 133.493 4.717 . . . . 0.0 105.992 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -66.05 -163.23 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 127.439 2.295 . . . . 0.0 111.406 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -109.22 -0.26 19.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.291 1.837 . . . . 0.0 110.091 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -95.17 157.18 16.0 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.962 1.305 . . . . 0.0 111.801 -179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 56.4 m -141.65 148.72 39.61 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.912 1.685 . . . . 0.0 107.609 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -101.62 138.52 38.5 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -117.22 145.63 43.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.428 1.491 . . . . 0.0 109.577 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.3 mt -136.06 128.83 30.97 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 125.027 1.331 . . . . 0.0 107.469 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -129.46 100.52 5.58 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.22 149.87 11.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 124.065 0.946 . . . . 0.0 108.797 -179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -114.11 102.36 10.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.4 0.68 . . . . 0.0 110.739 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.57 113.76 0.75 Allowed Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 116.396 -2.335 . . . . 0.0 108.72 177.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -60.59 -56.42 21.55 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.669 2.735 . . . . 0.0 110.501 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -63.06 -52.03 64.36 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -51.96 -49.62 62.85 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.825 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -63.24 -44.84 94.09 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 120.623 1.556 . . . . 0.0 111.596 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -57.06 -50.69 71.98 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.346 0.976 . . . . 0.0 110.4 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 81.2 mt -62.01 -58.27 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 127.058 2.143 . . . . 0.0 110.609 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.61 -36.79 77.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 116.647 -1.644 . . . . 0.0 110.043 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 64.0 mtp -63.08 -52.88 60.97 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 121.423 1.919 . . . . 0.0 110.316 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.45 -43.21 97.1 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.513 0.597 . . . . 0.0 111.827 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 74.6 mt -69.66 -34.49 74.07 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.67 0.668 . . . . 0.0 110.815 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . 0.458 ' HZ1' ' ND2' ' D' 1108 ' ' ASN . 0.2 OUTLIER -66.24 -54.16 28.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.684 0.794 . . . . 0.0 109.78 180.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -60.93 -41.94 97.21 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.011 1.325 . . . . 0.0 108.818 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.6 t -52.78 -52.97 54.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.827 0.851 . . . . 0.0 110.992 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' D' 1108 ' ' ASN . 3.8 mm? -68.2 -38.64 82.17 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.92 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -46.09 88.37 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.577 1.081 . . . . 0.0 109.071 178.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -67.45 -45.07 77.08 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 117.151 -1.404 . . . . 0.0 108.01 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 6.3 tpt -53.89 -33.35 56.27 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 120.101 1.319 . . . . 0.0 110.383 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.47 -31.92 48.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.847 0.859 . . . . 0.0 111.107 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 51.1 tp -87.88 -33.43 18.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 4.1 m -93.46 148.08 34.85 Favored Pre-proline 0 C--O 1.235 0.313 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.59 175.41 9.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 120.981 1.121 . . . . 0.0 110.071 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.36 33.47 0.05 OUTLIER Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 117.538 2.422 . . . . 0.0 117.538 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.26 -57.23 0.79 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 123.07 2.132 . . . . 0.0 112.551 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -28.89 69.9 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.974 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 9.9 t -63.25 -56.54 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.109 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.218 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.46 -35.68 77.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.157 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 9.6 t -61.71 -50.26 73.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 109.247 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.79 -40.41 72.58 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.896 -0.502 . . . . 0.0 109.759 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -52.89 -48.22 67.34 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.145 1.378 . . . . 0.0 111.448 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -77.7 -46.18 22.62 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 123.362 0.665 . . . . 0.0 112.09 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -55.59 -39.03 70.19 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.8 tm0? -80.55 -29.61 37.12 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 125.306 1.443 . . . . 0.0 109.048 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.28 -30.06 64.38 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.546 1.521 . . . . 0.0 108.035 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 14.3 mt -59.38 -13.66 9.2 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 118.917 0.78 . . . . 0.0 112.797 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.39 -21.03 27.39 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.218 1.807 . . . . 0.0 108.94 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -89.12 157.49 18.28 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 . . . . . 0 C--O 1.249 1.069 0 C-N-CA 124.084 0.954 . . . . 0.0 109.746 -179.507 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 11.6 t70 -66.93 -30.0 70.02 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.709 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -95.0 27.98 2.95 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.322 2.249 . . . . 0.0 112.973 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.52 119.18 7.55 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 121.804 -0.56 . . . . 0.0 109.672 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 61.5 tp -77.17 95.29 4.24 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 16.7 mt -96.48 127.41 42.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.723 2.009 . . . . 0.0 108.874 -178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -106.2 122.61 46.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.591 0.756 . . . . 0.0 109.465 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.3 mt -95.72 100.24 5.99 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 117.552 -1.213 . . . . 0.0 108.842 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -75.33 121.94 6.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.809 2.34 . . . . 0.0 110.252 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1010 ' ' VAL . . . . . 0.432 HG13 ' HE2' ' A' ' 23' ' ' LYS . 4.8 t -145.63 152.37 14.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 O-C-N 120.951 -1.093 . . . . 0.0 110.716 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.18 102.02 4.87 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.22 130.49 2.13 Favored Glycine 0 CA--C 1.52 0.365 0 CA-C-O 116.311 -2.383 . . . . 0.0 107.646 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -52.53 22.77 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.655 2.727 . . . . 0.0 111.911 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -72.54 -31.14 65.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.54 -41.55 98.45 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.822 0.849 . . . . 0.0 110.203 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 11.1 t80 -69.61 -52.04 29.57 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.057 0.844 . . . . 0.0 108.947 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -54.3 -57.42 11.29 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.81 -45.87 91.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.03 0.532 . . . . 0.0 111.999 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.5 mm? -67.29 -38.2 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.962 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.24 -49.03 47.52 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 119.988 1.267 . . . . 0.0 111.079 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.21 -46.97 75.93 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.407 1.003 . . . . 0.0 110.959 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 84.5 mt -68.69 -45.39 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.2 tptp -58.02 -45.84 86.25 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 124.537 1.135 . . . . 0.0 110.615 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -67.36 -50.98 57.55 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.434 1.094 . . . . 0.0 108.894 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 30.2 m -53.96 -42.6 69.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.368 0.985 . . . . 0.0 111.134 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -68.89 -52.13 32.82 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.452 1.101 . . . . 0.0 109.894 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -58.55 -43.55 89.36 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 122.956 0.502 . . . . 0.0 110.886 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.09 -40.02 86.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.762 -1.113 . . . . 0.0 109.516 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 49.0 ttp -63.13 -35.73 81.26 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.005 0.821 . . . . 0.0 110.163 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -87.6 -12.87 44.37 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.28 0.945 . . . . 0.0 112.496 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 7.2 t80 -98.58 -57.85 2.1 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.859 1.264 . . . . 0.0 113.029 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.73 156.26 91.38 Favored Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 123.727 0.811 . . . . 0.0 111.933 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.21 78.89 1.82 Allowed 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 124.139 3.226 . . . . 0.0 110.805 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -75.27 65.01 1.55 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.466 1.106 . . . . 0.0 113.103 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.0 t60 -67.86 -40.09 83.67 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.246 -0.909 . . . . 0.0 110.241 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 44.4 m -59.14 -43.51 92.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.044 -0.979 . . . . 0.0 108.463 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 42.4 mt -61.54 -45.41 98.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 119.791 1.178 . . . . 0.0 109.334 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -56.26 -55.37 34.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.806 0.842 . . . . 0.0 110.266 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 41.2 m -65.24 -34.85 79.35 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.819 -0.55 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.68 -52.61 56.32 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.473 1.109 . . . . 0.0 109.929 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -55.65 -47.33 76.83 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -59.32 -57.15 14.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.915 0.886 . . . . 0.0 109.966 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -50.2 -50.47 49.39 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.722 0.809 . . . . 0.0 111.349 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -63.13 -40.7 98.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.612 0.642 . . . . 0.0 110.97 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -62.89 -43.95 97.42 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.545 0.738 . . . . 0.0 109.455 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -67.41 -46.79 72.17 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.135 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -52.88 -45.72 67.62 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 124.137 0.975 . . . . 0.0 111.874 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 17.4 t60 -53.79 -37.56 63.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.667 0.667 . . . . 0.0 112.527 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -70.74 -31.85 68.83 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.025 0.93 . . . . 0.0 111.595 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 31.3 m170 -88.34 -8.88 54.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.837 1.255 . . . . 0.0 112.18 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1051 ' ' LEU . . . . . 0.445 ' C ' ' H ' ' C' 1053 ' ' GLN . 0.5 OUTLIER -58.48 -11.63 3.12 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.746 2.019 . . . . 0.0 112.818 -179.394 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 1.9 tp -71.9 16.57 0.11 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.928 2.091 . . . . 0.0 111.554 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1053 ' ' GLN . . . . . 0.445 ' H ' ' C ' ' C' 1051 ' ' LEU . 35.2 mt-30 51.89 71.63 0.44 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 129.373 3.069 . . . . 0.0 112.438 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -113.61 3.06 15.5 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.329 1.052 . . . . 0.0 113.661 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -87.88 166.19 14.73 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 119.247 0.93 . . . . 0.0 109.816 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 14.8 t -75.48 -50.26 16.27 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 106.568 -1.642 . . . . 0.0 106.568 178.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 50.8 m -139.31 151.09 46.14 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 126.208 1.803 . . . . 0.0 107.77 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 65.4 mt -136.73 137.33 47.5 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -146.93 158.55 43.95 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.196 0.999 . . . . 0.0 109.846 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.256 1.397 0 C-N-CA 126.917 2.087 . . . . 0.0 106.86 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.73 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 17.6 t -162.79 -169.01 1.94 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.422 2.689 . . . . 0.0 105.929 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -61.15 162.17 7.73 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -83.11 -9.84 59.0 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.793 -1.192 . . . . 0.0 112.66 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1097 ' ' ASP . . . . . 0.427 ' C ' ' HG1' ' D' 1098 ' ' THR . 24.4 t0 -80.15 169.93 17.14 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.602 -1.311 . . . . 0.0 109.29 179.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1098 ' ' THR . . . . . 0.427 ' HG1' ' C ' ' D' 1097 ' ' ASP . 59.5 m -158.41 156.96 31.37 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 119.472 -2.017 . . . . 0.0 108.569 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -101.82 134.38 45.09 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -120.84 123.3 42.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 125.837 1.655 . . . . 0.0 109.209 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.65 147.83 49.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.174 0.99 . . . . 0.0 108.884 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 7.4 pm0 -136.06 110.87 8.73 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.098 2.159 . . . . 0.0 109.428 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -155.2 151.21 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.471 1.509 . . . . 0.0 110.639 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.67 102.44 7.6 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.732 1.151 . . . . 0.0 110.535 177.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.56 122.87 2.04 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 105.197 -3.161 . . . . 0.0 105.197 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.57 -58.19 5.7 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 120.989 2.395 . . . . 0.0 114.3 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -63.06 -41.02 99.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.596 0.635 . . . . 0.0 109.327 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1108 ' ' ASN . . . . . 0.459 HD22 ' HB3' ' B' ' 119' ' ' LEU . 4.9 m-80 -53.02 -48.58 67.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.288 179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.6 t80 -63.76 -48.38 77.2 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 119.514 1.052 . . . . 0.0 111.727 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.0 -47.29 68.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.197 0.908 . . . . 0.0 111.313 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.4 mt -68.57 -57.56 8.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 126.104 1.762 . . . . 0.0 110.79 -179.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 5.1 mp -56.68 -39.0 73.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 118.925 0.784 . . . . 0.0 110.797 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 42.1 mtp -63.55 -52.67 60.08 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.362 0.983 . . . . 0.0 110.237 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.08 -33.33 75.25 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.428 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 31.6 mt -70.32 -38.37 74.91 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 120.215 1.37 . . . . 0.0 109.951 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 21.8 tptt -62.67 -52.49 63.08 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -57.01 -42.37 80.22 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.412 1.485 . . . . 0.0 109.693 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 44.8 t -52.64 -54.63 30.71 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.529 1.132 . . . . 0.0 110.255 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.09 -43.39 74.61 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.411 -0.805 . . . . 0.0 110.977 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -55.36 -48.15 74.69 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.172 0.896 . . . . 0.0 111.7 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.35 -48.76 39.4 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 116.208 -1.853 . . . . 0.0 109.058 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.5 tpt -54.51 -33.06 59.2 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.846 1.657 . . . . 0.0 109.436 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -74.87 -32.96 62.01 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 117.897 -1.049 . . . . 0.0 110.572 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 43.7 tp -87.03 -32.55 19.95 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.179 1.354 . . . . 0.0 113.624 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 9.7 m -92.41 148.45 36.44 Favored Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 120.752 -1.218 . . . . 0.0 108.322 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -68.84 177.34 5.03 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 N-CA-C 109.426 -1.028 . . . . 0.0 109.426 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1127 ' ' GLN . . . . . 0.4 ' H ' ' CD ' ' D' 1127 ' ' GLN . 3.2 pm0 -113.4 47.71 0.38 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 116.361 1.986 . . . . 0.0 116.361 -177.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.41 -51.18 0.77 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.744 2.296 . . . . 0.0 113.014 -178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -29.6 69.43 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.136 -0.978 . . . . 0.0 110.625 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.6 t -61.17 -54.48 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 124.034 0.934 . . . . 0.0 108.669 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.63 -45.73 92.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.02 0.827 . . . . 0.0 111.428 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.8 t -59.07 -50.46 74.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.095 0.958 . . . . 0.0 110.484 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.1 t80 -68.39 -42.16 79.48 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.035 1.334 . . . . 0.0 110.853 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.49 -49.15 68.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 119.107 0.867 . . . . 0.0 111.023 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -74.43 -39.93 62.29 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.1 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -62.79 -29.9 71.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.822 0.449 . . . . 0.0 111.42 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -80.19 -39.06 29.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -56.75 -32.67 65.8 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.814 -0.554 . . . . 0.0 109.518 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 15.1 mt -64.26 -12.19 38.83 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.605 1.162 . . . . 0.0 113.097 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 3.0 tt -83.03 -21.54 33.81 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.618 1.167 . . . . 0.0 109.122 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -94.35 177.26 6.01 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 127.619 2.368 . . . . 0.0 109.166 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 123.4 0.68 . . . . 0.0 109.589 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.2 t . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.299 0.095 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -72.27 -10.66 60.08 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.058 0.943 . . . . 0.0 112.039 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -113.72 9.61 17.77 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.018 1.727 . . . . 0.0 111.297 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.25 112.28 4.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.691 0.796 . . . . 0.0 109.288 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.3 95.4 0.43 Allowed 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -104.14 129.16 51.85 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.292 1.037 . . . . 0.0 110.243 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -103.38 118.6 37.12 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -101.93 96.02 6.23 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 125.806 1.642 . . . . 0.0 111.118 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -75.38 113.95 3.88 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 125.12 3.88 . . . . 0.0 111.466 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.9 t -145.11 154.91 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.278 -0.889 . . . . 0.0 109.487 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -135.34 101.88 4.97 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 125.046 1.339 . . . . 0.0 107.817 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.94 121.36 0.97 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 107.64 -2.184 . . . . 0.0 107.64 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.92 -51.57 31.81 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 120.232 2.016 . . . . 0.0 108.45 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.98 -32.82 73.5 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -61.52 -53.37 57.27 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.135 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -67.65 -39.16 84.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.02 -57.23 12.56 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.332 0.515 . . . . 0.0 110.397 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -71.48 -33.38 69.24 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 119.322 -0.37 . . . . 0.0 111.494 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 tp -61.22 -53.34 58.11 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.172 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.88 -34.95 77.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.225 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.25 -49.22 72.6 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.602 1.092 . . . . 0.0 110.607 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.0 mt -83.25 -35.05 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 123.612 0.765 . . . . 0.0 112.169 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.52 -46.63 87.54 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 120.186 -1.571 . . . . 0.0 109.359 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -67.83 -48.9 64.9 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 117.346 -1.311 . . . . 0.0 109.812 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.3 p -53.03 -41.26 64.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 120.04 1.291 . . . . 0.0 112.158 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -74.19 -49.67 22.53 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.898 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -54.46 -47.61 72.71 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.031 0.832 . . . . 0.0 109.913 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 55.8 mt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.709 1.604 . . . . 0.0 110.857 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.9 ttt -56.75 -47.1 80.84 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.586 1.154 . . . . 0.0 109.079 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -64.84 -40.28 94.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.866 1.267 . . . . 0.0 111.532 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.8 -30.33 65.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.696 1.199 . . . . 0.0 112.307 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.3 tp -126.3 70.06 69.08 Favored Pre-proline 0 C--O 1.238 0.449 0 C-N-CA 123.657 0.783 . . . . 0.0 109.918 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.29 77.92 3.4 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.235 2.624 . . . . 0.0 111.487 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 62.9 mm-40 -69.27 167.95 15.25 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.0 m80 -59.25 -28.07 66.37 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.593 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.6 m -57.15 -48.53 78.46 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.252 1.387 . . . . 0.0 107.798 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.4 mt -65.35 -44.48 94.69 Favored 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 124.38 1.072 . . . . 0.0 108.616 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.04 -39.27 77.97 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.449 0.568 . . . . 0.0 111.98 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.4 m -66.6 -52.48 44.81 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -55.76 -51.38 67.59 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 123.408 0.683 . . . . 0.0 111.042 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -53.21 -48.44 68.13 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.737 0.415 . . . . 0.0 111.3 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -64.02 -50.81 67.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.539 0.735 . . . . 0.0 111.924 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -61.53 -40.49 94.84 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.019 0.928 . . . . 0.0 111.846 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -45.37 67.95 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -58.02 -29.15 65.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.412 1.005 . . . . 0.0 111.709 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -59.46 -46.29 89.19 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -60.21 -31.88 70.58 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.559 -0.713 . . . . 0.0 111.372 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -70.33 -57.12 5.21 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -55.52 -36.61 66.91 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.152 0.581 . . . . 0.0 110.811 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -68.19 -44.62 75.46 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.081 -0.961 . . . . 0.0 111.345 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.5 mt -73.99 -44.02 56.1 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.95 1.25 . . . . 0.0 111.601 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.88 -46.0 92.34 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 49.16 69.04 0.62 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.094 1.357 . . . . 0.0 111.094 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 9.1 mmpt? -133.46 170.99 14.68 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.353 1.061 . . . . 0.0 111.877 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -144.38 90.36 2.09 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.336 1.454 . . . . 0.0 109.969 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.2 p -143.3 -24.65 0.6 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.154 0.981 . . . . 0.0 111.57 178.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 56.7 m -128.84 99.12 5.19 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.186 1.795 . . . . 0.0 106.411 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 pp -81.47 7.44 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 123.223 0.609 . . . . 0.0 111.063 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.424 ' NE2' ' H ' ' A' ' 60' ' ' SER . 0.0 OUTLIER -120.0 158.46 26.72 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.196 2.999 . . . . 0.0 106.294 -179.642 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.424 ' H ' ' NE2' ' A' ' 59' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.154 0 C-N-CA 125.034 1.334 . . . . 0.0 109.195 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.816 0 N-CA-C 111.919 -0.472 . . . . 0.0 111.919 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -163.52 165.01 24.12 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.41 1.884 . . . . 0.0 108.606 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -90.94 101.96 14.73 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -72.55 8.63 1.34 Allowed 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 126.636 1.974 . . . . 0.0 114.582 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 28.1 t0 72.17 167.81 0.31 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.778 2.431 . . . . 0.0 112.5 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 59.2 m -86.04 167.05 15.36 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.539 1.936 . . . . 0.0 110.896 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -123.37 142.24 51.17 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 124.488 1.115 . . . . 0.0 108.567 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -127.2 147.45 50.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.06 0.944 . . . . 0.0 109.777 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.16 144.87 51.15 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.357 1.863 . . . . 0.0 107.371 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.08 98.92 4.12 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.223 1.009 . . . . 0.0 112.321 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -151.72 150.35 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.174 -1.579 . . . . 0.0 112.108 -178.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.2 100.85 6.9 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 121.924 0.869 . . . . 0.0 108.883 177.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.64 116.54 1.04 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 103.753 -3.739 . . . . 0.0 103.753 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.7 -56.78 14.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 120.473 2.137 . . . . 0.0 111.002 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -61.11 -48.96 79.25 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 -54.86 -45.5 74.57 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.428 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -61.83 -55.05 33.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.356 -1.307 . . . . 0.0 111.216 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -48.45 -54.32 14.6 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.291 1.036 . . . . 0.0 111.049 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.3 mt -60.62 -57.73 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 126.13 1.772 . . . . 0.0 110.028 -179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.44 -25.77 67.44 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.195 -0.94 . . . . 0.0 112.136 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 5.5 ttt -68.91 -52.42 29.63 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.657 1.117 . . . . 0.0 108.218 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -65.58 -37.67 87.31 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 118.894 -1.123 . . . . 0.0 110.344 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.0 mt -63.89 -38.89 92.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.756 -0.59 . . . . 0.0 111.241 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . 0.467 ' HZ2' ' HB2' ' B' ' 116' ' ' LYS . 0.1 OUTLIER -66.15 -54.21 28.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 O-C-N 121.344 -0.848 . . . . 0.0 110.025 -179.661 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -54.66 -42.83 71.79 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 125.377 1.673 . . . . 0.0 108.337 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 40.8 t -58.04 -48.65 79.45 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.242 1.017 . . . . 0.0 110.899 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.26 -43.43 86.48 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.65 0.659 . . . . 0.0 111.26 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.07 -45.63 91.24 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.198 0.908 . . . . 0.0 109.598 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -48.05 75.02 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.635 -0.666 . . . . 0.0 109.818 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -24.0 67.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.129 0.972 . . . . 0.0 111.098 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -89.31 -20.65 23.8 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.747 1.158 . . . . 0.0 110.521 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.08 -33.18 11.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 120.034 1.288 . . . . 0.0 112.149 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.1 t -95.49 148.08 34.04 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.729 1.612 . . . . 0.0 108.487 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.25 -178.1 3.98 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 123.481 2.788 . . . . 0.0 111.635 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -129.0 62.84 64.43 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 116.752 2.13 . . . . 0.0 116.752 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.19 -54.83 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.517 2.811 . . . . 0.0 113.728 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 tt -56.33 -34.09 66.24 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.627 0.771 . . . . 0.0 109.767 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 14.8 t -61.25 -47.57 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 126.101 1.76 . . . . 0.0 109.3 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -63.49 -36.29 83.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.646 1.112 . . . . 0.0 109.74 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 2.8 t -70.62 -39.05 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.881 0.472 . . . . 0.0 110.166 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -70.1 -50.76 37.57 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.315 1.446 . . . . 0.0 109.371 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.17 -48.12 68.25 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.447 1.499 . . . . 0.0 110.445 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 -68.34 -48.05 65.87 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.732 1.151 . . . . 0.0 110.648 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -56.0 -40.47 73.41 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.004 -0.435 . . . . 0.0 110.924 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -80.74 -27.71 36.74 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.541 1.137 . . . . 0.0 111.264 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -63.68 -33.3 75.32 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.654 1.57 . . . . 0.0 108.483 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.7 mt -63.96 -15.68 59.78 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.043 0.937 . . . . 0.0 111.756 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.4 tt -73.37 -16.45 61.34 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.094 1.357 . . . . 0.0 109.433 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.82 169.83 8.31 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.801 1.64 . . . . 0.0 110.183 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 49.0 mtt-85 . . . . . 0 C--O 1.249 1.056 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 178.299 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.685 0 CA-C-O 121.173 0.511 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 23.1 t0 -70.9 -33.73 70.85 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.439 1.095 . . . . 0.0 109.639 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -87.81 4.77 43.21 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.719 2.007 . . . . 0.0 111.85 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -71.97 104.72 3.61 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 21.9 tp -73.78 95.15 2.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.82 176.36 5.32 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.306 2.242 . . . . 0.0 109.276 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -138.42 144.83 40.36 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.633 1.573 . . . . 0.0 107.224 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.9 tp -126.11 105.78 25.32 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.418 1.487 . . . . 0.0 110.494 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -82.66 115.43 2.47 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 123.868 3.045 . . . . 0.0 111.43 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 96.4 t -139.93 150.86 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 120.299 -1.501 . . . . 0.0 108.056 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.39 104.77 5.71 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.205 0.602 . . . . 0.0 110.775 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -165.96 125.42 1.34 Allowed Glycine 0 CA--C 1.519 0.319 0 N-CA-C 105.881 -2.888 . . . . 0.0 105.881 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -68.52 -51.78 39.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 121.779 2.79 . . . . 0.0 109.881 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.0 -41.71 97.4 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.561 0.696 . . . . 0.0 109.138 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -61.93 -46.82 87.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 124.344 1.057 . . . . 0.0 111.647 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 17.1 t80 -66.77 -41.91 86.93 Favored 'General case' 0 C--O 1.23 0.065 0 CA-C-N 120.157 1.344 . . . . 0.0 111.863 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -55.54 -56.99 13.86 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.563 0.745 . . . . 0.0 110.716 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 tmm? -70.47 -40.26 73.77 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 118.507 -0.758 . . . . 0.0 112.594 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 8.5 tp -58.11 -40.95 82.49 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.242 0.928 . . . . 0.0 108.904 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 6.6 mt -66.87 -47.14 72.8 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.919 -1.039 . . . . 0.0 109.142 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -55.52 -49.14 73.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.382 0.992 . . . . 0.0 111.976 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.76 -36.89 66.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 O-C-N 121.866 -0.521 . . . . 0.0 111.183 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -66.59 -57.9 6.29 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.108 -0.995 . . . . 0.0 109.122 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -54.96 -55.23 33.08 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.327 1.451 . . . . 0.0 109.731 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 33.1 p -53.37 -49.9 66.2 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.958 1.254 . . . . 0.0 112.49 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.28 -52.07 63.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 118.197 0.453 . . . . 0.0 110.767 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.84 -40.67 80.66 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.452 0.701 . . . . 0.0 112.089 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 31.5 mt -71.36 -44.5 64.91 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.036 -1.04 . . . . 0.0 110.012 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -43.25 85.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -66.61 -44.45 82.06 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.404 1.882 . . . . 0.0 110.951 179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 t80 -68.64 -44.46 74.12 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 12.6 tp -116.04 73.92 5.13 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.621 1.168 . . . . 0.0 110.869 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.38 99.47 1.21 Allowed 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 122.129 1.886 . . . . 0.0 109.023 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1034 ' ' GLN . . . . . 0.419 ' H ' HD13 ' C' 1037 ' ' ILE . 36.6 mm-40 -85.07 167.03 16.17 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.511 1.124 . . . . 0.0 108.206 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 13.3 m80 -54.2 -36.98 64.03 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.126 0.421 . . . . 0.0 111.344 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -51.55 66.81 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.75 1.22 . . . . 0.0 108.801 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C 1037 ' ' ILE . . . . . 0.419 HD13 ' H ' ' C' 1034 ' ' GLN . 48.3 mt -65.39 -45.31 93.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 125.743 1.617 . . . . 0.0 108.676 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.48 -45.3 69.57 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 124.911 1.284 . . . . 0.0 111.314 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.7 m -65.68 -52.9 47.88 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.752 1.221 . . . . 0.0 109.784 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -55.78 -48.97 74.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.027 0.931 . . . . 0.0 111.208 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -55.22 -48.53 73.76 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.3 0.64 . . . . 0.0 110.468 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -33.72 75.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.97 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.76 -48.74 77.86 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.522 0.729 . . . . 0.0 109.089 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -60.25 -46.58 89.3 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.896 0.479 . . . . 0.0 109.718 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -58.64 -33.49 70.12 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.198 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -60.44 -45.38 93.88 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.826 1.194 . . . . 0.0 108.443 178.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -70.42 -29.84 66.55 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.574 -0.704 . . . . 0.0 111.756 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -64.29 -47.1 80.8 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.303 0.956 . . . . 0.0 108.628 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -65.39 -39.81 92.68 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.187 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 63.3 m170 -59.67 -43.55 93.92 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.083 1.31 . . . . 0.0 113.238 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 8.6 mt -75.51 -45.75 36.38 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 56.1 tp -75.12 -31.26 61.06 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 13.8 tt0 53.66 7.01 0.09 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 128.543 2.737 . . . . 0.0 116.238 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -67.65 164.43 19.24 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 119.614 -1.929 . . . . 0.0 111.692 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -141.61 83.2 1.85 Allowed 'General case' 0 C--N 1.33 -0.279 1 N-CA-C 99.644 -4.206 . . . . 0.0 99.644 178.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 46.5 p -133.99 -15.14 2.33 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.101 1.76 . . . . 0.0 112.915 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 15.8 m -143.6 118.4 9.91 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 104.249 -2.5 . . . . 0.0 104.249 179.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 2.3 pp -100.77 10.56 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 124.506 1.122 . . . . 0.0 113.307 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.39 153.28 47.61 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 126.01 1.724 . . . . 0.0 106.563 178.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.251 1.134 0 C-N-CA 126.556 1.942 . . . . 0.0 105.836 179.982 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.61 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.17 177.97 4.73 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.352 1.061 . . . . 0.0 109.763 178.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 1.4 t70 -77.36 153.68 33.52 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -122.83 22.74 9.64 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.601 0.76 . . . . 0.0 111.592 -177.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 3.0 t70 68.0 -165.59 0.2 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.453 1.101 . . . . 0.0 111.012 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.3 167.69 12.46 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.051 1.34 . . . . 0.0 108.533 179.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -119.83 130.49 54.93 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -120.6 142.79 49.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.401 1.08 . . . . 0.0 109.227 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.31 134.83 54.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.703 1.201 . . . . 0.0 108.197 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -128.25 111.52 13.49 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.7 m -155.38 151.68 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 126.209 1.804 . . . . 0.0 108.71 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.88 101.68 7.38 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.86 122.32 1.81 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 106.833 -2.507 . . . . 0.0 106.833 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -67.51 -58.0 5.51 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 120.799 2.299 . . . . 0.0 113.683 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 51.6 mttm -65.83 -42.93 89.93 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -51.98 -49.01 64.08 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.227 -0.892 . . . . 0.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 75.2 t80 -62.94 -49.63 73.99 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.301 0.955 . . . . 0.0 112.558 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -56.77 -49.71 74.47 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.208 0.913 . . . . 0.0 110.551 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.8 mt -58.98 -48.81 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 1.8 mm? -62.3 -34.7 77.1 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.313 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -52.85 57.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.189 0.904 . . . . 0.0 108.562 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -62.97 -42.47 99.84 Favored 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.72 -0.792 . . . . 0.0 111.232 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 34.9 mt -64.1 -44.59 91.85 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 118.209 0.459 . . . . 0.0 112.157 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1116 ' ' LYS . . . . . 0.42 ' HZ2' ' HB2' ' D' 1116 ' ' LYS . 0.1 OUTLIER -65.62 -51.96 55.6 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 118.703 0.683 . . . . 0.0 110.475 -178.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.05 -52.12 59.55 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.583 1.177 . . . . 0.0 108.815 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 42.2 t -56.5 -44.7 80.94 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.143 -1.408 . . . . 0.0 112.839 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.87 -44.9 91.68 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.899 1.227 . . . . 0.0 110.487 -179.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.77 -48.26 81.45 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.635 0.774 . . . . 0.0 109.511 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -44.95 89.26 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.2 1.0 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.4 -30.55 70.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.769 1.227 . . . . 0.0 111.47 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 40.0 tp10 -78.7 -34.69 45.85 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.843 -0.599 . . . . 0.0 109.914 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.1 pp -85.75 -29.81 23.58 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.1 p -94.2 144.26 27.74 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 119.917 1.235 . . . . 0.0 109.059 -178.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.65 175.51 7.92 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.484 1.456 . . . . 0.0 110.667 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -117.93 39.96 0.31 Allowed Pre-proline 0 CA--C 1.553 1.083 0 N-CA-C 118.07 2.619 . . . . 0.0 118.07 -176.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -57.54 -48.76 15.8 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.727 2.284 . . . . 0.0 115.08 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 9.1 tt -65.1 -38.98 92.45 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.4 t -58.11 -48.32 84.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 123.773 0.829 . . . . 0.0 109.01 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.85 -45.08 78.55 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 2.5 m -63.05 -48.0 80.58 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 119.183 -0.437 . . . . 0.0 110.238 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.38 -52.59 64.73 Favored 'General case' 0 C--O 1.227 -0.109 0 C-N-CA 124.834 1.253 . . . . 0.0 110.948 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -53.23 -46.04 68.94 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.37 1.868 . . . . 0.0 110.822 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.75 -50.78 26.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.626 0.648 . . . . 0.0 110.226 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -56.08 -35.15 66.66 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.818 -0.552 . . . . 0.0 110.888 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -78.1 -32.89 50.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.165 0.986 . . . . 0.0 110.286 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -59.57 -33.09 71.0 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.7 mt -61.2 -9.93 5.75 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.423 0.689 . . . . 0.0 112.544 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.71 12.48 36.49 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.582 1.953 . . . . 0.0 109.665 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -134.0 157.36 46.27 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 126.292 1.837 . . . . 0.0 108.887 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 75.9 mtt-85 . . . . . 0 C--O 1.246 0.908 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 179.435 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.4 p . . . . . 0 CA--C 1.533 0.294 0 CA-C-O 119.683 -0.198 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -2.62 1.18 Allowed 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -89.16 1.58 55.43 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 128.575 2.75 . . . . 0.0 113.388 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.83 107.81 0.57 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.314 0.961 . . . . 0.0 108.84 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.9 tp -77.58 108.91 11.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.034 1.334 . . . . 0.0 111.429 -178.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -103.34 162.64 12.84 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -135.97 102.25 4.98 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.338 -0.852 . . . . 0.0 111.094 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mp -75.73 119.4 76.97 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 119.897 1.226 . . . . 0.0 108.626 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -86.85 117.42 1.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 122.836 2.358 . . . . 0.0 107.839 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.4 t -141.13 152.07 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 119.955 1.252 . . . . 0.0 108.763 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.16 102.9 5.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.93 124.58 1.24 Allowed Glycine 0 C--O 1.225 -0.444 0 CA-C-O 115.695 -2.725 . . . . 0.0 107.682 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -69.88 -52.0 28.45 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 122.617 3.209 . . . . 0.0 111.288 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -76.17 -30.85 58.24 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.816 1.246 . . . . 0.0 109.29 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 m -67.0 -51.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -58.88 -37.9 77.61 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 119.036 0.835 . . . . 0.0 109.912 179.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -57.64 9.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.472 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -64.95 -44.09 90.57 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.497 0.59 . . . . 0.0 111.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.04 -51.4 69.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.2 1.0 . . . . 0.0 108.49 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -70.77 -45.56 64.51 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.323 0.965 . . . . 0.0 111.85 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -56.31 -48.85 75.87 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.657 1.117 . . . . 0.0 113.367 -177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.7 mt -74.4 -32.97 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.718 -0.614 . . . . 0.0 109.352 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.89 -48.23 79.89 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.98 -45.46 93.55 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 125.554 1.541 . . . . 0.0 109.139 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.2 t -53.17 -51.35 62.33 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.747 0.819 . . . . 0.0 110.72 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tt -61.6 -55.56 29.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.865 0.866 . . . . 0.0 109.946 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.89 -51.63 65.4 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 124.547 1.139 . . . . 0.0 112.588 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.05 -41.55 86.31 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.141 -0.974 . . . . 0.0 112.521 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.89 -45.5 93.48 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -67.23 -31.51 71.92 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 118.36 -0.829 . . . . 0.0 111.378 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -71.39 -27.59 63.43 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.159 0.89 . . . . 0.0 109.767 178.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.2 mt -126.34 76.58 73.01 Favored Pre-proline 0 C--O 1.241 0.631 0 CA-C-N 119.743 1.156 . . . . 0.0 109.417 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -72.91 2.52 5.32 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.249 3.299 . . . . 0.0 113.208 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -113.14 -65.01 1.23 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.472 1.109 . . . . 0.0 108.895 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -47.84 -50.1 27.25 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.454 1.502 . . . . 0.0 113.902 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -45.68 79.02 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.759 -0.588 . . . . 0.0 112.026 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.2 mm -67.49 -34.76 70.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 123.849 0.86 . . . . 0.0 111.048 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -58.7 -54.85 42.47 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -58.74 -41.11 85.72 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.649 0.78 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -60.42 -53.4 57.99 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.22 0.918 . . . . 0.0 110.558 179.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.07 -40.46 81.09 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.074 0.55 . . . . 0.0 109.867 -178.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.55 -47.92 65.64 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.77 -0.633 . . . . 0.0 109.712 179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.41 -46.8 76.6 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.41 1.484 . . . . 0.0 110.995 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -62.36 -49.72 74.45 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.713 0.805 . . . . 0.0 110.47 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.08 -41.87 98.62 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.635 1.174 . . . . 0.0 111.253 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -60.8 -32.61 71.96 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.064 0.546 . . . . 0.0 111.896 -179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -61.84 -36.83 82.36 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -73.62 -37.61 65.34 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 -61.14 -33.02 72.74 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.689 -0.632 . . . . 0.0 109.965 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -61.72 -51.31 68.9 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 24.9 tp -62.05 -19.6 63.08 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.284 1.034 . . . . 0.0 112.409 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.39 -15.99 60.41 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.733 0.813 . . . . 0.0 110.013 178.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 37.9 52.96 1.53 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 128.489 2.716 . . . . 0.0 112.68 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -144.82 9.84 1.34 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 114.798 1.406 . . . . 0.0 114.798 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -130.1 155.19 46.59 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 121.051 1.75 . . . . 0.0 109.687 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 p -91.83 -47.17 7.47 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.753 1.221 . . . . 0.0 108.152 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.1 t -157.28 -169.57 2.96 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.38 1.872 . . . . 0.0 107.248 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.4 tt -66.9 -12.74 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 125.635 1.574 . . . . 0.0 110.953 178.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -131.9 158.35 41.6 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 128.341 2.656 . . . . 0.0 105.397 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 m . . . . . 0 C--O 1.256 1.409 0 C-N-CA 127.082 2.153 . . . . 0.0 106.328 179.673 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.548 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 5.2 m -138.38 151.05 47.15 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 123.303 0.641 . . . . 0.0 110.002 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -161.78 117.43 2.04 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 104.783 -2.303 . . . . 0.0 104.783 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -132.44 -15.3 2.83 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 125.782 1.633 . . . . 0.0 110.685 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.79 91.47 3.51 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 103.125 -2.917 . . . . 0.0 103.125 178.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.3 m -148.82 151.5 34.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -102.74 129.61 49.43 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -105.68 155.14 19.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.71 145.91 26.94 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.27 108.6 5.27 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.367 1.867 . . . . 0.0 109.892 -179.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . 0.447 HG11 ' HE3' ' D' 1116 ' ' LYS . 54.6 t -155.37 146.37 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.54 1.136 . . . . 0.0 109.372 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -97.27 104.77 16.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.07 108.06 0.5 Allowed Glycine 0 C--O 1.225 -0.45 0 CA-C-O 116.448 -2.306 . . . . 0.0 111.451 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -64.53 -57.23 9.74 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.546 3.173 . . . . 0.0 110.775 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -50.09 66.64 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.927 0.891 . . . . 0.0 109.908 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -56.71 -43.57 80.69 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 118.481 -0.771 . . . . 0.0 112.031 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -61.47 -49.96 74.69 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.225 0.921 . . . . 0.0 109.483 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.62 -53.73 54.28 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 124.04 0.837 . . . . 0.0 112.349 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.34 -58.03 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.601 1.56 . . . . 0.0 110.921 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.31 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 117.606 -1.188 . . . . 0.0 111.184 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -70.25 -44.81 67.72 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 120.821 1.646 . . . . 0.0 108.169 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.04 -47.6 71.4 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 18.5 mt -67.99 -39.54 83.23 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.013 0.925 . . . . 0.0 111.454 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . 0.457 ' HZ2' ' HB3' ' D' 1108 ' ' ASN . 1.5 tpmt? -57.93 -59.07 5.81 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.751 1.62 . . . . 0.0 109.012 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -54.27 -50.3 67.57 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.769 2.028 . . . . 0.0 110.369 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 16.4 m -59.07 -36.25 74.75 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -38.42 64.14 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.097 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.96 -42.75 98.9 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.48 -42.64 99.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.25 -38.11 89.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.64 0.776 . . . . 0.0 110.85 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.63 -38.16 70.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.775 0.83 . . . . 0.0 111.404 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -32.97 28.24 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 65.4 t -93.72 141.28 23.59 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 119.3 0.955 . . . . 0.0 108.524 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -67.72 -164.38 0.1 OUTLIER 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 122.841 2.361 . . . . 0.0 110.389 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -108.77 47.3 0.2 Allowed Pre-proline 0 CA--C 1.555 1.154 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -67.89 -71.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.314 2.676 . . . . 0.0 112.602 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.76 -38.69 79.01 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 7.5 t -52.89 -55.86 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 126.777 2.031 . . . . 0.0 109.975 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -66.01 -43.39 87.84 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.314 1.046 . . . . 0.0 111.583 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.1 t -56.73 -49.92 73.77 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.513 0.725 . . . . 0.0 109.986 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -64.77 -48.79 73.24 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.686 1.594 . . . . 0.0 108.111 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.0 66.3 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.761 1.224 . . . . 0.0 112.098 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.32 -56.62 10.26 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.91 0.777 . . . . 0.0 110.692 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -53.98 -41.39 67.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.096 0.558 . . . . 0.0 110.94 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -69.56 -41.63 75.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.569 1.148 . . . . 0.0 110.261 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -56.96 -31.45 65.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 119.434 1.015 . . . . 0.0 109.871 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.37 -11.49 6.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.15 0.886 . . . . 0.0 112.45 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 tt -76.94 -12.37 59.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.57 1.548 . . . . 0.0 109.638 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -141.13 177.11 8.3 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.577 1.551 . . . . 0.0 110.792 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . 0.459 ' H ' ' HD3' ' B' ' 142' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.239 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 121.291 0.567 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.05 -22.1 16.44 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.797 2.439 . . . . 0.0 112.465 -178.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.58 7.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 126.38 1.872 . . . . 0.0 114.969 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.92 113.27 4.82 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.261 0.937 . . . . 0.0 109.119 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.59 106.58 8.32 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.373 1.869 . . . . 0.0 110.462 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.07 154.27 19.9 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.025 1.73 . . . . 0.0 109.072 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -119.16 145.32 46.09 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.217 0.917 . . . . 0.0 111.519 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.8 mt -117.79 90.3 35.89 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.711 1.604 . . . . 0.0 110.661 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.0 106.72 2.27 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.952 3.768 . . . . 0.0 110.769 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 15.3 t -139.41 156.91 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.339 1.456 . . . . 0.0 108.917 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.57 101.56 4.83 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 123.156 0.583 . . . . 0.0 110.026 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.87 121.92 1.02 Allowed Glycine 0 CA--C 1.522 0.512 0 N-CA-C 108.363 -1.895 . . . . 0.0 108.363 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -69.19 -51.84 33.96 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.277 2.039 . . . . 0.0 111.255 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -70.7 -33.46 70.91 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.48 0.657 . . . . 0.0 109.465 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 33.1 m -60.1 -51.29 70.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.319 1.448 . . . . 0.0 108.552 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.12 -44.52 95.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.751 1.221 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -55.91 -57.18 13.16 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.6 ppp? -65.24 -39.12 92.28 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.682 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 19.7 tp -60.07 -49.6 77.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.671 -0.681 . . . . 0.0 112.078 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.63 -45.86 88.33 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.594 0.634 . . . . 0.0 109.856 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -55.2 -45.58 75.86 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.266 0.626 . . . . 0.0 111.549 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 25.8 mt -76.27 -46.73 32.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.207 0.603 . . . . 0.0 111.169 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -59.6 -37.24 78.02 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.35 0.66 . . . . 0.0 110.221 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -66.64 -51.97 50.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.3 t -53.44 -51.52 62.4 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.693 0.797 . . . . 0.0 112.131 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.18 -53.64 54.42 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.609 0.764 . . . . 0.0 110.764 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -58.84 -51.03 71.74 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.159 0.584 . . . . 0.0 111.967 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.8 -38.03 89.6 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.655 0.782 . . . . 0.0 111.4 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.2 tmt? -62.04 -46.79 87.58 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -74.93 -20.27 59.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.702 0.683 . . . . 0.0 110.888 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -76.64 -38.09 55.22 Favored 'General case' 0 C--N 1.346 0.445 0 O-C-N 120.568 -1.332 . . . . 0.0 108.396 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 17.5 mt -118.44 76.03 12.61 Favored Pre-proline 0 N--CA 1.467 0.411 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -70.78 0.92 5.67 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.57 2.846 . . . . 0.0 114.91 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -105.32 -58.34 1.91 Allowed 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 119.777 1.171 . . . . 0.0 109.962 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -47.38 -47.92 26.05 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 -177.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.92 71.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.148 1.34 . . . . 0.0 111.281 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.34 -36.95 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.687 1.195 . . . . 0.0 110.45 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.5 -52.46 61.16 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.131 1.772 . . . . 0.0 108.762 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.8 m -64.11 -40.81 97.0 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -56.59 -53.65 55.18 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.409 1.084 . . . . 0.0 109.614 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -63.09 -40.09 96.61 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.444 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.75 -48.83 80.05 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.879 0.763 . . . . 0.0 109.031 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -62.09 -50.77 70.6 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.276 1.43 . . . . 0.0 111.283 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -57.02 -43.79 82.21 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.386 1.074 . . . . 0.0 108.978 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -64.66 -54.32 33.63 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.791 0.837 . . . . 0.0 109.3 178.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -53.87 -31.47 49.82 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 112.675 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -55.88 -48.35 75.75 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.557 1.071 . . . . 0.0 108.976 178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -74.27 -35.03 63.74 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.472 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -58.68 -38.42 78.19 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.117 0.872 . . . . 0.0 108.733 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -47.99 83.77 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.853 0.861 . . . . 0.0 110.366 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 50.1 tp -59.46 -22.61 61.78 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.361 0.664 . . . . 0.0 112.219 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.29 -14.0 59.61 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.184 1.394 . . . . 0.0 111.8 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 14.0 mm100 38.57 55.31 1.89 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.57 2.348 . . . . 0.0 112.335 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -132.76 2.13 3.7 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -139.84 153.48 47.06 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 121.551 1.978 . . . . 0.0 108.95 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 3.3 p -80.24 -44.45 19.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.045 0.938 . . . . 0.0 111.233 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 15.8 t -160.02 -165.7 1.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.214 1.006 . . . . 0.0 108.385 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 19.7 tt -63.66 -19.87 25.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.752 2.021 . . . . 0.0 110.994 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -125.4 156.42 38.83 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 127.367 2.267 . . . . 0.0 105.709 178.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 62.6 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 128.101 2.56 . . . . 0.0 105.841 179.55 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 60.3 m -112.54 143.22 44.08 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.048 1.339 . . . . 0.0 108.414 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 28.1 p-10 -164.69 63.65 0.13 Allowed 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.364 1.466 . . . . 0.0 109.369 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -92.16 -23.59 19.35 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.957 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -67.14 100.92 0.82 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.14 147.74 18.13 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -178.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -102.22 128.91 48.54 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.63 160.87 13.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.165 1.386 . . . . 0.0 109.453 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -152.8 152.67 31.87 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.409 -1.432 . . . . 0.0 107.893 176.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -151.39 98.0 2.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.779 1.232 . . . . 0.0 109.032 -177.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 55.2 t -148.73 149.65 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.983 1.713 . . . . 0.0 108.35 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -118.94 102.06 8.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.403 1.456 . . . . 0.0 112.606 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.37 124.93 2.42 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 107.164 -2.374 . . . . 0.0 107.164 176.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -67.3 -57.15 7.18 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 120.641 2.22 . . . . 0.0 110.979 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.58 -47.98 83.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1108 ' ' ASN . . . . . 0.457 ' HB3' ' HZ2' ' B' ' 116' ' ' LYS . 86.2 m-20 -52.84 -50.52 63.57 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.482 1.513 . . . . 0.0 112.402 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 66.7 t80 -64.31 -48.01 77.24 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.17 -178.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.84 -53.03 54.61 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.022 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.98 -57.95 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 125.474 1.51 . . . . 0.0 110.597 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.24 -40.05 88.89 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.9 -1.048 . . . . 0.0 111.551 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.5 tmt? -64.1 -48.9 74.33 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 120.418 1.463 . . . . 0.0 109.726 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 14.3 ttmm -53.47 -51.89 61.28 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.492 0.717 . . . . 0.0 109.205 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 40.0 mt -62.7 -42.06 99.44 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.407 1.083 . . . . 0.0 111.57 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1116 ' ' LYS . . . . . 0.447 ' HE3' HG11 ' B' ' 103' ' ' VAL . 39.0 tptt -59.77 -53.3 59.55 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.748 1.219 . . . . 0.0 110.798 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -59.54 -51.38 70.07 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.385 1.474 . . . . 0.0 109.491 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.5 m -54.76 -44.61 73.78 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.09 0.956 . . . . 0.0 112.179 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -36.74 77.94 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.265 0.484 . . . . 0.0 110.988 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.65 -41.29 92.75 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.399 1.0 . . . . 0.0 109.127 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.72 -52.25 58.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.805 1.242 . . . . 0.0 110.376 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.5 -19.87 65.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.235 0.471 . . . . 0.0 111.75 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -79.64 -39.16 32.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.857 1.208 . . . . 0.0 109.065 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -75.62 -28.9 59.01 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 118.245 -0.883 . . . . 0.0 112.61 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.91 147.39 33.87 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.781 0.832 . . . . 0.0 110.057 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.45 -176.53 2.54 Favored 'Trans proline' 0 CA--C 1.547 1.14 0 C-N-CA 123.314 2.676 . . . . 0.0 110.496 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -104.22 40.94 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.256 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.84 -56.76 0.23 Allowed 'Trans proline' 0 C--N 1.355 0.875 0 CA-C-N 124.34 2.586 . . . . 0.0 113.096 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.57 -44.63 90.09 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.193 0.906 . . . . 0.0 108.824 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 t -53.07 -53.46 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 125.544 1.538 . . . . 0.0 110.504 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 7.4 t70 -63.53 -38.51 91.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.154 0.888 . . . . 0.0 111.44 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 21.5 t -62.89 -50.09 72.25 Favored 'General case' 0 N--CA 1.457 -0.119 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -62.14 -42.57 99.37 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -48.02 73.66 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.62 0.768 . . . . 0.0 110.011 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -69.66 -47.79 62.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.175 0.898 . . . . 0.0 110.672 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -55.7 -40.44 72.4 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.814 1.246 . . . . 0.0 111.231 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -80.64 -33.77 35.47 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.058 1.743 . . . . 0.0 110.611 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -60.5 -30.89 70.0 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.483 1.038 . . . . 0.0 108.671 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.3 -20.48 59.34 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.441 0.564 . . . . 0.0 111.956 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.01 -0.41 54.32 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.956 1.302 . . . . 0.0 112.014 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -135.38 178.75 6.79 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.264 1.826 . . . . 0.0 111.465 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.035 0 C-N-CA 125.946 1.698 . . . . 0.0 107.453 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 73.6 m . . . . . 0 CA--C 1.514 -0.405 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -95.73 -32.13 12.88 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -93.42 -50.66 5.34 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 62.8 160.92 0.09 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.162 2.185 . . . . 0.0 110.322 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -81.53 101.54 10.01 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.18 -1.575 . . . . 0.0 107.002 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.64 168.79 11.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.711 1.205 . . . . 0.0 108.602 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -133.26 138.28 46.39 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.919 1.288 . . . . 0.0 108.653 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.8 90.43 48.37 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 124.823 1.249 . . . . 0.0 111.966 -178.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.74 112.39 2.66 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 124.5 3.467 . . . . 0.0 111.806 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.7 t -144.71 152.96 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.554 1.141 . . . . 0.0 108.501 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -135.18 100.88 4.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.67 1.123 . . . . 0.0 108.858 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.99 124.21 1.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-O 116.343 -2.365 . . . . 0.0 107.356 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -66.16 -51.09 61.11 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 121.399 2.6 . . . . 0.0 110.055 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.02 -41.65 92.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.202 1.001 . . . . 0.0 111.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -64.81 -50.0 68.47 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.125 1.37 . . . . 0.0 108.692 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -56.92 -51.82 67.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.643 -0.694 . . . . 0.0 111.028 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -55.3 -54.87 38.05 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 124.159 0.912 . . . . 0.0 111.942 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.443 ' HE3' ' HE3' ' D' 1114 ' ' LYS . 37.6 ttm -59.55 -50.45 73.85 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.488 0.315 . . . . 0.0 111.391 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.82 -41.69 91.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.854 0.862 . . . . 0.0 110.813 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 tt -68.05 -45.72 73.1 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.46 -40.16 81.91 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.949 0.795 . . . . 0.0 111.512 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mt -72.77 -43.64 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -59.26 -46.23 89.06 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.545 -0.722 . . . . 0.0 109.316 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -56.03 -55.21 35.57 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.935 1.694 . . . . 0.0 109.65 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 p -64.18 -44.32 92.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.04 -47.88 84.34 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 118.669 0.668 . . . . 0.0 109.88 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -62.13 -43.57 98.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.02 -49.92 70.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 118.733 0.697 . . . . 0.0 111.324 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.0 ttm -57.4 -37.17 72.29 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.72 -34.55 64.85 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.022 -1.049 . . . . 0.0 111.628 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -77.07 -30.85 55.71 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.606 1.094 . . . . 0.0 110.894 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -123.96 69.12 46.94 Favored Pre-proline 0 CA--C 1.539 0.532 0 C-N-CA 126.68 1.992 . . . . 0.0 107.896 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -72.58 -6.26 18.72 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.331 2.021 . . . . 0.0 113.982 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -129.93 -47.38 1.13 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.982 -178.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -51.81 -51.9 53.05 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.447 1.099 . . . . 0.0 112.786 -178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 m -61.73 -45.54 93.5 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.086 -1.008 . . . . 0.0 109.359 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 9.1 mm -63.47 -41.07 91.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 123.837 0.855 . . . . 0.0 110.578 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.9 -36.92 78.01 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.609 1.564 . . . . 0.0 109.726 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.5 m -68.52 -52.39 32.66 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -60.36 -36.07 77.16 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.309 1.044 . . . . 0.0 111.55 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -48.96 76.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.684 1.194 . . . . 0.0 108.712 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -67.22 -55.88 12.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 118.499 -0.762 . . . . 0.0 111.205 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.92 -54.76 34.28 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.425 1.09 . . . . 0.0 111.576 -178.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.426 HE22 ' NE2' ' A' ' 47' ' ' GLN . 22.2 tp60 -62.39 -39.55 93.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.516 -0.754 . . . . 0.0 111.373 -178.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -64.02 -49.81 70.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.833 0.742 . . . . 0.0 109.347 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -60.09 -44.89 94.48 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.798 0.726 . . . . 0.0 110.03 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.426 ' NE2' HE22 ' A' ' 44' ' ' GLN . 30.0 tt0 -58.7 -50.91 72.14 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.245 1.018 . . . . 0.0 109.47 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -63.76 -43.56 96.06 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.291 0.636 . . . . 0.0 110.963 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.59 -43.27 99.22 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.725 1.21 . . . . 0.0 110.729 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -65.02 -21.12 66.79 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.968 0.804 . . . . 0.0 112.503 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 37.8 tp -93.2 -46.5 7.38 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.755 1.222 . . . . 0.0 109.921 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.85 -55.73 15.55 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 124.63 1.172 . . . . 0.0 110.126 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 52.04 4.68 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 130.589 3.556 . . . . 0.0 115.599 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -112.3 154.14 26.12 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 127.118 2.167 . . . . 0.0 107.108 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -74.12 -52.19 13.31 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.8 m 56.94 78.56 0.22 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.272 1.429 . . . . 0.0 109.752 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.8 m -152.71 174.98 13.33 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.221 1.408 . . . . 0.0 108.078 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.4 mm -71.39 -18.05 20.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 124.134 0.974 . . . . 0.0 111.71 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -133.22 151.48 51.93 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 119.191 0.905 . . . . 0.0 109.403 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.9 m . . . . . 0 C--O 1.251 1.141 0 C-N-CA 124.83 1.252 . . . . 0.0 109.514 178.439 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.683 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 3.0 p -138.56 160.42 39.63 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -133.52 -46.25 0.82 Allowed 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 118.651 0.66 . . . . 0.0 109.673 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -73.08 -36.95 66.92 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 177.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 38.2 t0 65.74 -63.74 0.21 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 130.131 3.372 . . . . 0.0 108.476 -178.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 96.8 m -71.38 125.24 26.48 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 177.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -102.1 150.93 22.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -123.56 137.14 54.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.52 1.128 . . . . 0.0 109.777 -177.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 19.7 tp -139.68 149.83 44.16 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 123.387 0.675 . . . . 0.0 110.805 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -145.68 108.29 4.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.367 -2.457 . . . . 0.0 104.367 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 m -149.66 150.67 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.804 1.184 . . . . 0.0 112.153 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.42 102.14 10.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.67 114.42 0.82 Allowed Glycine 0 C--O 1.227 -0.316 0 CA-C-O 116.006 -2.552 . . . . 0.0 109.873 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -68.05 -57.44 6.12 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 122.489 3.144 . . . . 0.0 108.404 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -70.3 -49.88 45.06 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.14 -51.32 58.65 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.059 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -67.12 -36.52 82.08 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.958 1.254 . . . . 0.0 111.682 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -60.71 -54.14 48.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 120.003 1.274 . . . . 0.0 110.768 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.77 -51.08 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 125.745 1.618 . . . . 0.0 110.611 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.3 mt -60.41 -33.88 73.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.718 -179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -45.92 70.21 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.771 1.623 . . . . 0.0 108.212 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . 0.404 ' HE3' ' HE1' ' C' 1018 ' ' MET . 29.1 ttpt -55.83 -49.49 73.13 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 30.7 mt -60.43 -36.34 77.96 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-O 119.009 -0.52 . . . . 0.0 110.97 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -59.99 4.46 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 119.477 1.035 . . . . 0.0 109.149 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -62.05 -43.81 98.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.619 -0.705 . . . . 0.0 111.423 -178.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 4.1 t -58.05 -45.29 87.27 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.405 1.002 . . . . 0.0 111.501 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -69.56 -46.34 66.63 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 117.846 -1.073 . . . . 0.0 109.679 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -57.01 -49.34 76.09 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.051 0.841 . . . . 0.0 109.939 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.51 -50.72 72.75 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 123.808 0.843 . . . . 0.0 110.726 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -69.6 -18.87 63.65 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -83.57 -47.38 11.36 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.034 1.334 . . . . 0.0 108.976 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.79 -32.67 72.56 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.699 -179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 77.6 t -92.76 144.51 28.71 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -67.61 -176.76 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.08 2.52 . . . . 0.0 111.274 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -111.5 48.37 0.29 Allowed Pre-proline 0 CA--C 1.551 1.0 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.93 -57.46 0.13 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.251 1.967 . . . . 0.0 113.782 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.7 tt -63.38 -31.96 73.26 Favored 'General case' 0 C--N 1.349 0.546 0 O-C-N 120.627 -1.296 . . . . 0.0 110.952 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 t -51.8 -56.78 4.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 C-N-CA 124.226 1.01 . . . . 0.0 111.943 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -73.9 -31.49 63.12 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.406 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.2 m -61.06 -47.88 84.32 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 122.398 1.094 . . . . 0.0 108.088 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -66.98 -38.36 85.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.466 1.506 . . . . 0.0 108.409 178.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -46.99 84.37 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.96 0.904 . . . . 0.0 109.188 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -59.03 -46.41 88.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -44.66 89.04 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.41 0.684 . . . . 0.0 110.906 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -35.36 73.71 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.169 0.987 . . . . 0.0 110.076 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -56.21 -40.31 73.85 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.2 -18.29 63.34 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.562 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp -72.58 -49.68 30.66 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.904 1.229 . . . . 0.0 110.154 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -140.91 105.97 4.98 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 126.207 1.803 . . . . 0.0 109.493 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ttt85 . . . . . 0 C--O 1.256 1.414 0 C-N-CA 124.045 0.938 . . . . 0.0 108.68 178.75 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -103.43 -7.67 20.77 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.342 1.057 . . . . 0.0 112.451 -177.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -108.71 -50.12 3.06 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.8 tp10 78.19 158.82 0.19 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 129.853 3.261 . . . . 0.0 110.727 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 33.7 tp -76.54 95.49 3.91 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 103.968 -2.605 . . . . 0.0 103.968 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 58.4 mt -89.54 124.64 34.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 124.35 1.06 . . . . 0.0 108.222 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -104.57 125.93 51.18 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 128.917 2.887 . . . . 0.0 108.1 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.95 92.01 19.75 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.244 1.417 . . . . 0.0 109.641 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.24 118.17 4.86 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.648 2.232 . . . . 0.0 107.501 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 22.0 t -145.15 155.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 119.706 1.139 . . . . 0.0 109.978 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -134.98 102.58 5.27 Favored 'General case' 0 C--N 1.343 0.312 0 O-C-N 121.214 -0.929 . . . . 0.0 109.134 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.37 116.83 0.7 Allowed Glycine 0 CA--C 1.519 0.31 0 CA-C-O 115.496 -2.836 . . . . 0.0 107.001 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.4 tpp85 -61.98 -51.82 66.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.697 2.749 . . . . 0.0 111.976 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -69.2 -41.07 77.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.868 0.758 . . . . 0.0 109.502 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -55.47 -46.49 76.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.3 t80 -65.57 -47.93 74.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.54 0.736 . . . . 0.0 109.998 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -53.18 -50.71 64.07 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.774 1.23 . . . . 0.0 110.69 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1018 ' ' MET . . . . . 0.404 ' HE1' ' HE3' ' B' ' 114' ' ' LYS . 3.1 tmm? -69.33 -43.16 74.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.314 0.646 . . . . 0.0 111.41 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.12 -46.55 89.26 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.735 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.25 -46.33 81.01 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 119.268 0.94 . . . . 0.0 111.612 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -54.98 -44.46 74.47 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.111 0.868 . . . . 0.0 110.335 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.5 mt -72.63 -44.11 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.839 1.256 . . . . 0.0 111.166 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -57.77 -49.08 77.78 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.847 0.859 . . . . 0.0 109.34 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.25 -45.45 80.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.305 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.7 p -61.08 -40.6 94.3 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 120.328 1.422 . . . . 0.0 111.536 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 64.4 mt -67.87 -46.32 72.02 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.124 0.97 . . . . 0.0 109.471 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.18 -44.18 97.18 Favored 'General case' 0 C--O 1.224 -0.264 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 1.4 mm? -57.95 -44.3 86.88 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 119.12 0.873 . . . . 0.0 110.515 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 4.6 ttm -57.19 -36.07 70.37 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -76.96 -37.17 55.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.365 -1.302 . . . . 0.0 111.669 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -83.1 -19.59 36.47 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 120.942 1.701 . . . . 0.0 113.667 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -124.55 65.2 42.15 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -68.08 -20.15 44.45 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.838 2.359 . . . . 0.0 115.282 -178.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -121.78 -41.0 2.49 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 119.7 1.136 . . . . 0.0 111.56 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -52.26 -52.64 51.51 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.218 0.917 . . . . 0.0 113.371 -178.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.18 -43.18 96.08 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.126 -0.984 . . . . 0.0 110.373 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 13.0 mm -63.93 -34.33 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.369 1.068 . . . . 0.0 109.808 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -69.56 -44.34 71.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.246 1.018 . . . . 0.0 108.892 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.3 m -62.94 -46.74 86.32 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.1 t80 -59.24 -50.36 74.29 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.247 1.419 . . . . 0.0 111.226 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 tpp85 -56.43 -48.48 76.91 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.923 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -57.26 -55.73 31.03 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.313 0.96 . . . . 0.0 109.585 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.96 -54.36 39.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.846 1.259 . . . . 0.0 112.968 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -65.23 -47.01 78.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.118 1.367 . . . . 0.0 111.592 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -56.62 -47.17 80.26 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.589 1.156 . . . . 0.0 108.231 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -61.64 -54.34 44.15 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.576 1.15 . . . . 0.0 110.471 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -53.72 -53.43 52.19 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 125.086 1.354 . . . . 0.0 112.003 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 8.6 t60 -68.61 -43.85 75.53 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.654 -0.688 . . . . 0.0 111.605 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -61.15 -38.95 88.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 119.885 1.221 . . . . 0.0 110.806 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -70.45 -20.17 62.91 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.831 0.452 . . . . 0.0 112.007 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 41.5 tp -85.04 -44.79 12.73 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.366 1.066 . . . . 0.0 109.939 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 57.2 tp -76.55 -51.28 11.98 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.559 0.744 . . . . 0.0 110.326 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 34.2 tt0 52.05 15.7 0.45 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.835 2.454 . . . . 0.0 114.234 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 31.0 mttp -131.95 121.43 23.95 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 125.506 1.523 . . . . 0.0 107.421 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -45.43 -42.91 10.88 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.691 1.196 . . . . 0.0 112.975 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 3.8 m 46.38 78.64 0.07 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.774 2.03 . . . . 0.0 111.822 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 68.6 m -150.86 172.48 15.57 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.915 1.286 . . . . 0.0 107.699 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 33.8 mm -69.41 -11.58 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 C-N-CA 124.081 0.952 . . . . 0.0 111.306 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -139.55 158.41 44.18 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.201 1.401 . . . . 0.0 108.828 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.407 1.483 . . . . 0.0 108.309 178.13 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.525 0 N-CA-C 108.554 -1.818 . . . . 0.0 108.554 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 14.4 p -68.68 141.78 55.23 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -88.39 -59.34 2.26 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -87.9 -27.43 22.18 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . 0.283 12.5 t70 68.67 -56.35 0.52 Allowed 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 129.39 3.076 . . . . 0.0 110.139 -177.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.17 140.67 32.44 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 126.347 1.859 . . . . 0.0 107.581 177.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -131.4 158.33 41.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.846 1.258 . . . . 0.0 109.069 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -124.44 160.58 27.9 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.152 1.381 . . . . 0.0 110.352 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 13.4 tp -159.88 139.01 10.93 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.585 1.154 . . . . 0.0 108.496 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -138.97 98.07 3.45 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 30.4 m -145.45 151.72 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 O-C-N 120.683 -1.26 . . . . 0.0 114.254 -176.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.14 103.48 12.69 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.45 100.56 0.24 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 103.661 -3.776 . . . . 0.0 103.661 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -61.82 -57.49 11.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 122.474 3.137 . . . . 0.0 112.803 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 6.5 mttp -66.34 -38.73 88.33 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.376 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.5 m120 -59.39 -51.76 68.51 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.67 -1.157 . . . . 0.0 111.36 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1109 ' ' PHE . . . . . 0.401 ' CZ ' ' HG3' ' D' 1113 ' ' MET . 84.2 t80 -60.84 -42.1 97.13 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 120.247 1.385 . . . . 0.0 110.333 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.45 -53.71 52.9 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.469 0.652 . . . . 0.0 110.068 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.96 -54.04 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 125.562 1.545 . . . . 0.0 110.607 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.11 -38.86 74.02 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.488 1.515 . . . . 0.0 111.186 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1113 ' ' MET . . . . . 0.401 ' HG3' ' CZ ' ' D' 1109 ' ' PHE . 0.0 OUTLIER -71.74 -43.99 64.86 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.213 1.369 . . . . 0.0 109.577 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' D' D 1114 ' ' LYS . . . . . 0.443 ' HE3' ' HE3' ' A' ' 18' ' ' MET . 8.8 ttpt -56.9 -44.74 82.66 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 68.9 mt -63.46 -36.09 82.6 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.869 0.868 . . . . 0.0 111.248 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -60.03 4.47 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.215 -0.928 . . . . 0.0 108.68 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -64.4 -29.37 70.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.368 0.267 . . . . 0.0 111.081 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 17.8 t -64.45 -47.68 78.17 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.842 0.747 . . . . 0.0 110.088 178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.51 -44.3 58.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 116.959 -1.496 . . . . 0.0 111.979 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -59.28 -41.24 88.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.952 1.705 . . . . 0.0 110.827 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.1 mm? -66.33 -50.6 63.04 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 3.5 ttt -61.76 -27.4 68.7 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.31 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -78.6 -37.07 43.33 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.345 1.458 . . . . 0.0 111.773 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -79.43 -27.9 41.71 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 118.362 -0.828 . . . . 0.0 112.257 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.25 147.14 33.98 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 118.735 0.698 . . . . 0.0 109.988 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.92 -175.16 0.55 Allowed 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.243 2.629 . . . . 0.0 109.378 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.272 7.2 pt20 -111.63 51.18 0.34 Allowed Pre-proline 0 CA--C 1.557 1.232 0 O-C-N 120.039 -1.663 . . . . 0.0 114.425 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.42 -65.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.462 2.775 . . . . 0.0 113.127 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.15 -30.43 71.49 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.708 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -58.92 -55.79 21.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.814 1.246 . . . . 0.0 110.367 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 45.2 t0 -63.63 -40.71 97.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.649 0.659 . . . . 0.0 110.483 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 19.9 m -60.13 -50.4 73.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.327 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.7 t80 -62.96 -42.92 99.97 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.89 1.276 . . . . 0.0 110.39 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -45.61 70.44 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -69.03 -52.88 24.02 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.577 0.751 . . . . 0.0 110.512 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -50.47 -47.51 57.04 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.027 1.731 . . . . 0.0 111.183 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.72 -38.99 62.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.547 1.139 . . . . 0.0 109.281 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.5 -32.39 39.92 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.495 1.043 . . . . 0.0 110.882 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -56.98 -23.55 46.72 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 118.684 0.675 . . . . 0.0 112.171 177.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 32.2 tp -77.38 -40.95 41.96 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.485 1.493 . . . . 0.0 112.898 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -137.65 107.3 6.21 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 125.477 1.511 . . . . 0.0 107.598 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 . . . . . 0 C--O 1.252 1.219 0 C-N-CA 123.672 0.789 . . . . 0.0 110.464 -179.675 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.2 m . . . . . 0 N--CA 1.463 0.202 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -102.87 -83.77 0.47 Allowed 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.64 -35.5 11.58 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.447 0.699 . . . . 0.0 111.785 -179.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.418 ' HG3' ' H ' ' A' ' 5' ' ' LEU . 2.2 tp10 76.01 167.93 0.27 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 127.239 2.215 . . . . 0.0 110.582 -178.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.418 ' H ' ' HG3' ' A' ' 4' ' ' GLU . 57.3 tp -79.38 95.24 5.69 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.1 mt -95.52 140.73 29.94 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -112.21 144.11 42.15 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.774 1.63 . . . . 0.0 107.902 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.4 tp -130.39 94.04 30.99 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 124.596 1.158 . . . . 0.0 109.546 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -78.58 121.26 5.07 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 109.356 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.4 t -144.78 156.08 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.03 1.286 . . . . 0.0 108.719 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -133.03 102.17 5.5 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.99 110.58 0.41 Allowed Glycine 0 C--O 1.219 -0.84 0 CA-C-O 115.839 -2.645 . . . . 0.0 107.526 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.32 65.29 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 122.94 3.37 . . . . 0.0 109.1 178.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -67.05 -46.84 73.14 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -36.85 84.8 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.925 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -71.11 -43.9 66.73 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 120.189 1.359 . . . . 0.0 108.672 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.14 -49.8 76.21 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.511 1.051 . . . . 0.0 109.308 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.4 ttp -57.22 -46.77 82.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.882 0.473 . . . . 0.0 109.82 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.54 -38.97 93.17 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 123.921 0.888 . . . . 0.0 110.027 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.37 -47.13 71.29 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 119.297 0.953 . . . . 0.0 109.718 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -48.95 74.01 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.582 0.753 . . . . 0.0 110.501 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.3 mt -73.01 -33.45 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.185 0.994 . . . . 0.0 110.957 -178.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -67.58 -56.9 7.62 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.57 -38.94 72.64 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.058 2.143 . . . . 0.0 110.426 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -61.19 -52.52 64.48 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.405 -0.807 . . . . 0.0 110.838 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -39.27 61.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.012 0.824 . . . . 0.0 111.851 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.79 -54.47 46.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.827 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.21 -41.45 77.05 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 117.97 -1.015 . . . . 0.0 110.264 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -57.86 -38.99 76.68 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.247 0.931 . . . . 0.0 110.668 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -79.53 -20.63 46.66 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.328 0.513 . . . . 0.0 110.119 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -82.59 -39.56 22.06 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.984 -1.072 . . . . 0.0 112.103 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.3 tp -122.38 76.06 43.66 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.876 1.67 . . . . 0.0 109.933 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -78.13 73.92 5.55 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 123.516 2.811 . . . . 0.0 111.914 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.86 170.49 2.05 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 121.177 -0.952 . . . . 0.0 109.273 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -60.6 -24.61 65.62 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.5 m -54.8 -51.16 66.65 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.165 2.186 . . . . 0.0 109.031 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.48 -45.87 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 125.607 1.563 . . . . 0.0 109.733 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.97 -55.6 32.06 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.817 0.447 . . . . 0.0 111.845 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -62.0 -43.01 99.74 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.42 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -58.02 -49.55 76.48 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 119.494 1.043 . . . . 0.0 108.9 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.97 -48.2 82.69 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.193 1.397 . . . . 0.0 111.725 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -59.85 -56.55 20.36 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.477 1.111 . . . . 0.0 110.091 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -58.48 -43.95 89.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.155 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -52.86 -46.75 68.01 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.163 0.985 . . . . 0.0 111.95 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.12 -53.9 38.11 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.009 0.524 . . . . 0.0 111.016 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -62.1 -32.66 73.24 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.011 0.434 . . . . 0.0 110.84 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -66.78 -45.58 78.02 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.648 1.579 . . . . 0.0 109.951 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -53.93 -50.52 66.25 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.163 0.892 . . . . 0.0 111.083 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -58.16 -29.85 65.9 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -83.74 -46.4 12.29 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.15 0.98 . . . . 0.0 111.044 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.0 mp -58.23 -55.46 34.67 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 124.568 1.147 . . . . 0.0 111.082 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 52.4 tp -53.8 -75.59 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.305 1.442 . . . . 0.0 113.606 -178.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -158.13 151.46 23.2 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.347 -0.846 . . . . 0.0 112.028 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -77.49 -25.53 50.49 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.963 0.905 . . . . 0.0 110.203 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -169.27 -65.99 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 129.336 3.055 . . . . 0.0 104.503 178.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 14.4 t -164.52 165.86 20.9 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.008 2.123 . . . . 0.0 106.314 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.9 m 33.49 -152.96 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 129.196 2.998 . . . . 0.0 116.146 178.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.7 pt -78.34 -30.26 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 124.826 1.25 . . . . 0.0 109.888 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -146.36 159.28 43.57 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 129.146 2.978 . . . . 0.0 105.685 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 54.7 p . . . . . 0 C--O 1.255 1.348 0 CA-C-O 113.64 -3.076 . . . . 0.0 104.289 179.403 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.542 0 N-CA-C 111.399 -0.681 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.0 t -174.61 -176.33 1.04 Allowed 'General case' 0 C--O 1.236 0.352 0 C-N-CA 126.998 2.119 . . . . 0.0 107.162 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.52 159.99 29.87 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 104.438 -2.43 . . . . 0.0 104.438 176.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -131.4 18.98 4.81 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.5 1.12 . . . . 0.0 110.152 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -132.33 153.07 51.1 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.799 0.839 . . . . 0.0 109.78 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.7 m -79.2 158.05 27.72 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -106.03 150.68 25.51 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -128.58 140.15 51.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.511 1.125 . . . . 0.0 110.718 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.5 mt -133.21 110.12 9.9 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -110.29 98.59 7.8 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 128.503 2.721 . . . . 0.0 105.808 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -154.41 151.17 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.226 1.41 . . . . 0.0 109.012 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.33 101.27 7.27 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.685 0.675 . . . . 0.0 110.813 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.19 105.42 0.39 Allowed Glycine 0 C--O 1.228 -0.28 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -53.79 -54.15 42.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 121.586 2.693 . . . . 0.0 112.918 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.89 -40.65 89.45 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.868 0.758 . . . . 0.0 109.854 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -60.18 -50.58 73.13 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.154 -0.926 . . . . 0.0 110.539 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -54.33 -46.04 72.8 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 119.256 0.935 . . . . 0.0 111.194 -178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -61.74 -53.74 51.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.34 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 45.2 mt -58.05 -52.54 57.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.985 1.714 . . . . 0.0 110.543 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 73.6 mt -65.76 -32.28 73.73 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.154 1.381 . . . . 0.0 111.885 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 24.3 mtp -68.24 -54.56 16.85 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.85 1.205 . . . . 0.0 109.433 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -60.71 -35.95 77.62 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.674 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.95 -54.77 11.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 117.836 -1.078 . . . . 0.0 110.697 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 5.3 tptp -58.16 -40.83 82.42 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 121.059 1.754 . . . . 0.0 110.018 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.5 -58.53 7.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 126.322 1.849 . . . . 0.0 106.39 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 90.2 p -57.68 -36.16 71.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.3 -42.77 65.11 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.17 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -64.84 -40.03 94.52 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.012 1.278 . . . . 0.0 107.583 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 44.6 mt -64.24 -46.16 85.0 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.026 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -71.2 -19.08 62.43 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.312 0.96 . . . . 0.0 110.7 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -89.08 -42.79 11.51 Favored 'General case' 0 C--N 1.343 0.323 0 O-C-N 121.01 -1.056 . . . . 0.0 113.225 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -76.3 -33.01 59.07 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.0 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -95.5 147.56 33.2 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 178.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -71.68 177.89 6.36 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.508 1.472 . . . . 0.0 110.382 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -112.17 50.85 0.37 Allowed Pre-proline 0 CA--C 1.554 1.099 0 O-C-N 121.08 -1.013 . . . . 0.0 112.389 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.37 -57.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.732 2.288 . . . . 0.0 113.292 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.2 tt -65.33 -33.52 76.16 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 119.992 1.269 . . . . 0.0 109.206 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 40.2 t -54.36 -56.33 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.851 1.661 . . . . 0.0 109.228 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.59 -47.35 85.88 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.81 0.844 . . . . 0.0 111.233 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 30.1 t -54.75 -50.78 67.58 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 0.0 110.442 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -68.55 -44.08 75.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.87 1.268 . . . . 0.0 111.019 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -54.96 -46.0 74.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 118.822 0.737 . . . . 0.0 109.729 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -65.81 -49.63 67.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.448 0.567 . . . . 0.0 110.917 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -57.28 -44.77 84.29 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.229 0.612 . . . . 0.0 111.673 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.69 -29.82 61.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.882 0.873 . . . . 0.0 109.547 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -61.75 -32.83 73.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -6.0 3.62 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.07 1.348 . . . . 0.0 113.021 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 4.7 tt -76.5 -49.34 16.75 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -90.93 178.2 6.09 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.923 2.089 . . . . 0.0 111.328 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 117.644 -1.17 . . . . 0.0 108.815 -179.65 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.468 0.448 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.87 -74.12 0.41 Allowed 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -100.88 -50.48 3.82 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.867 0.758 . . . . 0.0 109.976 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.5 tp10 75.24 163.84 0.26 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 127.503 2.321 . . . . 0.0 110.894 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 67.2 tp -78.47 95.21 5.08 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 42.8 mt -90.52 153.75 20.13 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -123.29 142.31 51.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.584 1.154 . . . . 0.0 108.921 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 41.7 tp -134.11 94.89 17.43 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.11 0.964 . . . . 0.0 111.182 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.18 130.03 9.05 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.432 2.755 . . . . 0.0 109.964 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 2.4 t -145.78 152.04 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.602 1.161 . . . . 0.0 108.478 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -134.91 101.83 5.03 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 177.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.57 117.01 0.7 Allowed Glycine 0 CA--C 1.519 0.328 0 N-CA-C 105.402 -3.079 . . . . 0.0 105.402 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -52.41 58.85 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 122.067 2.934 . . . . 0.0 110.968 -179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.95 -41.14 78.43 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 54.0 m -58.27 -48.03 81.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 118.316 -0.849 . . . . 0.0 109.964 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.4 t80 -58.54 -50.59 73.21 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 119.147 0.885 . . . . 0.0 110.145 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.0 -48.8 78.72 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 ttt -58.69 -49.34 77.93 Favored 'General case' 0 N--CA 1.46 0.066 0 C-N-CA 124.754 1.222 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.86 -50.28 73.85 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.385 1.074 . . . . 0.0 109.132 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -55.86 28.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.011 0.924 . . . . 0.0 111.15 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -55.6 -48.52 74.75 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.676 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 76.7 mt -67.0 -43.93 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.669 -0.644 . . . . 0.0 111.176 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.16 -52.28 59.77 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 123.786 0.835 . . . . 0.0 111.539 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -66.92 -35.11 79.25 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.258 1.023 . . . . 0.0 110.044 -179.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 4.8 t -56.05 -51.77 66.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -48.27 80.17 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 123.193 0.308 . . . . 0.0 110.663 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -57.06 -54.62 44.68 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.51 0.724 . . . . 0.0 111.989 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.43 -41.4 84.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 119.342 0.974 . . . . 0.0 112.344 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -44.6 92.8 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 -22.99 46.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.733 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 t80 -79.14 -33.45 44.16 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.117 1.326 . . . . 0.0 111.311 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 49.8 tp -129.1 74.22 81.26 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -77.55 77.83 3.73 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.166 2.577 . . . . 0.0 110.57 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -63.51 174.55 1.27 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.349 1.46 . . . . 0.0 109.875 178.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 38.3 m80 -54.99 -32.83 62.02 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.245 -0.91 . . . . 0.0 112.934 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.6 m -61.27 -49.39 77.27 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 120.117 1.326 . . . . 0.0 109.451 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1037 ' ' ILE . . . . . 0.453 ' CD1' ' H ' ' C' 1037 ' ' ILE . 2.2 mp -59.21 -42.95 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 126.342 1.857 . . . . 0.0 109.526 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.73 -59.41 4.93 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.676 1.19 . . . . 0.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.3 m -60.1 -52.74 64.05 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.153 1.381 . . . . 0.0 111.897 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.27 -50.33 69.8 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.466 0.706 . . . . 0.0 112.37 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -61.13 -44.7 96.94 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 118.887 0.767 . . . . 0.0 111.641 -179.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -61.93 -48.91 78.32 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -64.55 -36.24 83.56 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-O 116.984 -1.484 . . . . 0.0 111.127 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -60.46 -42.33 95.95 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 120.92 1.691 . . . . 0.0 108.239 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -47.6 84.89 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 118.997 0.817 . . . . 0.0 110.598 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -68.94 -54.11 17.2 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 123.41 0.444 . . . . 0.0 110.647 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -55.75 -42.59 75.62 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 126.23 1.812 . . . . 0.0 111.294 -179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -52.87 -49.77 65.16 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.115 1.325 . . . . 0.0 109.112 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -57.06 -43.46 82.05 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.14 0.976 . . . . 0.0 110.864 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -72.21 -43.63 64.19 Favored 'General case' 0 C--O 1.234 0.268 0 O-C-N 121.787 -0.57 . . . . 0.0 112.523 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.93 -23.07 66.12 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.091 1.356 . . . . 0.0 111.873 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 11.2 tp -74.18 -79.03 0.09 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -167.88 179.69 4.6 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.236 1.414 . . . . 0.0 109.424 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.43 -48.75 5.45 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -138.51 -78.57 0.35 Allowed 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 103.604 -2.739 . . . . 0.0 103.604 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 12.5 t -157.51 172.46 18.52 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.348 1.059 . . . . 0.0 108.287 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 6.4 m 25.33 -107.82 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 131.546 3.938 . . . . 0.0 112.904 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 42.4 pt -122.61 -24.09 2.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.143 1.377 . . . . 0.0 111.202 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -146.15 159.18 43.66 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 128.528 2.731 . . . . 0.0 105.527 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 46.5 p . . . . . 0 C--O 1.255 1.393 0 CA-C-O 113.921 -2.942 . . . . 0.0 105.6 179.819 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.85 0 N-CA-C 108.983 -1.647 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 2.1 t -149.89 169.87 20.13 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 105.204 -2.147 . . . . 0.0 105.204 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.91 147.42 50.36 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -108.33 21.63 17.05 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 126.029 1.732 . . . . 0.0 111.842 -178.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 1.4 t0 -138.02 164.87 27.98 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 113.442 0.905 . . . . 0.0 113.442 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 80.6 m -86.86 167.24 14.52 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.009 1.723 . . . . 0.0 111.12 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -120.38 143.12 48.59 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -126.83 142.94 51.41 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.777 1.231 . . . . 0.0 110.677 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 90.4 mt -129.86 140.97 50.89 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -136.87 98.44 3.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.423 1.077 . . . . 0.0 108.117 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.6 m -153.19 151.51 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.944 1.298 . . . . 0.0 111.671 -177.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.33 102.79 10.18 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.374 0.988 . . . . 0.0 111.604 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.25 116.81 0.99 Allowed Glycine 0 C--O 1.229 -0.168 0 CA-C-O 115.636 -2.758 . . . . 0.0 107.886 177.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.78 -56.93 11.81 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 122.521 3.16 . . . . 0.0 111.592 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.84 -43.8 97.83 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 14.7 m120 -54.13 -47.88 71.39 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 117.671 -1.156 . . . . 0.0 112.038 -178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.1 t80 -64.5 -46.25 83.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.524 1.056 . . . . 0.0 109.856 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.98 -52.39 65.7 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.537 1.062 . . . . 0.0 111.408 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.16 -48.61 84.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 126.971 2.108 . . . . 0.0 111.825 -178.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 53.8 mt -67.72 -36.14 80.06 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.901 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 68.8 mtp -65.45 -53.2 46.32 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 119.999 1.272 . . . . 0.0 109.729 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -56.37 -40.72 75.01 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.359 0.981 . . . . 0.0 111.276 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 38.6 mt -74.24 -41.0 62.03 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1116 ' ' LYS . . . . . 0.521 ' HZ1' ' HG2' ' D' 1120 ' ' GLU . 3.1 tptp -65.7 -43.44 89.17 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.476 -1.39 . . . . 0.0 107.941 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -59.47 -52.86 63.76 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.482 1.513 . . . . 0.0 108.021 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 84.2 p -60.6 -34.64 74.53 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.008 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.07 -36.98 78.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.233 0.924 . . . . 0.0 109.489 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D 1120 ' ' GLU . . . . . 0.521 ' HG2' ' HZ1' ' D' 1116 ' ' LYS . 0.6 OUTLIER -64.71 -52.48 56.9 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.238 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 43.3 mt -57.8 -47.12 83.49 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.135 1.774 . . . . 0.0 112.122 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.0 ppp? -76.49 -24.61 53.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 120.074 1.306 . . . . 0.0 112.749 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -80.44 -42.9 21.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.115 0.87 . . . . 0.0 110.049 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.3 -32.24 38.07 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.77 149.07 35.86 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.766 1.226 . . . . 0.0 107.916 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -65.36 167.95 15.52 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 121.339 1.359 . . . . 0.0 110.954 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -118.79 57.05 3.1 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 124.507 1.123 . . . . 0.0 113.113 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -70.51 -64.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.25 2.633 . . . . 0.0 112.826 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.7 tt -58.81 -33.78 70.76 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.868 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.8 t -52.2 -53.52 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 C-N-CA 124.154 0.982 . . . . 0.0 110.054 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 35.5 t0 -70.52 -41.17 72.91 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.202 0.91 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 14.5 t -54.82 -49.82 70.07 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.16 -49.72 63.73 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.423 1.489 . . . . 0.0 109.8 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -53.53 -45.91 69.96 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.216 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.67 -49.18 69.55 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 120.525 1.511 . . . . 0.0 110.236 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -52.03 -49.26 63.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.125 1.37 . . . . 0.0 109.242 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -39.68 75.24 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 127.138 2.175 . . . . 0.0 111.173 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -59.94 -28.09 67.33 Favored 'General case' 0 N--CA 1.462 0.156 0 O-C-N 120.988 -1.07 . . . . 0.0 109.651 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -19.71 47.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.506 0.722 . . . . 0.0 111.076 177.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.44 -54.44 20.31 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.17 1.388 . . . . 0.0 110.332 179.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -92.34 155.05 18.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.635 0.652 . . . . 0.0 112.307 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 33.1 mtp85 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 116.625 -1.655 . . . . 0.0 107.343 178.688 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 120.394 0.14 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -60.39 -9.38 3.51 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 126.458 1.903 . . . . 0.0 114.655 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -80.24 31.6 0.28 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.11 1.364 . . . . 0.0 109.776 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -74.51 104.0 5.05 Favored 'General case' 0 CA--C 1.521 -0.149 0 O-C-N 119.508 -1.995 . . . . 0.0 109.618 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -66.19 96.43 0.34 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.785 1.634 . . . . 0.0 109.121 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.88 143.73 26.69 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -103.79 100.69 10.5 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 30.7 tp -92.11 107.36 22.48 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 128.468 2.707 . . . . 0.0 108.217 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -85.16 129.68 3.88 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.218 2.612 . . . . 0.0 110.767 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 t -145.43 150.62 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.92 1.236 . . . . 0.0 110.867 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -136.43 102.24 4.9 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.95 128.1 1.63 Allowed Glycine 0 N--CA 1.459 0.208 0 CA-C-O 114.845 -3.197 . . . . 0.0 107.765 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -52.97 17.64 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 122.791 3.295 . . . . 0.0 109.898 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.35 -33.79 76.51 Favored 'General case' 0 C--N 1.343 0.29 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 m -60.48 -50.26 74.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.287 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.95 -46.42 87.81 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.217 -178.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -59.24 -52.37 65.95 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.413 0.551 . . . . 0.0 111.067 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 34.6 ttm -59.12 -52.0 67.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.245 1.018 . . . . 0.0 109.215 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.7 mp -60.8 -30.72 70.23 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.78 0.718 . . . . 0.0 111.015 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -55.77 7.74 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 119.197 0.908 . . . . 0.0 108.849 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.14 -39.04 92.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -178.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.4 mt -62.13 -47.6 92.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.41 -58.04 9.82 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -51.97 -39.29 59.1 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.358 1.863 . . . . 0.0 113.386 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 p -69.02 -51.16 42.12 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.675 0.671 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 tt -62.83 -50.65 70.14 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 124.614 1.166 . . . . 0.0 111.553 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.91 -53.99 48.34 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.33 1.052 . . . . 0.0 110.79 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.34 -35.81 76.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.562 0.619 . . . . 0.0 111.365 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -27.03 68.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.509 1.05 . . . . 0.0 110.529 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -92.77 -28.26 16.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.791 -0.568 . . . . 0.0 109.848 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -75.46 -29.92 59.78 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.145 0.884 . . . . 0.0 110.65 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -114.78 75.86 3.93 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.677 1.591 . . . . 0.0 107.771 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -76.09 73.69 4.83 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.966 3.111 . . . . 0.0 110.424 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.98 159.92 27.44 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.968 -1.083 . . . . 0.0 109.471 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -54.4 -34.51 61.43 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.104 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.0 m -59.3 -45.15 92.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.614 1.097 . . . . 0.0 110.106 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.47 -49.66 82.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 C-N-CA 125.384 1.474 . . . . 0.0 108.148 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.34 -41.57 96.71 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.2 m -60.88 -50.22 74.29 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.11 -43.16 77.87 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.627 0.771 . . . . 0.0 110.287 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -49.38 78.01 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.86 -0.525 . . . . 0.0 110.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -65.52 -50.39 65.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.948 0.899 . . . . 0.0 110.899 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -54.93 36.82 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.543 1.137 . . . . 0.0 110.596 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? -64.91 -32.9 74.84 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.886 1.221 . . . . 0.0 112.734 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.47 -47.77 74.93 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 118.762 0.71 . . . . 0.0 109.159 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -66.27 -48.12 71.47 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.434 1.094 . . . . 0.0 109.502 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -52.67 -33.85 49.07 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 126.027 1.731 . . . . 0.0 112.342 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -57.69 -23.99 54.48 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.979 -0.451 . . . . 0.0 111.066 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -70.81 -38.98 73.35 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 125.971 1.709 . . . . 0.0 111.306 178.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -92.69 -3.88 54.14 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.185 0.994 . . . . 0.0 113.294 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.7 tt -43.03 -35.43 1.26 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 128.472 2.709 . . . . 0.0 114.4 -177.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 52.6 tp -47.4 -32.14 4.71 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.229 1.812 . . . . 0.0 112.758 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 17.38 102.33 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 130.243 3.417 . . . . 0.0 113.97 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -57.46 164.08 2.08 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.746 0.818 . . . . 0.0 110.863 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -66.08 69.59 0.06 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 127.428 2.291 . . . . 0.0 110.582 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -148.46 90.47 1.8 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.835 2.854 . . . . 0.0 104.459 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -63.52 112.61 2.86 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.61 1.564 . . . . 0.0 111.337 -179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 8.9 tp -152.91 -10.88 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.468 0.707 . . . . 0.0 112.505 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -60.72 108.39 0.84 Allowed 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.093 0.861 . . . . 0.0 110.772 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 C--O 1.25 1.089 0 C-N-CA 128.627 2.771 . . . . 0.0 103.822 179.6 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.622 0 CA-C-O 121.383 0.435 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 9.1 p -135.95 -55.81 0.77 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.065 1.346 . . . . 0.0 109.844 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 49.74 67.6 0.87 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.8 2.04 . . . . 0.0 108.314 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -106.22 -4.32 20.33 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.756 2.022 . . . . 0.0 114.17 -178.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -80.64 35.86 0.37 Allowed 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.707 -1.246 . . . . 0.0 110.68 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m -52.77 143.73 15.86 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.606 2.362 . . . . 0.0 114.443 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -109.8 140.03 44.18 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.42 145.94 49.84 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 127.466 2.306 . . . . 0.0 107.867 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 50.0 mt -147.94 150.16 33.54 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.772 0.829 . . . . 0.0 109.052 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.02 107.63 4.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.524 -1.227 . . . . 0.0 110.43 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.9 t -155.13 144.82 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 119.879 1.218 . . . . 0.0 109.374 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.06 103.85 15.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -141.38 112.75 0.79 Allowed Glycine 0 C--O 1.227 -0.307 0 N-CA-C 106.985 -2.446 . . . . 0.0 106.985 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 46.3 tpt85 -65.22 -59.21 4.32 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.991 2.396 . . . . 0.0 112.068 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -71.67 -42.02 68.0 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.16 -50.81 61.07 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 125.639 1.576 . . . . 0.0 110.468 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.31 -41.04 85.99 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.822 1.192 . . . . 0.0 110.322 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.85 -52.44 62.78 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.491 1.042 . . . . 0.0 109.134 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 56.2 mt -57.08 -57.88 8.14 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 C-N-CA 127.205 2.202 . . . . 0.0 110.118 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 mp -55.26 -54.01 48.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.571 1.148 . . . . 0.0 110.869 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 7.3 ttp -59.84 -45.12 93.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.356 0.98 . . . . 0.0 111.417 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -56.31 -52.43 64.55 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.897 0.879 . . . . 0.0 109.934 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 78.4 mt -70.49 -30.0 66.68 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -58.81 -60.04 4.48 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.43 -45.27 80.84 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 124.201 0.938 . . . . 0.0 110.688 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 66.7 m -60.48 -44.06 96.32 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 118.034 -0.984 . . . . 0.0 113.389 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -38.21 63.01 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.894 1.224 . . . . 0.0 109.458 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -55.35 -52.81 62.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.798 0.808 . . . . 0.0 109.396 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.08 -42.41 94.13 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.452 -1.261 . . . . 0.0 109.288 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.52 -31.08 70.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.338 0.972 . . . . 0.0 111.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -77.09 -40.02 47.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.828 0.74 . . . . 0.0 110.013 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 26.7 tp -76.61 -22.46 54.15 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 33.3 m -94.5 147.61 33.54 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 119.848 1.203 . . . . 0.0 109.334 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.54 177.4 7.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 121.883 1.722 . . . . 0.0 108.639 178.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -112.09 56.58 0.47 Allowed Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 121.056 -1.028 . . . . 0.0 113.013 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.5 -72.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.584 2.19 . . . . 0.0 110.544 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.17 -36.91 85.18 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.8 t -54.29 -56.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 125.029 1.331 . . . . 0.0 111.597 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.18 -44.94 90.46 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.161 1.346 . . . . 0.0 111.497 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 17.4 t -57.83 -47.0 83.89 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -68.25 -35.63 78.21 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.235 1.414 . . . . 0.0 109.684 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 23.0 ttm-85 -55.46 -48.95 73.71 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.229 1.377 . . . . 0.0 108.834 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -69.72 -51.64 32.51 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.905 0.882 . . . . 0.0 111.631 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -51.11 -49.07 61.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.861 0.864 . . . . 0.0 110.068 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.26 -37.54 71.94 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.527 1.131 . . . . 0.0 110.579 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -57.13 -27.62 61.99 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.172 0.989 . . . . 0.0 110.6 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.25 -12.97 57.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.778 0.717 . . . . 0.0 112.186 177.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.66 2.8 35.82 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.943 -1.098 . . . . 0.0 111.045 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -133.1 177.45 7.65 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 126.009 1.724 . . . . 0.0 108.232 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 . . . . . 0 C--O 1.249 1.058 0 C-N-CA 125.12 1.368 . . . . 0.0 108.929 -179.711 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.474 0.74 0 CA-C-O 121.126 0.488 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -103.87 33.71 3.31 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 130.057 3.343 . . . . 0.0 109.26 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -118.13 39.28 3.44 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.755 1.222 . . . . 0.0 109.206 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -67.15 113.88 5.45 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 178.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 7.6 tt -79.37 98.88 6.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.147 1.379 . . . . 0.0 108.528 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.2 mt -87.64 152.74 21.93 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 126.125 1.77 . . . . 0.0 107.138 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -115.15 100.07 7.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 23.6 tp -82.04 108.57 11.84 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.455 1.502 . . . . 0.0 108.932 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -93.74 103.43 0.14 Allowed 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 124.772 3.648 . . . . 0.0 110.923 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 68.0 t -136.39 159.18 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 120.759 -1.213 . . . . 0.0 110.641 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -135.52 102.2 5.05 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.51 130.97 2.22 Favored Glycine 0 CA--C 1.517 0.176 0 CA-C-O 115.538 -2.812 . . . . 0.0 109.23 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -70.12 -52.68 21.77 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 121.351 2.576 . . . . 0.0 108.636 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.33 -34.93 78.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.199 0.599 . . . . 0.0 109.825 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.7 m -65.95 -47.98 72.85 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 89.9 t80 -64.33 -49.48 71.54 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.843 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -55.46 -53.23 58.94 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.527 1.131 . . . . 0.0 110.506 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 10.4 ttm -58.17 -53.59 56.6 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 123.285 0.634 . . . . 0.0 110.25 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.1 mp -62.75 -28.62 70.09 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.725 -1.131 . . . . 0.0 111.489 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.81 -56.6 5.96 Favored 'General case' 0 CA--C 1.522 -0.102 0 CA-C-N 120.696 1.589 . . . . 0.0 108.259 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -61.11 -46.9 88.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.479 0.712 . . . . 0.0 112.785 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 48.0 mt -67.9 -44.12 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.604 0.638 . . . . 0.0 110.632 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.2 tmpt? -66.73 -44.22 82.14 Favored 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 120.974 -1.079 . . . . 0.0 110.01 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -62.93 -50.85 69.21 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.582 0.753 . . . . 0.0 110.518 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 19.0 p -56.14 -46.41 79.25 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.184 0.902 . . . . 0.0 111.475 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 4.2 tt -62.94 -49.1 76.07 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.927 1.291 . . . . 0.0 110.056 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -60.27 -54.91 40.13 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.788 0.835 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.76 -40.93 94.31 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 124.416 1.086 . . . . 0.0 112.132 -178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmm? -63.27 -44.29 95.55 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -65.0 -37.11 86.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -33.54 76.15 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.801 1.24 . . . . 0.0 112.714 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -112.16 82.58 4.46 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 119.28 0.946 . . . . 0.0 109.713 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -73.83 62.0 4.72 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 125.095 3.863 . . . . 0.0 113.339 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.35 158.39 26.63 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.383 1.073 . . . . 0.0 109.224 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 26.5 m80 -61.46 -32.23 72.22 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.107 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 60.8 m -57.95 -47.67 82.24 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.473 1.033 . . . . 0.0 108.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 4.0 mp -59.29 -42.09 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.915 0.886 . . . . 0.0 109.062 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.06 -57.73 10.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.652 0.381 . . . . 0.0 111.213 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 91.2 m -57.82 -43.46 85.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.3 1.04 . . . . 0.0 109.745 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -58.43 -46.54 86.29 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.539 1.063 . . . . 0.0 110.302 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -49.16 76.54 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.69 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -68.32 -47.74 66.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 118.802 -0.618 . . . . 0.0 110.99 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -48.28 -51.19 26.88 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.081 1.353 . . . . 0.0 110.102 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . 0.296 3.7 pp0? -72.98 -31.72 64.71 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.74 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -66.25 -40.25 90.07 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.184 1.356 . . . . 0.0 108.456 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -70.31 -41.77 72.86 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -58.34 -36.88 74.09 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.481 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 1.9 t60 -54.98 -27.81 46.88 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.461 1.028 . . . . 0.0 112.363 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -70.51 -45.84 64.81 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.002 -1.061 . . . . 0.0 109.658 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -78.09 -9.35 59.11 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 128.405 2.682 . . . . 0.0 114.955 -178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 9.9 tt -44.78 -30.73 1.01 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 128.619 2.767 . . . . 0.0 114.376 -178.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 64.9 tp -51.09 -32.07 21.15 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 117.527 -1.225 . . . . 0.0 112.721 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 18.16 96.38 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 129.648 3.179 . . . . 0.0 115.989 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 30.8 tttt -52.81 139.79 25.91 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 125.6 1.56 . . . . 0.0 110.046 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.95 81.76 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.87 2.868 . . . . 0.0 111.939 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.91 103.08 0.78 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.207 -1.775 . . . . 0.0 106.207 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 5.8 m -57.44 138.28 55.2 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.549 1.14 . . . . 0.0 110.019 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 6.9 tp -160.41 -37.01 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 124.53 1.132 . . . . 0.0 110.267 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -60.79 148.96 37.33 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.884 0.874 . . . . 0.0 111.46 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 30.8 t . . . . . 0 C--O 1.252 1.206 0 N-CA-C 100.289 -3.967 . . . . 0.0 100.289 178.873 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.316 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 9.7 p -174.84 -53.37 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 125.612 1.565 . . . . 0.0 108.703 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 1.2 m-20 59.25 67.9 0.86 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 127.386 2.274 . . . . 0.0 109.458 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -117.29 -4.64 11.35 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.244 2.217 . . . . 0.0 114.02 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -82.96 29.67 0.46 Allowed 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.391 -1.443 . . . . 0.0 111.656 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 5.0 m -53.78 139.09 34.01 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 126.167 1.787 . . . . 0.0 110.687 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -106.99 145.4 32.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -130.03 143.29 50.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 125.571 1.548 . . . . 0.0 107.306 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 59.7 mt -144.42 154.81 43.35 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.095 0.558 . . . . 0.0 110.446 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -145.02 107.42 4.38 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.453 1.901 . . . . 0.0 108.116 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 99.6 t -155.55 152.32 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 128.547 2.739 . . . . 0.0 106.497 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 103.49 7.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 121.128 1.785 . . . . 0.0 112.854 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.39 120.33 1.75 Allowed Glycine 0 C--O 1.228 -0.279 0 N-CA-C 105.957 -2.857 . . . . 0.0 105.957 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 9.3 tpt85 -57.85 -56.61 19.69 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.439 1.62 . . . . 0.0 111.688 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 58.7 mttp -67.51 -48.91 65.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -51.7 -52.03 51.47 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.051 0.94 . . . . 0.0 110.51 -177.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 93.1 t80 -61.06 -51.03 70.91 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 117.89 -1.052 . . . . 0.0 111.816 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -57.63 -47.56 81.88 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.875 1.216 . . . . 0.0 111.415 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 87.7 mt -61.21 -58.2 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.832 1.253 . . . . 0.0 108.896 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 4.6 mp -55.2 -47.47 75.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.264 0.626 . . . . 0.0 109.802 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -44.38 87.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.695 1.198 . . . . 0.0 110.279 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -62.72 -53.03 60.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.751 1.16 . . . . 0.0 108.558 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 59.4 mt -59.2 -30.06 67.94 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.084 0.553 . . . . 0.0 112.475 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -64.34 -60.52 3.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.703 1.201 . . . . 0.0 108.522 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.23 -41.21 99.07 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 123.704 0.628 . . . . 0.0 110.722 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 58.6 m -58.91 -48.18 82.36 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.35 0.977 . . . . 0.0 112.019 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -41.63 70.21 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -57.27 -46.55 82.97 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.645 1.111 . . . . 0.0 110.341 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.52 -39.67 88.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 117.804 -1.093 . . . . 0.0 108.783 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -66.97 -30.75 70.95 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.151 0.98 . . . . 0.0 110.605 178.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -75.7 -28.74 58.75 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.935 1.694 . . . . 0.0 109.661 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 40.9 tp -85.48 -33.1 21.92 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.597 1.159 . . . . 0.0 112.476 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 21.2 m -93.46 148.0 34.72 Favored Pre-proline 0 C--N 1.332 -0.181 0 O-C-N 120.934 -1.104 . . . . 0.0 110.233 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -70.82 -179.9 3.75 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 N-CA-C 108.105 -1.536 . . . . 0.0 108.105 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -112.0 61.52 0.57 Allowed Pre-proline 0 CA--C 1.544 0.718 0 O-C-N 120.814 -1.179 . . . . 0.0 111.936 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.96 -75.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 123.598 2.865 . . . . 0.0 109.974 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.4 tt -65.05 -30.35 71.31 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.9 t -55.9 -52.41 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.328 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.15 -45.96 75.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.182 1.355 . . . . 0.0 110.693 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -50.25 67.53 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.643 0.777 . . . . 0.0 109.839 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 24.8 t80 -67.02 -42.46 84.9 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 125.335 1.454 . . . . 0.0 110.064 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -57.06 -47.8 80.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.954 1.252 . . . . 0.0 110.866 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -67.45 -37.77 83.48 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.898 0.772 . . . . 0.0 110.453 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -64.67 -34.0 77.26 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.767 1.627 . . . . 0.0 111.238 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.97 -43.69 19.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.53 1.532 . . . . 0.0 108.501 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -57.76 -31.53 66.59 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.018 0.927 . . . . 0.0 110.498 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 19.3 mt -58.6 -21.35 53.16 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.708 0.803 . . . . 0.0 111.429 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.44 -5.49 54.83 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.368 0.667 . . . . 0.0 111.884 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -120.97 161.1 22.17 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.968 1.307 . . . . 0.0 110.29 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 . . . . . 0 C--O 1.254 1.314 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.881 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -102.79 21.28 15.79 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.268 1.427 . . . . 0.0 109.261 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -128.98 26.39 5.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 128.425 2.69 . . . . 0.0 107.895 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.32 142.63 56.75 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.0 tp -89.8 121.75 32.24 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -106.57 163.75 12.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.597 1.159 . . . . 0.0 108.011 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -132.44 145.17 51.0 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -132.99 96.91 17.26 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-O 118.272 -0.871 . . . . 0.0 109.255 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.05 126.4 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.582 2.855 . . . . 0.0 112.737 -179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 t -145.77 148.63 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 119.655 1.116 . . . . 0.0 109.917 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -136.28 100.94 4.53 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.55 117.45 0.74 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 105.389 -3.084 . . . . 0.0 105.389 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -65.09 -50.94 64.18 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 122.174 2.987 . . . . 0.0 111.592 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.267 0.939 . . . . 0.0 110.228 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.2 m -63.84 -49.57 72.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -59.0 -34.88 72.36 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.932 1.242 . . . . 0.0 112.123 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.05 -57.38 13.34 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.422 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 1.2 ptp -63.82 -37.8 88.74 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 119.74 -0.784 . . . . 0.0 112.336 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.55 -53.62 48.88 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 117.896 -1.05 . . . . 0.0 111.817 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.01 -52.6 64.3 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 119.661 1.119 . . . . 0.0 110.439 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -56.29 -47.57 78.39 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.67 -47.62 69.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 118.709 0.686 . . . . 0.0 109.979 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.49 -53.78 41.17 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.937 0.895 . . . . 0.0 109.817 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -61.52 -34.39 75.43 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.978 0.911 . . . . 0.0 112.69 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 p -67.77 -43.74 79.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.489 0.586 . . . . 0.0 110.291 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.07 -42.45 89.38 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.399 1.079 . . . . 0.0 109.333 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -54.74 -53.87 49.4 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 56.5 tp -60.07 -56.28 23.57 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.402 1.081 . . . . 0.0 112.765 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.421 ' HE2' HH21 ' A' ' 41' ' ' ARG . 0.2 OUTLIER -54.36 -32.35 56.68 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.347 1.459 . . . . 0.0 112.467 -178.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -89.92 -41.64 11.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.633 0.651 . . . . 0.0 111.129 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -70.58 -21.71 62.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 112.912 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp -132.29 75.74 73.86 Favored Pre-proline 0 C--O 1.236 0.364 0 C-N-CA 123.992 0.917 . . . . 0.0 110.652 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -70.03 81.84 0.85 Allowed 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.357 2.705 . . . . 0.0 111.252 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -72.17 153.6 41.54 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -61.6 -21.85 64.7 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.33 -0.856 . . . . 0.0 110.854 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 m -62.14 -51.25 68.64 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.5 mp -57.21 -48.1 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.531 1.132 . . . . 0.0 108.682 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -60.57 -58.68 7.45 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.8 p -59.93 -50.02 75.39 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 123.726 0.81 . . . . 0.0 111.9 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.84 -35.25 76.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 118.043 0.383 . . . . 0.0 111.069 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.421 HH21 ' HE2' ' A' ' 29' ' ' MET . 37.9 ttm180 -67.24 -48.57 67.4 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -58.61 -45.62 88.78 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.657 0.383 . . . . 0.0 110.672 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -63.59 -49.66 72.49 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.422 -0.799 . . . . 0.0 110.337 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -58.01 -40.14 80.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.142 0.883 . . . . 0.0 110.239 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -67.19 -49.79 63.34 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -61.62 -38.01 86.06 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.599 -0.688 . . . . 0.0 110.42 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -59.17 -38.97 81.05 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.421 1.089 . . . . 0.0 108.535 178.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -61.9 -25.21 67.43 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.415 0.552 . . . . 0.0 110.987 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -69.68 -44.06 71.23 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -82.37 4.39 24.14 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.643 1.577 . . . . 0.0 112.999 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -28.01 64.21 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 120.085 1.312 . . . . 0.0 112.121 -179.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.21 -9.45 53.05 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.925 0.89 . . . . 0.0 111.437 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -96.73 -175.63 3.35 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 120.189 1.359 . . . . 0.0 111.351 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -61.52 141.79 57.49 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -155.5 93.51 1.5 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.433 0.693 . . . . 0.0 111.419 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 72.2 p -139.06 140.63 38.12 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.014 -1.053 . . . . 0.0 110.073 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.8 m -72.47 105.4 4.14 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 125.463 1.505 . . . . 0.0 110.815 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.6 tt -143.16 165.36 15.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.0 151.85 37.64 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.578 1.551 . . . . 0.0 106.952 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 C--O 1.255 1.365 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 179.145 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.599 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 15.6 m -114.71 -23.53 9.17 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.417 0.687 . . . . 0.0 111.175 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 t0 59.08 28.13 17.31 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 123.17 1.462 . . . . 0.0 111.727 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -138.8 18.62 2.67 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 129.092 2.957 . . . . 0.0 108.98 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -50.15 -74.91 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.334 1.854 . . . . 0.0 109.447 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 98.3 m -159.71 147.61 17.12 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.637 3.175 . . . . 0.0 105.722 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -119.69 130.11 54.87 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 104.15 -2.537 . . . . 0.0 104.15 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -108.33 151.03 26.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.507 1.523 . . . . 0.0 110.43 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 45.1 mt -148.67 150.73 33.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.698 0.799 . . . . 0.0 109.362 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.26 106.02 4.13 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.327 1.451 . . . . 0.0 109.867 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 57.5 t -154.68 151.48 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.968 1.307 . . . . 0.0 109.156 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -113.08 102.33 10.29 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.51 1.504 . . . . 0.0 111.603 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.15 111.32 0.64 Allowed Glycine 0 CA--C 1.52 0.366 0 CA-C-O 116.046 -2.53 . . . . 0.0 108.08 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 11.2 tpt180 -60.32 -58.02 10.3 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.954 2.877 . . . . 0.0 112.566 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -67.28 -41.83 84.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 118.544 0.611 . . . . 0.0 110.613 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -58.78 -48.05 82.6 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.54 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -63.7 -44.13 94.56 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 119.007 0.821 . . . . 0.0 110.438 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -57.66 -53.92 52.71 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.737 0.699 . . . . 0.0 111.277 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.8 mt -59.7 -54.17 38.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 124.31 1.044 . . . . 0.0 109.757 -178.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 58.1 mt -58.63 -51.32 70.42 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 117.259 -1.353 . . . . 0.0 112.247 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 26.2 ttt -64.16 -44.59 91.63 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.96 1.255 . . . . 0.0 111.133 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.1 ttpt -54.05 -52.37 61.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 119.028 0.831 . . . . 0.0 109.115 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 81.6 mt -72.57 -23.88 61.03 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.384 0.674 . . . . 0.0 112.187 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . 0.424 ' HE3' ' CB ' ' D' 1103 ' ' VAL . 25.2 tptt -63.26 -60.11 3.83 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 120.196 1.362 . . . . 0.0 107.978 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -39.13 77.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.434 1.709 . . . . 0.0 108.649 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 7.0 t -57.03 -45.31 83.21 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 123.43 0.692 . . . . 0.0 111.322 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.27 -42.77 71.67 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.382 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.91 -37.03 85.9 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 120.728 1.604 . . . . 0.0 110.248 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 mt -66.57 -48.28 70.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -61.61 -31.9 72.0 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.935 0.894 . . . . 0.0 111.113 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -73.9 -33.35 63.97 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.178 0.899 . . . . 0.0 109.671 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 52.7 tp -83.54 -33.69 25.41 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.5 m -94.16 148.6 35.42 Favored Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -71.42 172.26 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.082 0 CA-C-N 119.904 1.002 . . . . 0.0 110.5 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -112.84 41.6 0.23 Allowed Pre-proline 0 CA--C 1.556 1.18 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.51 -48.81 2.88 Favored 'Trans proline' 0 C--N 1.354 0.836 0 CA-C-N 122.417 1.899 . . . . 0.0 111.502 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.2 -36.13 80.98 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.016 0.826 . . . . 0.0 109.567 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.25 -46.65 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.068 0 C-N-CA 123.809 0.844 . . . . 0.0 110.23 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 100.0 m-20 -62.12 -50.07 73.36 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.015 0.526 . . . . 0.0 110.31 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.3 t -62.37 -46.38 88.89 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.008 0.523 . . . . 0.0 111.176 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -61.32 -49.61 76.29 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.535 1.134 . . . . 0.0 109.006 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -56.55 -47.72 78.83 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 118.503 -0.76 . . . . 0.0 108.968 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -58.7 -54.48 46.6 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.039 0.836 . . . . 0.0 111.207 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -34.4 75.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.7 0.682 . . . . 0.0 112.4 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -74.56 -33.9 62.8 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.148 0.579 . . . . 0.0 110.069 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -61.76 -38.62 88.66 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.151 -1.593 . . . . 0.0 107.55 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.16 -13.4 60.15 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.112 0.565 . . . . 0.0 112.059 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -69.52 -41.47 75.98 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -68.15 174.95 3.48 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.361 1.464 . . . . 0.0 111.508 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 . . . . . 0 C--O 1.242 0.71 0 C-N-CA 126.979 2.112 . . . . 0.0 107.101 179.433 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -104.27 -27.17 12.17 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.539 -0.726 . . . . 0.0 112.425 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 38.9 t70 -82.67 39.36 0.61 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.495 1.518 . . . . 0.0 109.779 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.64 139.86 58.45 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 120.576 -1.328 . . . . 0.0 107.758 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 68.8 tp -86.57 124.23 32.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.87 169.1 10.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -137.97 152.24 48.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -119.43 99.84 49.91 Favored Pre-proline 0 C--O 1.235 0.311 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -80.04 108.15 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.821 3.014 . . . . 0.0 109.582 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.3 t -142.17 147.42 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 O-C-N 121.027 -1.046 . . . . 0.0 110.365 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -126.25 101.97 6.98 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.56 120.82 0.91 Allowed Glycine 0 N--CA 1.459 0.218 0 CA-C-O 116.035 -2.536 . . . . 0.0 108.578 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -66.73 -51.77 52.07 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 122.411 3.106 . . . . 0.0 110.395 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -67.9 -38.12 82.59 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.31 99.11 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.274 0.63 . . . . 0.0 110.691 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 20.9 t80 -68.9 -38.93 79.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 119.742 1.155 . . . . 0.0 108.921 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -60.51 -54.4 45.9 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.353 -0.832 . . . . 0.0 111.497 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 3.8 ptp -61.59 -33.04 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.619 0.645 . . . . 0.0 111.132 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.21 -46.83 66.47 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -43.2 98.31 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 119.467 1.03 . . . . 0.0 109.741 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.74 -48.88 74.47 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.194 0.998 . . . . 0.0 110.624 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 8.6 mt -79.76 -31.53 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.508 0.723 . . . . 0.0 111.837 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -65.86 -56.69 10.55 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.14 -49.27 76.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.896 1.678 . . . . 0.0 113.055 -178.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 13.7 p -61.88 -50.19 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.688 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -65.77 -40.33 91.9 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.035 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.02 -54.53 41.88 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -47.56 78.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 117.916 0.326 . . . . 0.0 111.21 -179.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -54.76 -33.35 61.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.705 1.202 . . . . 0.0 111.297 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 -22.92 18.72 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.073 1.349 . . . . 0.0 111.354 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.48 -34.63 31.24 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.339 1.427 . . . . 0.0 109.752 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 22.6 tp -129.29 78.65 75.56 Favored Pre-proline 0 C--O 1.237 0.423 0 C-N-CA 126.433 1.893 . . . . 0.0 107.592 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.5 66.05 6.46 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.191 3.261 . . . . 0.0 109.443 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -56.14 152.16 11.15 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.549 1.54 . . . . 0.0 110.858 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 84.2 m-70 -51.28 -32.68 25.64 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.386 1.475 . . . . 0.0 112.464 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 7.3 m -61.75 -51.55 67.88 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.976 0.91 . . . . 0.0 109.002 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.98 -40.45 85.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 125.787 1.635 . . . . 0.0 109.116 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -65.21 -58.04 7.0 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.434 1.494 . . . . 0.0 112.625 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 26.3 p -59.2 -43.55 92.23 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.73 0.812 . . . . 0.0 110.744 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 6.5 t80 -59.72 -39.62 85.28 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.934 0.494 . . . . 0.0 109.789 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -62.86 -48.81 77.43 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 118.99 0.814 . . . . 0.0 109.653 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -57.83 -56.37 22.86 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.268 0.627 . . . . 0.0 111.009 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -60.47 -45.1 94.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.895 -1.05 . . . . 0.0 111.428 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.89 -33.77 76.44 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.258 0.935 . . . . 0.0 113.297 -178.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -69.33 -50.36 47.26 Favored 'General case' 0 N--CA 1.461 0.084 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -58.83 -35.1 72.35 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.054 0.942 . . . . 0.0 110.752 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 25.1 tt0 -57.45 -29.6 64.33 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.875 1.27 . . . . 0.0 110.381 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -64.22 -30.05 71.13 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.506 0.594 . . . . 0.0 111.09 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -66.64 -42.41 86.74 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 120.803 -1.185 . . . . 0.0 109.886 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 13.2 m170 -77.75 -3.46 41.39 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.795 0.838 . . . . 0.0 111.674 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.17 -20.21 64.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.399 1.079 . . . . 0.0 110.885 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 6.3 mp -66.18 -24.9 66.72 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.974 -1.079 . . . . 0.0 109.232 178.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -91.58 172.21 8.65 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.084 1.353 . . . . 0.0 110.794 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -51.9 142.24 15.89 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.054 1.342 . . . . 0.0 111.046 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -140.35 103.5 4.58 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.72 114.84 7.88 Favored 'General case' 0 C--O 1.241 0.652 0 O-C-N 121.718 -0.614 . . . . 0.0 109.552 -178.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 15.7 m -67.92 106.12 2.21 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.276 1.03 . . . . 0.0 109.472 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 20.1 tt -163.05 140.11 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 104.613 -2.366 . . . . 0.0 104.613 178.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -145.94 158.4 43.87 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.058 1.343 . . . . 0.0 108.586 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.255 1.381 0 C-N-CA 124.268 1.027 . . . . 0.0 109.053 179.425 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.601 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 2.0 m -131.98 -81.92 0.5 Allowed 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.595 -1.631 . . . . 0.0 106.595 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 31.1 t0 -169.48 39.27 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.968 2.107 . . . . 0.0 107.245 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -126.49 26.14 6.39 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.932 1.293 . . . . 0.0 109.456 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.86 -80.89 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 125.393 1.477 . . . . 0.0 111.572 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 84.2 m -160.69 139.14 10.02 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 128.007 2.523 . . . . 0.0 106.385 177.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -113.24 130.16 56.31 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -105.69 140.03 39.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.942 2.897 . . . . 0.0 110.141 -177.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 77.5 mt -137.66 144.93 42.09 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.326 -0.859 . . . . 0.0 111.006 -178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.84 101.39 3.94 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.03 1.732 . . . . 0.0 110.377 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D 1103 ' ' VAL . . . . . 0.424 ' CB ' ' HE3' ' B' ' 116' ' ' LYS . 63.9 t -151.25 152.01 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 120.585 -1.322 . . . . 0.0 109.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -115.79 101.47 8.84 Favored 'General case' 0 C--N 1.347 0.497 0 CA-C-N 120.486 1.494 . . . . 0.0 113.547 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.84 118.38 1.24 Allowed Glycine 0 CA--C 1.522 0.494 0 N-CA-C 107.717 -2.153 . . . . 0.0 107.717 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -66.73 -56.65 9.56 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 121.307 2.554 . . . . 0.0 111.014 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -63.38 -45.92 88.87 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.048 0.928 . . . . 0.0 109.328 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -57.99 -51.27 70.34 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 117.205 -1.378 . . . . 0.0 111.763 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.55 -44.97 95.54 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.498 1.499 . . . . 0.0 111.149 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -50.73 -54.1 26.03 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.807 0.843 . . . . 0.0 110.509 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.6 mt -65.88 -52.34 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.822 1.249 . . . . 0.0 110.383 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 18.2 mt -51.73 -52.26 49.92 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.566 1.147 . . . . 0.0 111.974 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 24.0 ttt -64.7 -44.26 90.84 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.25 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1114 ' ' LYS . . . . . 0.422 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 24.7 ttpt -54.99 -52.18 63.93 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.93 -45.8 76.76 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.576 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.6 tptt -53.76 -59.75 4.21 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 118.949 0.795 . . . . 0.0 111.755 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -30.31 71.18 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 18.4 t -60.86 -39.04 87.66 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 120.324 1.42 . . . . 0.0 109.7 178.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.07 -38.6 63.88 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.275 0.489 . . . . 0.0 110.093 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.73 -43.29 96.94 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.93 -48.85 70.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.6 tmt? -59.56 -22.49 61.79 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.752 0.821 . . . . 0.0 110.861 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.71 -46.8 35.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 65.1 tp -71.99 -33.11 67.84 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.864 0.866 . . . . 0.0 113.334 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 23.1 m -92.25 147.5 34.71 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 120.101 1.319 . . . . 0.0 110.4 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -71.45 174.86 10.25 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 N-CA-C 108.398 -1.424 . . . . 0.0 108.398 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -122.74 44.3 0.87 Allowed Pre-proline 0 CA--C 1.555 1.136 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -61.91 -48.72 8.03 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.158 2.572 . . . . 0.0 113.273 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 49.7 tp -65.64 -26.41 67.79 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.453 -0.779 . . . . 0.0 109.689 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 39.7 t -67.27 -46.56 83.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.237 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -56.84 -43.81 81.5 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -64.6 -48.47 74.82 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.137 0.575 . . . . 0.0 109.975 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.36 -41.85 94.54 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.205 1.002 . . . . 0.0 110.166 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.07 -48.44 80.12 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.66 -49.82 69.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 117.893 -1.051 . . . . 0.0 111.89 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -42.46 95.67 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.118 1.326 . . . . 0.0 111.384 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -71.01 -37.55 72.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.157 0.435 . . . . 0.0 111.12 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -65.82 -39.75 91.17 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 119.028 0.831 . . . . 0.0 109.659 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 43.4 mt -66.81 -26.13 66.79 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.887 0.767 . . . . 0.0 110.003 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tm? -77.21 -40.31 45.51 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.295 1.038 . . . . 0.0 108.677 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.24 138.0 56.66 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.672 1.989 . . . . 0.0 109.956 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 . . . . . 0 C--O 1.252 1.188 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 179.391 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.469 ' C ' ' H ' ' A' ' 3' ' ' ASP . 69.8 m . . . . . 0 N--CA 1.465 0.282 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -67.26 14.92 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 128.227 2.611 . . . . 0.0 112.09 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 1' ' ' SER . 7.2 p-10 -86.41 12.59 9.86 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 128.375 2.67 . . . . 0.0 110.535 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.67 110.24 15.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.87 104.71 1.14 Allowed 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -92.2 169.25 10.75 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -123.93 127.92 48.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 13.5 tp -115.67 93.98 38.98 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 126.022 1.729 . . . . 0.0 107.353 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -77.8 119.92 4.94 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.062 2.508 . . . . 0.0 112.988 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -145.62 155.59 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.04 1.336 . . . . 0.0 108.775 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.0 101.4 4.71 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.2 0.6 . . . . 0.0 111.102 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.48 115.93 0.65 Allowed Glycine 0 CA--C 1.526 0.732 0 C-N-CA 126.805 2.145 . . . . 0.0 107.758 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.07 -51.98 65.92 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.6 2.7 . . . . 0.0 112.286 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -73.42 -32.38 64.38 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 123.27 0.628 . . . . 0.0 110.737 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -61.05 -43.4 98.94 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.123 1.369 . . . . 0.0 108.627 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -67.51 -54.43 20.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -54.64 -54.93 35.12 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.471 0.708 . . . . 0.0 112.909 -178.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 40.0 ttm -53.42 -54.02 42.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.983 0.913 . . . . 0.0 110.349 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.94 -28.73 67.73 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-O 118.014 -0.993 . . . . 0.0 112.911 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.22 -55.8 10.98 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.61 -40.49 72.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.031 0.932 . . . . 0.0 110.349 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.2 mt -67.9 -51.07 53.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.63 -0.7 . . . . 0.0 110.337 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -32.82 74.49 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.108 1.322 . . . . 0.0 110.721 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -66.16 -55.17 17.71 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.031 1.332 . . . . 0.0 110.395 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 p -54.38 -40.63 68.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 117.9 0.318 . . . . 0.0 110.326 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 tt -68.5 -55.43 11.77 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.734 1.214 . . . . 0.0 110.513 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -53.36 -52.78 58.16 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.244 1.817 . . . . 0.0 111.869 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.8 -46.22 90.46 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.993 -1.003 . . . . 0.0 109.641 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.54 -43.03 97.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 119.079 0.854 . . . . 0.0 109.281 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -71.69 -13.17 61.66 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -102.77 -28.96 11.78 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.299 0.954 . . . . 0.0 113.526 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.6 tp -110.81 115.03 53.88 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 125.206 1.402 . . . . 0.0 109.848 -178.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -60.98 -37.43 76.74 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.152 1.901 . . . . 0.0 112.428 -179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 47.54 115.06 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 129.727 3.211 . . . . 0.0 114.749 179.421 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -52.53 -31.08 33.79 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.868 0.867 . . . . 0.0 112.501 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.8 m -67.83 -46.09 72.82 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.777 0.831 . . . . 0.0 108.942 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -65.28 -34.39 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -58.27 8.13 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.0 m -68.29 -49.43 60.5 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -52.2 -51.93 55.19 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 123.924 0.89 . . . . 0.0 111.256 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -69.05 -46.1 68.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.937 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -58.45 -52.99 63.29 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.986 0.514 . . . . 0.0 110.629 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -62.75 -41.18 99.08 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.676 -0.678 . . . . 0.0 109.372 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.78 -39.38 84.69 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.383 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.73 -52.15 61.76 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.187 1.358 . . . . 0.0 108.348 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.2 tm0? -57.69 -39.18 76.56 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.687 1.195 . . . . 0.0 111.712 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -78.6 -34.15 46.95 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.975 0.91 . . . . 0.0 110.291 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -58.74 -21.16 54.71 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.136 -0.978 . . . . 0.0 110.657 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.42 -45.61 76.74 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.704 1.602 . . . . 0.0 108.253 178.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -92.57 -38.41 11.92 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.238 1.015 . . . . 0.0 111.486 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.6 tp -57.54 -32.57 67.22 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.229 1.012 . . . . 0.0 113.639 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 69.0 mt -93.1 -0.8 56.93 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 122.853 0.461 . . . . 0.0 111.029 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 42.62 -134.6 0.41 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 127.34 2.256 . . . . 0.0 108.972 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.55 65.29 1.48 Allowed 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 103.622 -2.733 . . . . 0.0 103.622 178.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -137.6 -0.72 2.13 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -178.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t -139.8 147.58 40.98 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 120.924 1.693 . . . . 0.0 111.011 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.3 m -83.35 79.27 9.46 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 126.547 1.939 . . . . 0.0 110.767 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.6 pt -64.3 158.87 3.9 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.629 0.728 . . . . 0.0 111.407 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -65.82 158.7 27.08 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.665 1.586 . . . . 0.0 110.186 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.23 0 C-N-CA 124.65 1.18 . . . . 0.0 107.899 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.54 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 72.7 m -159.13 70.31 0.48 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 104.444 -2.428 . . . . 0.0 104.444 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -118.18 -74.26 0.61 Allowed 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 123.771 0.828 . . . . 0.0 110.344 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -66.83 -35.76 80.78 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.317 0.962 . . . . 0.0 111.486 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.31 -17.54 61.3 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.533 0.733 . . . . 0.0 111.167 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 53.1 m -75.29 150.52 38.49 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . 0.459 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 86.9 m-85 -101.7 128.23 48.1 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.108 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -105.98 161.98 14.0 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 126.026 1.73 . . . . 0.0 109.317 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 93.7 mt -151.0 142.98 23.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 127.441 2.296 . . . . 0.0 106.285 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -144.39 98.87 3.28 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.251 1.42 . . . . 0.0 108.37 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 m -153.63 150.32 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 123.485 0.714 . . . . 0.0 111.682 -177.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -117.54 102.48 9.22 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.043 1.292 . . . . 0.0 114.201 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.31 129.28 3.82 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 106.781 -2.528 . . . . 0.0 106.781 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -66.73 -57.51 6.97 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.202 2.001 . . . . 0.0 110.88 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -70.35 -37.87 74.7 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -54.6 -41.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.233 0.613 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -75.12 -42.68 55.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.257 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -54.15 -54.93 32.88 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.853 1.66 . . . . 0.0 110.273 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.02 -54.92 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.466 1.506 . . . . 0.0 110.423 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -32.18 73.74 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-O 116.711 -1.614 . . . . 0.0 112.89 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 21.3 mtp -68.78 -53.24 22.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 121.019 1.736 . . . . 0.0 107.547 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -52.07 -48.55 64.6 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.297 1.039 . . . . 0.0 109.836 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 50.9 mt -67.46 -54.99 15.47 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.6 -0.715 . . . . 0.0 112.138 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -54.45 -37.85 65.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 120.095 1.316 . . . . 0.0 110.797 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.04 -57.59 8.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.731 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 73.0 m -55.54 -34.12 64.41 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.11 -0.947 . . . . 0.0 111.432 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.45 -40.24 67.17 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.713 1.205 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.77 -47.09 85.01 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.44 1.018 . . . . 0.0 108.478 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 75.5 mt -60.64 -47.3 86.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -26.77 68.02 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.263 1.025 . . . . 0.0 111.807 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -79.64 -54.79 5.54 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.808 0.843 . . . . 0.0 111.868 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -69.6 -32.72 71.61 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.86 148.27 34.49 Favored Pre-proline 0 CA--C 1.534 0.327 0 C-N-CA 125.105 1.362 . . . . 0.0 108.756 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -70.98 169.42 20.52 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 121.077 1.185 . . . . 0.0 109.576 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -115.7 58.88 1.46 Allowed Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.436 1.094 . . . . 0.0 113.207 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.07 -63.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 123.558 2.838 . . . . 0.0 115.645 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.31 -33.33 75.57 Favored 'General case' 0 CA--C 1.513 -0.477 0 O-C-N 121.162 -0.961 . . . . 0.0 108.934 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 15.1 t -50.27 -53.33 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 C-N-CA 125.173 1.389 . . . . 0.0 108.401 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -66.39 -51.4 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.8 m -59.16 -41.13 87.66 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.97 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -67.98 -52.77 32.07 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.019 1.328 . . . . 0.0 110.365 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -59.69 -39.78 85.67 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.401 -1.285 . . . . 0.0 110.129 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -64.28 -55.6 20.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.911 1.232 . . . . 0.0 110.058 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -56.42 -42.48 78.12 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.356 -0.84 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -67.83 -40.72 83.74 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.993 0.917 . . . . 0.0 110.828 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -61.23 -34.32 74.93 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 125.26 1.424 . . . . 0.0 110.567 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -57.73 -14.36 5.6 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.388 0.994 . . . . 0.0 113.128 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 tt -72.2 -20.54 61.56 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.814 1.188 . . . . 0.0 109.693 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -141.04 99.75 3.66 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 125.81 1.644 . . . . 0.0 108.976 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.811 0 C-N-CA 123.881 0.872 . . . . 0.0 108.683 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1001 ' ' SER . . . . . 0.438 ' C ' ' H ' ' C' 1003 ' ' ASP . 37.3 m . . . . . 0 N--CA 1.463 0.192 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -78.0 32.49 0.18 Allowed 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 121.001 1.728 . . . . 0.0 112.176 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1003 ' ' ASP . . . . . 0.438 ' H ' ' C ' ' C' 1001 ' ' SER . 2.6 p30 -90.43 12.0 19.86 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 129.106 2.962 . . . . 0.0 110.594 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -65.05 106.0 1.17 Allowed 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 1.9 tt -69.19 95.9 0.79 Allowed 'General case' 0 C--O 1.236 0.378 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.7 mt -90.28 168.77 11.66 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.784 1.633 . . . . 0.0 107.506 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -126.44 135.23 51.12 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 28.4 tp -111.72 91.97 16.11 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.8 106.65 2.24 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.261 2.641 . . . . 0.0 109.471 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 58.9 t -144.91 153.69 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 119.977 1.262 . . . . 0.0 110.769 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -128.52 102.97 6.85 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.3 110.59 0.39 Allowed Glycine 0 CA--C 1.522 0.469 0 CA-C-O 115.646 -2.752 . . . . 0.0 108.878 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -62.06 -53.15 59.53 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 123.099 3.449 . . . . 0.0 111.962 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 16.7 m -67.92 -45.48 74.26 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.28 -0.887 . . . . 0.0 109.469 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.54 -52.39 61.33 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 124.051 0.94 . . . . 0.0 108.614 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -54.47 -51.39 65.17 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.141 0.976 . . . . 0.0 110.69 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 52.1 ttm -61.49 -53.84 51.1 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.654 0.781 . . . . 0.0 111.377 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.3 -36.54 84.38 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.94 -55.8 15.0 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -57.69 -39.31 76.88 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.513 0.725 . . . . 0.0 111.687 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 22.6 mt -65.15 -52.25 55.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 118.483 -0.77 . . . . 0.0 109.865 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -34.61 75.66 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 118.375 -1.33 . . . . 0.0 110.794 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -61.66 -55.35 31.48 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 110.049 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.2 p -55.32 -49.09 73.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 118.094 0.407 . . . . 0.0 110.911 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.3 tt -62.24 -54.3 42.8 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.843 0.857 . . . . 0.0 111.164 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -53.95 -50.97 65.3 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.613 1.165 . . . . 0.0 110.152 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.35 -48.83 76.33 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 123.774 0.829 . . . . 0.0 110.005 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 2.2 tmt? -58.87 -22.65 59.66 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.45 1.1 . . . . 0.0 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -100.98 -12.77 18.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.058 1.743 . . . . 0.0 112.012 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.3 t80 -101.72 -13.41 17.76 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.003 1.321 . . . . 0.0 110.581 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 41.7 tp -130.91 103.16 15.81 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 126.838 2.055 . . . . 0.0 108.633 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -76.84 40.05 0.77 Allowed 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 124.485 3.457 . . . . 0.0 111.092 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -25.36 123.51 0.06 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 131.31 3.844 . . . . 0.0 113.112 -178.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 7.2 m170 -48.44 -46.53 37.8 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 124.7 1.2 . . . . 0.0 112.855 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 13.3 m -58.78 -51.24 70.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.716 0.807 . . . . 0.0 109.829 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.5 mt -57.03 -46.04 84.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.981 1.712 . . . . 0.0 110.206 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.4 -52.11 66.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 122.872 0.469 . . . . 0.0 111.619 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 27.7 m -63.26 -39.53 94.85 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.706 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 24.7 t80 -57.7 -52.97 63.25 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 178.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 48.0 ttt-85 -63.77 -31.81 73.11 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.665 0.666 . . . . 0.0 111.859 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -57.85 11.07 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C 1043 ' ' GLN . . . . . 0.511 HE21 ' NE2' ' C' 1047 ' ' GLN . 54.8 tt0 -67.98 -37.87 82.01 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.668 1.187 . . . . 0.0 111.633 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -60.24 -47.39 86.17 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.586 -1.197 . . . . 0.0 109.834 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -64.64 -40.43 95.44 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.196 1.362 . . . . 0.0 110.012 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -59.05 -54.1 50.92 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1047 ' ' GLN . . . . . 0.511 ' NE2' HE21 ' C' 1043 ' ' GLN . 74.9 mt-30 -68.79 -29.75 68.18 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.464 -0.773 . . . . 0.0 111.958 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.81 -24.05 61.33 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 120.844 -1.16 . . . . 0.0 111.058 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -42.71 82.13 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 30.4 p80 -92.4 -34.0 14.32 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 118.459 -0.782 . . . . 0.0 111.014 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 24.5 tp -59.2 -47.13 86.45 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.588 1.085 . . . . 0.0 111.282 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 85.0 mt -79.06 -37.4 39.02 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 3.3 tt0 53.6 -175.52 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.717 2.007 . . . . 0.0 111.794 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -87.55 99.91 12.39 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 104.186 -2.524 . . . . 0.0 104.186 178.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 16.0 pt20 177.66 -2.22 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 127.832 2.453 . . . . 0.0 112.148 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 10.1 t -142.84 145.91 33.63 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 50.3 m -78.16 127.03 31.66 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.669 0.788 . . . . 0.0 109.532 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 13.1 pt -106.3 152.83 7.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 C-N-CA 124.736 1.215 . . . . 0.0 107.927 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -68.59 158.53 33.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 C--O 1.249 1.034 0 O-C-N 121.231 -0.918 . . . . 0.0 110.708 179.619 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 15.0 m -150.28 95.75 2.31 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 19.6 t70 -142.45 -51.0 0.38 Allowed 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 118.733 0.697 . . . . 0.0 111.807 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1096 ' ' GLU . . . . . 0.409 ' H ' ' CD ' ' D' 1096 ' ' GLU . 2.2 mp0 -58.5 -38.1 76.96 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 122.802 0.441 . . . . 0.0 111.385 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -86.75 -6.49 58.81 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 122.944 0.497 . . . . 0.0 111.464 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.2 m -74.3 152.42 39.65 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 105.087 -2.19 . . . . 0.0 105.087 178.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -101.9 130.18 48.32 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.194 -0.942 . . . . 0.0 110.173 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -115.61 150.0 37.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.55 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 70.9 mt -142.53 142.27 32.19 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.82 98.56 3.07 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.281 1.033 . . . . 0.0 108.354 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.39 146.52 18.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 124.958 1.303 . . . . 0.0 110.81 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.88 100.62 9.97 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.662 1.119 . . . . 0.0 113.284 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.09 108.15 0.5 Allowed Glycine 0 C--O 1.226 -0.371 0 N-CA-C 106.385 -2.686 . . . . 0.0 106.385 177.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -51.08 -57.11 9.52 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 122.005 2.903 . . . . 0.0 113.728 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -67.84 -44.25 77.6 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.344 -0.848 . . . . 0.0 110.467 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 3.3 m120 -58.6 -30.05 66.92 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.296 1.439 . . . . 0.0 110.645 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1109 ' ' PHE . . . . . 0.459 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 45.7 t80 -74.82 -55.33 5.93 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 177.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.36 -53.93 38.27 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.497 1.044 . . . . 0.0 113.399 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -60.03 -54.47 34.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 C-N-CA 125.035 1.334 . . . . 0.0 109.119 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -35.8 81.68 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 117.442 -1.266 . . . . 0.0 110.877 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.96 -52.45 62.98 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 119.843 1.202 . . . . 0.0 108.282 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 58.0 tttp -54.96 -46.96 75.1 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.69 0.796 . . . . 0.0 109.81 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 33.0 mt -66.86 -52.0 48.85 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 117.907 0.321 . . . . 0.0 110.649 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -55.03 -44.65 74.82 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.399 1.079 . . . . 0.0 111.438 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.62 -57.5 11.78 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.152 1.781 . . . . 0.0 106.983 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.6 m -53.2 -43.72 67.39 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.506 0.722 . . . . 0.0 112.008 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.82 -31.08 64.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.348 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -65.16 -44.86 87.19 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.504 1.502 . . . . 0.0 107.468 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.74 -43.14 89.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.053 1.341 . . . . 0.0 107.783 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.21 -36.46 79.96 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.019 0.827 . . . . 0.0 110.752 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -45.37 52.79 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.807 0.843 . . . . 0.0 112.288 -179.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -78.42 -32.83 48.85 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -94.31 146.12 30.97 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -67.0 173.97 7.54 Favored 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 122.912 2.408 . . . . 0.0 112.799 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.23 50.85 0.67 Allowed Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 125.059 1.344 . . . . 0.0 113.858 -179.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.09 -69.73 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.213 1.942 . . . . 0.0 112.245 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.87 -32.64 73.01 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.253 0.933 . . . . 0.0 110.007 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.0 t -53.99 -50.47 53.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 124.537 1.135 . . . . 0.0 110.074 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.89 -51.25 50.22 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.482 0.583 . . . . 0.0 111.253 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 49.5 m -54.59 -42.36 70.98 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.032 0.378 . . . . 0.0 110.841 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.03 -52.57 40.72 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 117.29 -1.338 . . . . 0.0 110.282 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.86 -43.4 94.7 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 120.121 1.328 . . . . 0.0 111.331 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -62.39 -54.96 32.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 118.875 0.761 . . . . 0.0 109.841 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -61.52 -27.89 68.93 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.8 tm0? -80.51 -49.71 11.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -55.37 -33.2 63.23 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.801 1.64 . . . . 0.0 109.971 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 9.6 mt -57.12 -13.97 3.49 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.038 0.935 . . . . 0.0 113.442 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.3 tt -75.02 -23.38 58.19 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.468 1.031 . . . . 0.0 110.731 178.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -140.86 100.01 3.74 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 126.364 1.866 . . . . 0.0 110.102 -178.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.952 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.9 p . . . . . 0 N--CA 1.463 0.216 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -104.38 3.77 32.7 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.964 0.905 . . . . 0.0 113.13 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -70.63 14.84 0.12 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.841 1.256 . . . . 0.0 114.078 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -53.97 107.28 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tp -62.85 94.57 0.07 Allowed 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.674 1.19 . . . . 0.0 113.123 -177.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.01 156.2 18.12 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -130.14 142.69 50.56 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.766 1.626 . . . . 0.0 106.738 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 tp -132.12 110.47 14.14 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 119.596 1.089 . . . . 0.0 111.885 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -88.18 113.31 0.78 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.766 3.644 . . . . 0.0 111.07 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.2 t -140.83 148.45 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 119.788 -1.82 . . . . 0.0 107.965 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.58 102.8 5.23 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.466 -0.771 . . . . 0.0 109.924 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.26 118.12 0.79 Allowed Glycine 0 CA--C 1.521 0.424 0 N-CA-C 104.325 -3.51 . . . . 0.0 104.325 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.98 -51.46 64.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.965 1.883 . . . . 0.0 109.878 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.51 -45.74 82.38 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.842 0.857 . . . . 0.0 109.449 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.7 m -55.31 -51.81 65.51 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.794 1.638 . . . . 0.0 110.488 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -62.0 -42.56 99.28 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.424 -0.798 . . . . 0.0 110.278 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -60.46 -42.96 97.26 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.118 1.326 . . . . 0.0 111.697 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.5 ttm -69.98 -53.83 15.96 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.038 0.535 . . . . 0.0 110.911 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.18 -47.02 82.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.654 1.581 . . . . 0.0 111.422 -178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.69 -49.09 78.93 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -57.81 -47.65 81.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.948 0.794 . . . . 0.0 111.814 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.12 -42.12 93.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 123.419 0.688 . . . . 0.0 109.249 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -63.38 -52.41 61.76 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 123.854 0.862 . . . . 0.0 108.756 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.35 -54.69 40.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.929 2.092 . . . . 0.0 110.949 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -53.82 -51.1 64.6 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.908 0.776 . . . . 0.0 109.721 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.14 -48.71 78.88 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -178.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -59.69 -51.83 68.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.145 1.378 . . . . 0.0 111.564 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.05 -42.48 94.23 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.072 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -37.18 67.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -89.66 -17.13 28.97 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.222 1.374 . . . . 0.0 112.91 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -87.56 -57.9 2.78 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 121.149 -0.969 . . . . 0.0 113.234 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.68 155.04 92.3 Favored Pre-proline 0 CA--C 1.54 0.579 0 O-C-N 121.919 -0.488 . . . . 0.0 110.826 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -60.14 112.54 1.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.83 2.353 . . . . 0.0 111.717 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -69.14 21.76 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.538 1.935 . . . . 0.0 114.376 -179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -47.23 -47.24 24.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 121.894 2.134 . . . . 0.0 114.681 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.2 m -66.72 -51.26 57.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.373 -0.83 . . . . 0.0 109.753 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.0 mt -58.3 -43.89 87.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 125.442 1.497 . . . . 0.0 110.939 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -55.95 -58.96 5.69 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.379 1.872 . . . . 0.0 109.677 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.9 m -62.73 -42.19 99.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.153 0.908 . . . . 0.0 110.071 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -55.3 -54.44 43.56 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.408 1.004 . . . . 0.0 111.223 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 43.3 ttt-85 -75.3 -29.87 60.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.308 -0.87 . . . . 0.0 112.209 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.73 -49.98 47.98 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.096 -1.002 . . . . 0.0 109.008 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -62.28 -44.14 97.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.658 1.183 . . . . 0.0 109.17 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -56.41 -51.9 66.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.369 0.986 . . . . 0.0 110.233 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -62.09 -34.97 77.32 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.984 -0.447 . . . . 0.0 111.241 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -69.43 -43.43 73.38 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.859 0.864 . . . . 0.0 110.4 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -57.36 -38.55 74.35 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.553 1.941 . . . . 0.0 110.763 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.59 -21.98 66.03 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.43 0.559 . . . . 0.0 111.793 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -70.07 -33.24 71.67 Favored 'General case' 0 C--O 1.226 -0.146 0 O-C-N 120.607 -1.308 . . . . 0.0 110.724 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -61.2 -32.75 72.51 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 117.919 0.327 . . . . 0.0 110.491 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.83 -20.82 66.01 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.24 0.616 . . . . 0.0 110.619 178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -100.47 -12.49 19.3 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.455 1.902 . . . . 0.0 110.955 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 35.32 65.18 0.41 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 129.261 3.025 . . . . 0.0 111.566 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -95.05 -20.4 19.35 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.887 1.275 . . . . 0.0 111.904 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -139.38 155.03 47.92 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.895 1.278 . . . . 0.0 108.45 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -115.83 139.92 49.72 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 125.68 1.592 . . . . 0.0 108.875 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.5 p -70.86 148.65 47.58 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 178.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.3 pt -147.78 179.41 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 127.441 2.296 . . . . 0.0 106.869 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -72.32 158.7 35.32 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.3 p . . . . . 0 C--O 1.256 1.401 0 CA-C-O 114.368 -2.729 . . . . 0.0 104.127 179.201 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.538 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 47.9 t -166.35 -179.13 4.84 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 127.062 2.145 . . . . 0.0 105.456 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -149.04 -19.06 0.3 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 124.004 0.922 . . . . 0.0 111.712 178.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -65.7 -39.22 91.01 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.685 0.675 . . . . 0.0 109.419 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -131.52 92.08 3.11 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.071 0.948 . . . . 0.0 110.589 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 92.3 m -120.99 164.05 17.33 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 125.749 1.62 . . . . 0.0 106.914 178.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . 0.426 ' HB3' ' CE2' ' D' 1109 ' ' PHE . 97.1 m-85 -118.59 131.32 56.2 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -113.1 158.19 20.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.383 1.473 . . . . 0.0 110.396 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 81.3 mt -144.06 135.82 26.12 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.42 98.87 4.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.515 1.526 . . . . 0.0 107.072 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 43.4 t -149.53 141.59 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.338 0.972 . . . . 0.0 109.627 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -92.83 103.98 16.27 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.22 108.44 0.49 Allowed Glycine 0 N--CA 1.465 0.627 0 CA-C-O 114.937 -3.146 . . . . 0.0 112.729 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -67.61 -58.21 5.08 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 123.55 3.675 . . . . 0.0 112.455 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -66.82 -43.08 84.71 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.294 -0.879 . . . . 0.0 110.012 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -57.63 -47.29 82.62 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.346 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -63.39 -41.73 98.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 120.302 1.41 . . . . 0.0 111.706 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -56.67 -52.39 65.11 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.718 1.144 . . . . 0.0 110.437 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.32 -52.6 53.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 C-N-CA 124.772 1.229 . . . . 0.0 110.788 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.413 ' CD1' ' HZ2' ' D' 1116 ' ' LYS . 64.1 mt -61.94 -29.44 70.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 117.564 -1.208 . . . . 0.0 111.77 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 mtp -69.68 -52.33 26.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.69 1.586 . . . . 0.0 107.524 178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -51.7 -51.82 53.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.223 0.952 . . . . 0.0 108.706 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 65.0 mt -68.99 -35.87 77.19 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -61.51 -52.13 65.74 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 120.371 1.442 . . . . 0.0 107.488 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.13 -38.05 89.38 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 124.235 0.959 . . . . 0.0 109.891 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 5.4 t -52.8 -55.05 25.75 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.144 0.978 . . . . 0.0 110.52 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.47 -33.32 71.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.076 -0.964 . . . . 0.0 112.493 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -44.53 92.0 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.852 1.205 . . . . 0.0 108.409 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 54.9 mt -67.07 -48.23 68.86 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 9.6 tpt -58.67 -26.92 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.173 0.897 . . . . 0.0 110.83 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -79.63 -44.69 20.49 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.261 1.024 . . . . 0.0 111.052 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -79.41 -26.1 41.95 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.047 1.294 . . . . 0.0 114.279 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -94.95 148.52 34.85 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.953 1.701 . . . . 0.0 108.916 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -73.36 179.86 5.1 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.735 2.29 . . . . 0.0 110.746 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 16.6 mp0 -121.2 44.27 0.73 Allowed Pre-proline 0 CA--C 1.563 1.47 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -63.4 -48.67 5.59 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.217 2.611 . . . . 0.0 115.284 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 69.4 tp -62.93 -41.86 99.61 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.551 1.068 . . . . 0.0 108.973 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 1.8 t -51.76 -48.68 37.86 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 C-N-CA 125.452 1.501 . . . . 0.0 109.706 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -61.49 -51.11 70.03 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.684 1.193 . . . . 0.0 111.767 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.5 t -62.79 -50.17 72.07 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.946 -0.471 . . . . 0.0 110.595 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -61.91 -36.12 80.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.597 1.559 . . . . 0.0 110.182 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -59.98 -48.63 80.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.31 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -69.13 -49.8 53.76 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.822 0.737 . . . . 0.0 111.706 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -54.15 -46.05 72.16 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.692 1.197 . . . . 0.0 111.185 -178.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -80.25 -27.67 38.62 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.928 0.891 . . . . 0.0 110.843 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -57.64 -39.66 77.48 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.184 1.357 . . . . 0.0 108.625 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.3 mt -58.66 -17.28 21.1 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.123 0.969 . . . . 0.0 112.459 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.18 -15.78 61.0 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.579 1.081 . . . . 0.0 111.985 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -99.88 170.28 8.63 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.124 -0.985 . . . . 0.0 109.756 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 . . . . . 0 C--O 1.244 0.801 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 179.063 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.423 0 CA-C-O 122.173 0.987 . . . . 0.0 108.864 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.29 -6.65 41.43 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.249 1.02 . . . . 0.0 112.528 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 2.3 t70 -71.35 32.08 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.2 1.8 . . . . 0.0 115.805 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -70.59 106.59 3.54 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.01 95.06 0.11 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.56 1.544 . . . . 0.0 110.352 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.6 mt -94.44 135.73 35.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -104.98 152.65 22.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.28 1.032 . . . . 0.0 109.276 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 55.6 tp -146.68 102.75 3.94 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.999 1.32 . . . . 0.0 109.808 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -84.25 129.64 4.51 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.291 2.661 . . . . 0.0 110.979 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.6 t -144.44 150.91 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.816 1.247 . . . . 0.0 107.65 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.66 99.04 3.95 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.771 1.623 . . . . 0.0 109.586 177.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -170.29 137.01 4.23 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 116.773 -2.126 . . . . 0.0 107.875 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -70.62 -52.03 24.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 121.429 2.614 . . . . 0.0 112.076 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.65 -41.41 88.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.893 0.77 . . . . 0.0 110.79 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -51.73 66.95 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 126.006 1.722 . . . . 0.0 108.742 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 36.4 t80 -68.38 -49.6 58.96 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.009 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.41 -56.8 13.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.809 1.244 . . . . 0.0 112.78 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.73 -48.44 81.68 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.236 1.015 . . . . 0.0 110.656 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.88 -39.41 91.83 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 119.09 -0.481 . . . . 0.0 111.058 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.28 -47.4 79.66 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.405 -0.807 . . . . 0.0 109.293 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.51 -49.21 73.19 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.416 0.553 . . . . 0.0 110.88 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 82.4 mt -65.41 -51.24 66.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 123.698 0.799 . . . . 0.0 110.027 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -54.22 -55.55 26.97 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.609 1.164 . . . . 0.0 110.182 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.26 -42.71 95.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.329 -178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 8.3 t -58.09 -51.16 70.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.519 0.6 . . . . 0.0 109.532 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.28 -49.04 71.07 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.13 -53.12 60.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.977 0.911 . . . . 0.0 111.296 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.25 -42.47 93.27 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.015 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 16.0 tmm? -58.12 -47.25 83.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.383 0.673 . . . . 0.0 110.324 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -78.69 -18.97 53.52 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.114 0.87 . . . . 0.0 112.7 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 15.0 t80 -83.63 -53.41 5.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 119.422 1.01 . . . . 0.0 113.178 -177.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.67 157.51 74.43 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.85 90.99 0.72 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 124.445 3.43 . . . . 0.0 110.114 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -80.52 71.59 7.38 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.665 0.745 . . . . 0.0 110.724 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -58.94 -30.37 67.82 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.59 1.156 . . . . 0.0 109.069 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 14.1 m -67.1 -51.64 51.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.813 1.245 . . . . 0.0 109.767 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 69.9 mt -60.2 -41.93 88.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.599 0.76 . . . . 0.0 109.833 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.2 -58.33 8.41 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 87.4 m -66.15 -37.08 84.8 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.354 1.061 . . . . 0.0 112.225 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.89 -54.3 46.71 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.25 1.02 . . . . 0.0 109.162 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 54.7 ttt-85 -73.43 -31.95 64.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.118 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -63.57 -57.22 10.83 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 109.037 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -65.62 -34.37 78.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.15 -0.929 . . . . 0.0 111.335 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -61.26 -54.95 37.54 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.12 1.327 . . . . 0.0 108.73 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -63.72 -33.18 75.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.853 0.461 . . . . 0.0 111.347 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -68.52 -52.72 29.02 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 124.204 1.002 . . . . 0.0 109.74 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -52.78 -34.62 54.18 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.924 1.69 . . . . 0.0 110.965 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.48 -31.12 67.53 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 118.681 0.673 . . . . 0.0 110.721 178.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -69.93 -26.87 64.34 Favored 'General case' 0 C--N 1.342 0.269 0 O-C-N 121.074 -1.016 . . . . 0.0 111.816 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -60.26 -36.52 77.98 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.615 1.098 . . . . 0.0 110.395 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.24 -28.19 67.85 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.417 0.553 . . . . 0.0 110.788 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.24 -5.25 52.8 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.235 1.414 . . . . 0.0 112.499 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 33.38 39.46 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 129.675 3.19 . . . . 0.0 117.116 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 64.1 tttm -63.65 -22.77 67.07 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.154 -1.591 . . . . 0.0 111.573 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -142.71 178.26 7.76 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 125.963 1.705 . . . . 0.0 107.81 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 17.0 p -125.82 177.49 6.26 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.22 2.608 . . . . 0.0 107.498 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.28 138.9 50.92 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 40.5 pt -140.94 -178.51 1.53 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 126.391 1.876 . . . . 0.0 107.815 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -72.05 158.94 35.04 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 37.7 p . . . . . 0 C--O 1.256 1.437 0 CA-C-O 114.591 -2.623 . . . . 0.0 104.011 179.023 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.733 0 N-CA-C 110.736 -0.946 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 64.3 m -117.99 -177.19 3.21 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 125.108 1.363 . . . . 0.0 110.769 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -136.16 7.61 3.15 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -99.8 -47.74 4.95 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 120.417 1.462 . . . . 0.0 107.785 178.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -105.38 116.48 32.03 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 124.347 1.059 . . . . 0.0 109.573 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 3.9 m -146.67 153.76 40.65 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.563 1.145 . . . . 0.0 108.086 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -109.96 142.28 41.56 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -128.31 152.89 47.61 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.144 0.978 . . . . 0.0 111.033 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.3 mt -146.03 138.7 25.59 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.031 1.333 . . . . 0.0 107.538 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.24 105.59 5.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.816 1.247 . . . . 0.0 108.996 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 94.7 t -152.11 150.65 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 125.221 1.408 . . . . 0.0 108.925 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.15 101.78 10.79 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.743 1.156 . . . . 0.0 109.836 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.33 106.64 0.41 Allowed Glycine 0 N--CA 1.461 0.364 0 CA-C-O 114.922 -3.155 . . . . 0.0 107.034 177.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -59.0 -57.6 12.34 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 122.454 3.127 . . . . 0.0 114.92 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -65.02 -47.02 78.95 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.395 0.678 . . . . 0.0 109.897 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -62.11 -41.57 98.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.221 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1109 ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' B' ' 99' ' ' TYR . 80.2 t80 -66.41 -41.48 89.24 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 119.996 1.271 . . . . 0.0 111.188 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.18 -52.79 63.12 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.7 mt -58.07 -53.64 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 C-N-CA 124.417 1.087 . . . . 0.0 109.162 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 39.1 mt -56.36 -34.82 67.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 117.625 -1.179 . . . . 0.0 111.447 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.3 mtp -70.52 -43.85 68.75 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.815 1.643 . . . . 0.0 108.585 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -55.34 -51.37 66.97 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 54.0 mt -70.07 -33.28 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.335 1.054 . . . . 0.0 112.964 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1116 ' ' LYS . . . . . 0.413 ' HZ2' ' CD1' ' B' ' 112' ' ' LEU . 11.0 tppt? -60.45 -60.15 4.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.246 1.385 . . . . 0.0 108.826 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.58 -38.07 89.72 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 117.402 -1.285 . . . . 0.0 109.116 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.4 t -52.41 -50.16 63.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 121.266 1.848 . . . . 0.0 111.757 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.88 -42.12 73.86 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.41 0.55 . . . . 0.0 111.322 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.47 87.7 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.344 0.658 . . . . 0.0 110.271 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.28 -48.42 34.77 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.826 1.65 . . . . 0.0 109.676 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.6 tpt -59.77 -30.54 68.94 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.938 1.245 . . . . 0.0 110.199 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -75.93 -41.63 51.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.325 1.05 . . . . 0.0 110.454 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.48 -32.45 54.31 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.391 0.996 . . . . 0.0 112.199 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -81.87 147.9 59.62 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.63 1.172 . . . . 0.0 108.723 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.24 172.13 13.68 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 N-CA-C 107.582 -1.738 . . . . 0.0 107.582 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -120.85 58.38 6.75 Favored Pre-proline 0 CA--C 1.546 0.812 0 O-C-N 120.676 -1.265 . . . . 0.0 111.43 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -73.29 -59.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.682 2.921 . . . . 0.0 113.749 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.8 -40.9 85.41 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -51.07 -48.03 30.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 0.0 109.53 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 10.8 t70 -65.32 -46.73 79.16 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -49.51 77.57 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.0 t80 -59.38 -44.18 92.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.346 1.458 . . . . 0.0 109.582 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -54.85 -48.82 72.42 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.269 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -68.84 -48.37 63.67 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 119.609 1.095 . . . . 0.0 111.958 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -57.26 -38.42 73.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.811 0.845 . . . . 0.0 110.283 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -81.34 -28.26 34.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.726 1.611 . . . . 0.0 110.963 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -60.36 -37.24 80.09 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.26 -9.92 5.92 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.54 -6.86 58.16 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.647 1.579 . . . . 0.0 109.926 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1141 ' ' GLN . . . . . 0.458 ' HG2' ' H ' ' D' 1142 ' ' ARG . 22.0 tt0 -112.77 176.61 4.94 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.548 1.539 . . . . 0.0 110.732 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D 1142 ' ' ARG . . . . . 0.458 ' H ' ' HG2' ' D' 1141 ' ' GLN . 39.5 mtm180 . . . . . 0 C--O 1.243 0.759 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 N--CA 1.47 0.553 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -76.71 33.27 0.14 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 128.549 2.74 . . . . 0.0 109.923 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -86.36 -10.89 53.48 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 127.65 2.38 . . . . 0.0 114.337 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 42.45 -147.71 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 129.123 2.969 . . . . 0.0 111.556 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 14.4 tp -134.29 108.44 8.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -115.07 168.62 9.76 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 120.226 1.375 . . . . 0.0 110.25 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -145.25 138.18 26.28 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.192 1.397 . . . . 0.0 107.417 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -112.0 97.97 40.38 Favored Pre-proline 0 C--O 1.232 0.165 0 CA-C-O 118.126 -0.94 . . . . 0.0 110.58 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.2 119.76 6.36 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.118 1.878 . . . . 0.0 107.316 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.6 t -143.59 148.57 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.282 1.033 . . . . 0.0 108.77 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.3 100.27 4.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.07 111.27 0.44 Allowed Glycine 0 C--O 1.226 -0.389 0 CA-C-O 116.463 -2.299 . . . . 0.0 108.036 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -59.8 -48.95 79.64 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 122.017 2.908 . . . . 0.0 112.564 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.7 -32.04 67.39 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.056 0.455 . . . . 0.0 109.907 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.6 m -65.26 -45.14 85.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.082 1.353 . . . . 0.0 109.272 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -61.35 -48.59 80.58 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.294 1.837 . . . . 0.0 109.437 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -53.7 -48.2 69.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.437 0.637 . . . . 0.0 110.416 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -67.8 -45.26 75.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.915 -0.491 . . . . 0.0 111.221 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.2 tp -62.65 -47.47 83.59 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 123.566 0.746 . . . . 0.0 112.876 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.44 -47.11 80.29 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.085 0.554 . . . . 0.0 109.987 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.69 -45.92 85.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.625 0.648 . . . . 0.0 111.287 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 65.2 mt -62.36 -52.61 57.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -57.15 -45.74 83.34 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 123.938 0.895 . . . . 0.0 111.47 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -58.9 -51.98 67.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.903 -0.57 . . . . 0.0 110.061 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.0 p -61.15 -40.39 93.67 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -67.25 -55.54 13.57 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.692 0.797 . . . . 0.0 109.481 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -56.94 -40.89 77.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.959 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.27 -47.49 85.77 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 119.903 1.229 . . . . 0.0 111.161 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.7 tmm? -57.69 -27.83 63.26 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.569 0.622 . . . . 0.0 110.164 178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -89.55 -27.11 20.48 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.255 -0.903 . . . . 0.0 110.921 178.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.59 -35.08 46.27 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 120.372 1.442 . . . . 0.0 110.35 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 72.9 mt -114.95 70.69 2.5 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.93 -24.92 45.36 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.7 1.6 . . . . 0.0 112.599 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -115.41 -35.46 4.61 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 117.923 -1.037 . . . . 0.0 112.491 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.45 -46.82 88.67 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.7 m -65.21 -46.83 79.08 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.116 1.325 . . . . 0.0 109.867 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.34 -34.75 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.932 1.293 . . . . 0.0 110.733 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -63.24 -51.49 66.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.32 1.048 . . . . 0.0 108.444 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.05 -37.98 84.55 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.35 0.523 . . . . 0.0 111.999 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -53.18 61.26 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -34.98 77.05 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.586 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -57.87 -57.1 14.26 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -54.64 -41.1 69.67 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.455 1.025 . . . . 0.0 110.102 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -57.99 -54.5 46.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.174 0.59 . . . . 0.0 111.519 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -71.94 -35.83 69.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.507 0.594 . . . . 0.0 111.497 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -59.41 -29.62 67.87 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.98 1.312 . . . . 0.0 111.031 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -57.38 -39.67 76.54 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.361 0.982 . . . . 0.0 109.508 179.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -66.58 -47.36 73.01 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -62.43 -28.9 70.12 Favored 'General case' 0 C--N 1.339 0.117 0 CA-C-O 118.715 -0.659 . . . . 0.0 111.865 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -65.0 -40.46 94.98 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.2 tp -70.37 -49.94 43.93 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.367 1.067 . . . . 0.0 109.6 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mp -58.61 -33.09 69.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.208 0.603 . . . . 0.0 110.5 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 50.09 -134.2 1.52 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.553 1.941 . . . . 0.0 111.099 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -138.19 -8.73 1.53 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -131.43 72.65 1.51 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 120.094 1.316 . . . . 0.0 107.533 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.6 p -132.04 -164.73 1.49 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.851 2.06 . . . . 0.0 107.977 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.0 p -137.75 -166.39 1.95 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.751 1.22 . . . . 0.0 108.301 179.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.3 tt -49.94 118.82 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 124.194 0.998 . . . . 0.0 109.528 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.08 159.33 24.76 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.672 0.789 . . . . 0.0 109.867 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.6 t . . . . . 0 C--O 1.255 1.358 0 C-N-CA 127.895 2.478 . . . . 0.0 105.568 178.603 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.488 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 34.0 m -137.34 166.9 22.71 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 126.209 1.803 . . . . 0.0 107.811 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -119.69 140.01 51.34 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -69.42 -16.76 63.56 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 123.677 0.791 . . . . 0.0 111.732 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -82.77 46.13 1.06 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.316 1.055 . . . . 0.0 111.465 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.96 143.46 57.38 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 105.239 -2.134 . . . . 0.0 105.239 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -100.96 130.11 46.9 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -105.92 129.84 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.938 1.695 . . . . 0.0 107.128 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.08 150.18 48.36 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -146.33 105.65 3.92 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.951 1.3 . . . . 0.0 113.508 -177.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.4 t -150.48 149.76 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.272 1.396 . . . . 0.0 109.401 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.57 99.27 6.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 121.353 1.888 . . . . 0.0 109.241 178.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.16 133.43 5.29 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 108.125 -1.99 . . . . 0.0 108.125 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -67.93 -58.36 4.67 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 119.563 1.681 . . . . 0.0 112.55 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -67.86 -42.48 81.27 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -51.86 -50.37 61.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.973 1.709 . . . . 0.0 111.442 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -69.67 -51.39 35.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 117.774 -1.108 . . . . 0.0 112.0 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.09 -54.45 24.86 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.125 0.97 . . . . 0.0 112.651 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.21 -55.35 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 123.413 0.685 . . . . 0.0 110.804 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 89.6 mt -64.9 -28.49 69.57 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -52.02 20.62 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.86 1.209 . . . . 0.0 108.114 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -52.59 -50.53 62.85 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 19.3 mt -63.19 -36.12 82.58 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.032 -0.985 . . . . 0.0 112.14 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 11.1 tppt? -58.18 -56.59 20.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 120.404 1.456 . . . . 0.0 109.324 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.15 -33.74 76.48 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 119.232 -0.413 . . . . 0.0 110.618 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.3 t -63.69 -47.23 82.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.286 0.948 . . . . 0.0 109.501 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.44 -48.7 71.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.842 -1.075 . . . . 0.0 109.745 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -56.33 -39.37 72.69 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.364 0.984 . . . . 0.0 110.144 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -67.35 -47.66 69.78 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.816 -0.552 . . . . 0.0 110.093 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -68.49 -19.42 64.54 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.308 0.504 . . . . 0.0 111.757 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.68 -43.64 20.05 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.088 -1.007 . . . . 0.0 108.692 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -76.38 -32.41 58.57 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -94.87 147.57 33.33 Favored Pre-proline 0 N--CA 1.467 0.375 0 CA-C-N 119.45 1.023 . . . . 0.0 109.16 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.19 -178.41 3.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.197 1.931 . . . . 0.0 110.905 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.59 48.32 0.35 Allowed Pre-proline 0 CA--C 1.553 1.063 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 -178.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.31 -52.07 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.55 2.167 . . . . 0.0 112.593 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.53 -33.82 73.22 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.502 0.592 . . . . 0.0 109.624 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.14 -43.17 98.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -50.96 71.26 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.721 0.809 . . . . 0.0 111.202 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 74.0 m -66.85 -46.77 74.0 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -58.64 -43.9 89.88 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.733 0.813 . . . . 0.0 109.923 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -48.09 81.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 118.291 -0.861 . . . . 0.0 109.999 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.5 -54.85 40.48 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 118.766 0.712 . . . . 0.0 109.826 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -50.14 66.07 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.435 1.094 . . . . 0.0 111.632 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -65.13 -39.61 93.27 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.337 1.055 . . . . 0.0 110.62 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -56.67 -40.23 75.16 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.183 0.901 . . . . 0.0 109.936 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.4 mt -60.07 -24.39 64.54 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.528 0.731 . . . . 0.0 112.463 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.55 -17.2 64.56 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.854 0.862 . . . . 0.0 112.94 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.05 175.0 9.98 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.266 0.939 . . . . 0.0 109.657 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 31.6 mmm180 . . . . . 0 C--O 1.252 1.207 0 C-N-CA 125.449 1.499 . . . . 0.0 111.076 -179.494 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C 1001 ' ' SER . . . . . 0.406 ' C ' ' H ' ' C' 1003 ' ' ASP . 21.8 p . . . . . 0 N--CA 1.475 0.819 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.09 33.21 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 130.536 3.534 . . . . 0.0 111.882 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1003 ' ' ASP . . . . . 0.406 ' H ' ' C ' ' C' 1001 ' ' SER . 36.2 m-20 -72.81 -43.51 62.63 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.465 1.906 . . . . 0.0 107.717 178.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.3 tt0 77.86 162.49 0.22 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 130.727 3.611 . . . . 0.0 109.906 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -90.2 101.72 14.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -105.02 167.26 9.82 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.71 137.66 38.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 94.25 23.41 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.16 122.38 9.22 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.735 2.29 . . . . 0.0 108.508 178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 84.4 t -144.67 148.04 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 125.0 1.32 . . . . 0.0 108.496 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.56 101.86 5.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -169.7 128.28 1.63 Allowed Glycine 0 CA--C 1.524 0.612 0 CA-C-O 115.404 -2.887 . . . . 0.0 109.714 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 36.0 mmm-85 -69.91 -50.3 43.51 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 123.25 3.525 . . . . 0.0 111.45 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -69.25 -36.96 77.7 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -58.19 -52.08 67.05 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 125.455 1.502 . . . . 0.0 110.112 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.2 t80 -63.39 -47.37 82.3 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.276 1.03 . . . . 0.0 110.244 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -53.19 -57.48 10.33 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -40.3 90.42 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.239 0.615 . . . . 0.0 111.566 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.55 -44.01 93.38 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.812 -0.613 . . . . 0.0 110.02 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.02 -48.0 72.57 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.89 0.876 . . . . 0.0 109.813 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.32 -48.63 73.87 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.951 0.5 . . . . 0.0 110.362 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 97.8 mt -65.08 -50.36 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -50.46 -46.55 56.81 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.37 1.068 . . . . 0.0 110.315 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.87 -49.65 67.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.322 -0.847 . . . . 0.0 111.402 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 87.2 p -56.0 -38.87 71.05 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.593 1.088 . . . . 0.0 113.073 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -73.02 -45.83 55.48 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -57.54 -39.15 75.97 Favored 'General case' 0 C--N 1.342 0.265 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -64.04 -45.1 90.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 116.741 -1.6 . . . . 0.0 110.938 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 26.5 ttm -58.49 -43.58 89.07 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.822 1.192 . . . . 0.0 108.381 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -65.67 -34.5 78.35 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.419 0.688 . . . . 0.0 112.251 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -81.09 -36.82 29.9 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.726 1.148 . . . . 0.0 111.806 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 50.1 mt -117.88 65.63 5.27 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 126.016 1.726 . . . . 0.0 111.115 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -74.9 -4.46 15.45 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.509 2.806 . . . . 0.0 113.643 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -138.74 -24.47 0.92 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.368 1.067 . . . . 0.0 111.764 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 1.9 t60 -68.59 -58.03 4.87 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.614 1.165 . . . . 0.0 108.887 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 17.3 m -62.3 -40.53 96.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.391 1.077 . . . . 0.0 110.89 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.92 -43.8 93.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.11 -47.54 84.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.751 -1.118 . . . . 0.0 108.764 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -35.95 64.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.358 1.435 . . . . 0.0 111.929 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -53.91 32.13 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -36.63 84.64 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.727 -0.608 . . . . 0.0 111.06 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -59.31 -48.13 82.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.907 1.283 . . . . 0.0 108.75 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -63.09 -44.31 96.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.514 1.052 . . . . 0.0 109.173 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -55.03 -43.03 73.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.996 0.919 . . . . 0.0 110.623 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.56 -42.75 58.23 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.104 0.962 . . . . 0.0 110.326 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -61.87 -34.33 75.82 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 123.938 0.895 . . . . 0.0 110.777 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -59.07 -32.87 70.18 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.922 0.783 . . . . 0.0 109.618 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -75.38 -53.96 7.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 21.1 mm100 -59.78 -29.52 68.25 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 3.5 t60 -59.39 -36.79 76.47 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.085 0.954 . . . . 0.0 108.975 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 63.9 tp -75.28 -49.92 17.69 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.723 0.809 . . . . 0.0 109.545 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.3 -27.34 67.23 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.908 0.483 . . . . 0.0 110.64 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 47.16 -126.05 1.62 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.639 2.376 . . . . 0.0 111.566 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -142.37 -46.96 0.34 Allowed 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.403 1.081 . . . . 0.0 112.255 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.45 70.29 6.94 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.18 0.9 . . . . 0.0 108.758 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 12.2 p -133.01 -158.63 0.9 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.905 2.082 . . . . 0.0 108.594 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 60.0 p -143.78 -135.97 0.09 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 15.0 tt -67.3 161.23 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 119.208 0.913 . . . . 0.0 110.338 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.33 159.45 43.34 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.771 2.028 . . . . 0.0 106.663 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.255 1.344 0 C-N-CA 125.472 1.509 . . . . 0.0 107.2 179.658 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.78 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.63 178.63 9.65 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 125.084 1.353 . . . . 0.0 108.418 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 4.0 t0 -146.92 149.9 34.12 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -92.63 9.26 35.51 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.273 0.629 . . . . 0.0 110.655 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -89.62 25.23 2.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.604 1.962 . . . . 0.0 108.399 177.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 17.3 m -60.02 135.78 57.82 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 119.758 -1.839 . . . . 0.0 109.83 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -101.89 128.99 48.04 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -106.58 155.28 19.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -152.48 127.97 10.01 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -119.93 106.2 11.81 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.026 2.13 . . . . 0.0 112.058 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 21.2 t -155.35 150.1 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.962 1.305 . . . . 0.0 110.37 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.44 103.37 11.46 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.7 116.98 1.2 Allowed Glycine 0 CA--C 1.51 -0.23 0 N-CA-C 104.615 -3.394 . . . . 0.0 104.615 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -65.76 -57.7 7.38 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.092 1.946 . . . . 0.0 113.644 -177.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -71.99 -38.85 69.58 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 119.424 1.011 . . . . 0.0 108.414 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -54.73 -50.49 68.24 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.282 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 13.9 t80 -64.69 -42.63 95.2 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 119.562 1.073 . . . . 0.0 110.432 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.12 -54.28 38.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.055 0.843 . . . . 0.0 110.942 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.73 -57.5 10.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 126.668 1.987 . . . . 0.0 111.057 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 57.1 mt -58.89 -36.34 74.51 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.651 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.9 tmt? -70.25 -52.13 25.37 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.755 1.161 . . . . 0.0 108.778 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.1 ttmm -51.97 -51.88 54.19 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 65.7 mt -65.7 -32.34 73.84 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.152 -0.928 . . . . 0.0 112.146 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -63.33 -48.29 78.62 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.586 1.539 . . . . 0.0 108.719 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -66.67 -41.53 88.0 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.77 -42.2 75.15 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.513 0.725 . . . . 0.0 110.267 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.88 -52.45 50.07 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.093 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.01 -43.01 86.44 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.588 1.086 . . . . 0.0 110.355 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.5 mm? -61.42 -48.97 78.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.44 0.696 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.45 -28.0 67.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.063 -0.398 . . . . 0.0 111.585 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -80.31 -23.29 40.76 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 126.693 1.997 . . . . 0.0 113.129 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -94.64 -27.51 15.84 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.287 0.635 . . . . 0.0 110.41 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 81.2 t -95.2 147.46 33.07 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 124.936 1.294 . . . . 0.0 109.111 179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -71.3 -173.11 0.86 Allowed 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.926 2.417 . . . . 0.0 110.432 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.27 35.71 0.11 Allowed Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 117.749 2.5 . . . . 0.0 117.749 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.73 -51.41 4.97 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 123.446 2.267 . . . . 0.0 114.281 -178.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.26 -40.14 92.97 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.0 t -57.56 -47.77 84.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.434 0 C-N-CA 123.668 0.787 . . . . 0.0 109.406 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 44.5 t0 -60.58 -52.01 66.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.509 1.124 . . . . 0.0 110.465 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 41.3 m -60.9 -42.36 97.88 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.905 -0.497 . . . . 0.0 111.743 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.69 -52.33 39.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.914 0.886 . . . . 0.0 109.517 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.5 69.15 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.262 1.425 . . . . 0.0 111.193 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -67.32 -47.98 68.95 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.492 1.042 . . . . 0.0 110.86 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -58.86 -42.53 89.64 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.224 0.92 . . . . 0.0 109.692 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -65.18 -32.68 74.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.312 1.445 . . . . 0.0 109.2 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -59.54 -44.3 93.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.7 mt -64.39 -11.22 30.58 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.482 1.113 . . . . 0.0 113.577 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 13.2 tp -79.65 -19.34 49.36 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.726 1.148 . . . . 0.0 110.167 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -126.51 177.58 6.41 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.537 1.935 . . . . 0.0 108.666 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 39.7 mmt180 . . . . . 0 C--O 1.248 1.001 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.575 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.0 m . . . . . 0 N--CA 1.472 0.664 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -62.48 -26.55 68.59 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 120.587 -1.32 . . . . 0.0 111.527 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -105.65 7.81 32.85 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.496 1.918 . . . . 0.0 113.837 -179.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -58.2 104.94 0.23 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.563 1.145 . . . . 0.0 111.176 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tp -73.12 106.18 4.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.48 161.08 15.38 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -136.32 116.41 13.37 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.425 2.29 . . . . 0.0 105.797 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.82 105.16 15.4 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -75.23 117.13 4.75 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.325 2.683 . . . . 0.0 110.272 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.7 t -145.11 150.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 123.563 0.745 . . . . 0.0 109.532 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -135.11 102.21 5.12 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.862 -1.149 . . . . 0.0 109.837 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.0 135.2 3.53 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 107.529 -2.229 . . . . 0.0 107.529 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -70.78 -52.25 21.85 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.561 2.181 . . . . 0.0 110.419 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -30.81 64.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.68 1.192 . . . . 0.0 108.888 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.4 m -60.89 -49.92 75.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.74 1.216 . . . . 0.0 107.739 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -62.86 -39.9 95.84 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.264 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.46 -57.41 11.31 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.013 0.824 . . . . 0.0 111.704 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 35.6 ttm -57.71 -44.7 86.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.597 0.635 . . . . 0.0 110.359 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.6 mt -59.54 -48.57 81.15 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.382 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.76 -40.95 88.46 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.576 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.18 -49.45 76.99 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.247 1.385 . . . . 0.0 109.56 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.5 mt -67.15 -51.57 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.701 -0.625 . . . . 0.0 109.769 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -56.69 -48.56 77.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 117.814 -1.089 . . . . 0.0 112.146 -178.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.19 -55.79 30.37 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.4 m -56.74 -36.36 69.66 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.49 -37.89 50.29 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.981 0.81 . . . . 0.0 111.925 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -63.8 -50.36 69.27 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.269 -0.895 . . . . 0.0 108.692 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.3 mt -61.08 -52.08 66.44 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.861 1.265 . . . . 0.0 111.376 -179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.3 ppp? -56.93 -45.9 82.42 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.267 0.939 . . . . 0.0 111.854 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -74.34 -29.37 61.56 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.254 0.934 . . . . 0.0 112.879 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -71.03 -47.15 60.25 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.955 0.798 . . . . 0.0 110.425 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.1 tp -120.51 75.52 25.31 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 124.855 1.262 . . . . 0.0 108.741 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -80.66 67.45 8.63 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.875 3.05 . . . . 0.0 112.764 -178.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -59.44 168.96 1.36 Allowed 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.327 0.651 . . . . 0.0 111.161 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -48.26 -46.59 35.89 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 123.714 0.806 . . . . 0.0 112.267 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -58.2 -51.26 70.5 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.485 1.039 . . . . 0.0 110.766 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.32 -42.26 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.904 1.682 . . . . 0.0 109.704 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.56 -42.82 67.35 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.417 0.687 . . . . 0.0 111.535 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.281 1.433 . . . . 0.0 109.912 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.67 -51.11 70.76 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -55.23 -48.51 73.81 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.412 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -56.91 -42.07 79.26 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.75 0.82 . . . . 0.0 110.818 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -55.04 -54.76 38.95 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.777 1.231 . . . . 0.0 111.497 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -78.23 -40.76 36.37 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.339 0.518 . . . . 0.0 111.709 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -55.61 -41.09 72.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.51 1.124 . . . . 0.0 111.713 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -54.22 -45.96 72.39 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -69.04 -53.68 19.13 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.168 0.587 . . . . 0.0 110.092 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -52.7 -38.69 61.05 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.193 1.797 . . . . 0.0 113.532 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -56.12 -26.53 50.37 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.108 0.963 . . . . 0.0 113.056 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -66.34 -27.82 68.18 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.772 -1.205 . . . . 0.0 110.134 178.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 mp -95.05 9.6 38.89 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.464 2.306 . . . . 0.0 112.039 178.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.3 tp -64.68 -6.24 7.42 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -178.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -76.96 80.47 3.5 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 120.582 1.537 . . . . 0.0 108.884 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -61.01 -35.39 76.73 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 124.584 1.154 . . . . 0.0 111.508 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 26.9 96.89 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 130.262 3.425 . . . . 0.0 114.161 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.7 m 70.16 55.9 0.3 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.655 1.182 . . . . 0.0 111.476 178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -158.56 108.56 2.04 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 120.841 -1.162 . . . . 0.0 110.181 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.0 tt -156.53 141.62 9.06 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 C-N-CA 126.195 1.798 . . . . 0.0 108.588 179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.438 ' HB2' ' HE2' ' B' ' 107' ' ' LYS . 3.1 tt0 -147.0 159.05 44.04 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.668 1.987 . . . . 0.0 107.76 179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 p . . . . . 0 C--O 1.256 1.398 0 CA-C-O 117.275 -1.345 . . . . 0.0 108.745 179.742 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.628 0 N-CA-C 108.911 -1.676 . . . . 0.0 108.911 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 15.0 m 62.96 86.52 0.12 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.689 1.596 . . . . 0.0 113.913 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -144.46 96.36 2.86 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 177.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -139.86 -16.6 0.99 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.087 0.955 . . . . 0.0 113.086 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.94 165.43 17.78 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.049 0.94 . . . . 0.0 109.961 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.96 143.64 48.3 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.275 -0.891 . . . . 0.0 109.572 -178.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -102.4 130.28 49.11 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.59 116.94 27.06 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.567 1.147 . . . . 0.0 108.4 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.52 141.34 35.51 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -140.47 104.35 4.75 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.0 m -155.49 150.57 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 112.011 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -110.75 101.92 10.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.214 1.37 . . . . 0.0 108.187 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.66 116.13 0.91 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-O 116.763 -2.132 . . . . 0.0 108.916 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -66.88 -57.14 7.57 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 121.717 2.759 . . . . 0.0 113.425 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . 0.438 ' HE2' ' HB2' ' A' ' 59' ' ' GLN . 5.5 mptt -66.29 -44.63 82.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.501 ' HB3' ' HZ2' ' D' 1116 ' ' LYS . 16.1 m-20 -52.12 -50.51 61.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 125.756 1.622 . . . . 0.0 110.908 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -63.97 -47.07 81.85 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.942 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -51.21 -53.87 30.97 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 124.063 0.852 . . . . 0.0 110.427 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.7 mt -60.17 -58.22 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 125.251 1.42 . . . . 0.0 110.494 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mp -55.62 -44.24 76.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 117.824 -1.084 . . . . 0.0 113.232 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 22.4 ttp -62.73 -48.07 80.84 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 119.907 1.231 . . . . 0.0 109.961 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -55.76 -50.94 69.06 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 118.428 0.558 . . . . 0.0 110.274 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 mt -65.51 -30.73 71.53 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 24.8 tptt -64.51 -60.0 3.66 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.65 -44.6 81.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.194 0.998 . . . . 0.0 110.896 -179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 31.0 t -52.55 -46.45 66.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.041 0.937 . . . . 0.0 110.33 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.67 -45.88 56.66 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.984 0.514 . . . . 0.0 111.204 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -56.34 -39.88 73.56 Favored 'General case' 0 C--O 1.238 0.473 0 O-C-N 121.672 -0.642 . . . . 0.0 110.343 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.75 -53.88 23.75 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.137 0.975 . . . . 0.0 108.523 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.31 -39.69 67.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.833 0.742 . . . . 0.0 112.401 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -73.3 -29.27 62.6 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.372 1.069 . . . . 0.0 110.4 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 20.8 tp -86.31 -33.23 20.67 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.853 -1.154 . . . . 0.0 113.643 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 12.4 m -94.97 148.27 34.43 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 120.019 1.281 . . . . 0.0 110.883 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.62 -174.93 1.19 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.187 1.925 . . . . 0.0 109.066 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -113.58 82.13 6.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 O-C-N 121.614 -0.678 . . . . 0.0 112.244 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -80.86 -102.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.494 0 C-N-CA 124.181 3.254 . . . . 0.0 111.873 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.27 -35.7 65.31 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.541 -1.35 . . . . 0.0 109.99 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.7 m -56.39 -37.03 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 C-N-CA 124.351 1.06 . . . . 0.0 112.581 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.29 -46.67 22.27 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 6.1 m -56.23 -42.46 77.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 123.385 0.428 . . . . 0.0 110.329 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -67.78 -50.53 56.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 126.168 1.787 . . . . 0.0 108.315 178.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -52.85 -47.74 67.55 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.601 1.091 . . . . 0.0 111.134 -178.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.85 -42.2 86.12 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.172 0.897 . . . . 0.0 112.559 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.84 -38.28 82.97 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.525 -0.734 . . . . 0.0 110.517 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -46.81 78.0 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.53 -35.11 65.31 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.55 1.54 . . . . 0.0 110.975 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.32 -24.47 29.07 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.356 1.434 . . . . 0.0 111.832 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.4 tt -65.6 -36.7 84.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 110.265 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.29 102.96 4.62 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.68 1.592 . . . . 0.0 111.74 -179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 54.1 ttt-85 . . . . . 0 C--O 1.245 0.841 0 C-N-CA 125.016 1.327 . . . . 0.0 108.69 179.922 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 N--CA 1.467 0.416 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -62.82 -29.95 71.12 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 120.512 -1.368 . . . . 0.0 111.503 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -79.96 2.42 23.61 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.809 2.044 . . . . 0.0 113.909 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.73 99.61 0.16 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 120.142 1.337 . . . . 0.0 110.139 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.1 tp -69.19 95.53 0.76 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.85 0.86 . . . . 0.0 109.247 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.21 170.97 9.02 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.739 1.216 . . . . 0.0 109.519 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -146.12 154.62 42.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.973 1.309 . . . . 0.0 108.532 179.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -125.36 91.97 47.91 Favored Pre-proline 0 N--CA 1.45 -0.439 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.94 112.4 3.28 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.592 2.194 . . . . 0.0 107.033 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 46.7 t -144.83 155.7 14.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -135.44 103.76 5.59 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.67 112.69 0.51 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 105.62 -2.992 . . . . 0.0 105.62 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -59.49 -51.91 67.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 122.172 2.986 . . . . 0.0 108.615 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -71.04 -39.95 72.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.221 1.009 . . . . 0.0 111.145 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -63.51 -42.16 98.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.45 0.7 . . . . 0.0 110.261 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 71.2 t80 -61.68 -45.14 95.29 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.769 1.228 . . . . 0.0 108.89 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -56.64 -50.43 72.08 Favored 'General case' 0 N--CA 1.462 0.161 0 O-C-N 123.28 0.363 . . . . 0.0 110.857 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.3 ttm -64.79 -46.08 83.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.117 0.567 . . . . 0.0 111.293 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 46.9 mt -60.46 -46.48 89.91 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.403 -178.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.69 -49.04 70.0 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.265 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.91 -49.7 70.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.388 0.675 . . . . 0.0 111.468 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 79.2 mt -70.17 -39.27 76.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.647 -0.658 . . . . 0.0 110.372 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -61.26 -45.47 94.37 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.56 0.744 . . . . 0.0 110.752 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -52.26 65.89 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.0 0.92 . . . . 0.0 108.654 -179.112 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 26.7 m -58.1 -45.87 86.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 123.479 0.712 . . . . 0.0 112.33 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.43 -36.39 81.14 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.869 0.758 . . . . 0.0 111.099 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.59 -48.49 66.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 121.638 -0.664 . . . . 0.0 111.421 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.47 -40.66 70.13 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.071 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 5.2 ppp? -62.49 -40.22 95.99 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.316 0.962 . . . . 0.0 109.928 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -76.21 -34.89 59.27 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 118.961 0.8 . . . . 0.0 111.438 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 59.9 t80 -69.56 -40.06 77.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.088 0.858 . . . . 0.0 112.626 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 28.4 tp -126.57 75.2 74.59 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -76.71 79.91 2.94 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.888 3.059 . . . . 0.0 112.179 -178.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -63.38 163.56 10.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.724 1.209 . . . . 0.0 108.631 178.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -55.74 -35.69 66.44 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.041 0.837 . . . . 0.0 110.618 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.0 m -56.31 -52.23 65.28 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.697 1.135 . . . . 0.0 110.22 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.96 -46.21 92.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 128.243 2.617 . . . . 0.0 111.424 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -69.87 -47.5 62.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.809 -0.615 . . . . 0.0 111.642 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.7 m -55.12 -39.28 69.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.81 0.844 . . . . 0.0 109.062 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -53.58 49.23 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.272 0.629 . . . . 0.0 110.695 178.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -57.49 -44.27 84.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 118.795 -0.621 . . . . 0.0 110.046 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -54.61 -44.09 72.77 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.147 0.579 . . . . 0.0 110.208 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -61.83 -55.29 31.41 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.0 -44.06 73.55 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.86 0.755 . . . . 0.0 112.602 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -55.99 -36.36 67.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.521 1.529 . . . . 0.0 112.308 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -57.37 -36.59 71.42 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.635 0.652 . . . . 0.0 110.862 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -70.29 -53.0 18.66 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.879 0.763 . . . . 0.0 109.487 178.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -53.79 -33.28 55.47 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 124.877 1.271 . . . . 0.0 112.555 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -57.13 -33.45 67.39 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.983 0.81 . . . . 0.0 112.664 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 36.4 m80 -65.52 -32.63 74.33 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.346 0.976 . . . . 0.0 109.935 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 3.8 mp -93.19 7.95 42.18 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.642 1.577 . . . . 0.0 111.768 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 15.8 tp -62.05 -8.2 5.02 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.887 1.222 . . . . 0.0 113.994 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -68.25 72.36 0.19 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.477 2.311 . . . . 0.0 109.157 178.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 2.3 mtpp -65.64 -31.39 72.38 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.11 -0.994 . . . . 0.0 112.219 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 40.5 tt0 24.92 92.89 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.554 3.142 . . . . 0.0 113.393 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 15.2 m 68.03 69.58 0.33 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.375 1.07 . . . . 0.0 110.059 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 4.2 t -168.12 113.68 0.66 Allowed 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.318 1.447 . . . . 0.0 107.101 179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 19.0 tt -161.8 151.19 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 124.258 1.023 . . . . 0.0 109.837 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -146.6 159.62 43.21 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.344 2.258 . . . . 0.0 105.863 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 85.9 p . . . . . 0 C--O 1.253 1.259 0 CA-C-O 116.62 -1.657 . . . . 0.0 109.886 -179.219 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.853 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 73.79 89.03 0.09 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 126.442 1.897 . . . . 0.0 109.304 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 11.7 t70 -130.65 85.37 2.27 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.583 2.353 . . . . 0.0 106.042 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -138.95 -46.76 0.48 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.898 1.279 . . . . 0.0 109.077 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 27.9 t0 -55.44 117.3 3.45 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 125.29 1.436 . . . . 0.0 109.192 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.64 149.21 38.24 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.555 1.542 . . . . 0.0 110.035 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -102.38 157.23 17.06 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -137.27 158.02 45.35 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.96 0.504 . . . . 0.0 109.728 -179.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 1.3 mt -152.51 108.68 3.39 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -102.08 98.74 8.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.13 2.572 . . . . 0.0 105.874 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.3 m -151.86 151.43 12.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 C-N-CA 124.783 1.233 . . . . 0.0 110.046 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -122.26 102.35 8.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 118.994 0.815 . . . . 0.0 112.056 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.42 113.37 0.79 Allowed Glycine 0 CA--C 1.504 -0.621 0 N-CA-C 105.179 -3.168 . . . . 0.0 105.179 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.39 -56.85 16.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 119.667 1.734 . . . . 0.0 110.623 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 37.9 mttp -62.62 -49.31 75.69 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.289 1.036 . . . . 0.0 108.624 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -52.46 -49.54 64.44 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.89 1.276 . . . . 0.0 111.251 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.5 t80 -65.12 -39.92 93.76 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 119.412 1.005 . . . . 0.0 111.77 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -54.57 -53.56 52.91 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.209 0.913 . . . . 0.0 108.805 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 37.8 mt -62.38 -57.79 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.998 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.66 -45.38 81.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 116.953 -1.499 . . . . 0.0 113.81 -178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 2.0 ttt -61.79 -49.0 78.09 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 120.851 1.66 . . . . 0.0 109.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -57.31 -52.06 66.87 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.47 -25.89 66.93 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.778 -0.576 . . . . 0.0 112.122 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1116 ' ' LYS . . . . . 0.501 ' HZ2' ' HB3' ' B' ' 108' ' ' ASN . 12.4 tptt -63.06 -60.54 3.3 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 118.901 0.773 . . . . 0.0 109.303 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.98 -31.95 73.44 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 124.679 1.237 . . . . 0.0 111.459 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 33.4 t -55.16 -51.99 64.72 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.016 0.826 . . . . 0.0 109.173 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.22 -42.89 79.12 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 122.197 0.199 . . . . 0.0 110.878 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -59.19 -45.0 92.22 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.531 -0.73 . . . . 0.0 110.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 30.6 mt -65.78 -53.82 35.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.189 0.995 . . . . 0.0 109.773 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.66 -34.24 69.17 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.885 0.766 . . . . 0.0 110.834 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -79.04 -22.21 45.74 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.712 1.142 . . . . 0.0 110.369 178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 48.9 tp -90.48 -34.3 15.63 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 120.688 -1.257 . . . . 0.0 113.124 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 13.8 m -95.28 147.45 33.04 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 119.763 1.165 . . . . 0.0 110.832 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.0 178.04 5.78 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.075 1.85 . . . . 0.0 108.721 178.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -108.89 87.85 4.93 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -84.98 -100.45 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.327 0 C-N-CA 124.048 3.165 . . . . 0.0 108.884 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.8 -32.99 64.0 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 126.545 1.938 . . . . 0.0 111.269 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.1 m -56.9 -41.33 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 118.869 0.758 . . . . 0.0 110.755 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -74.68 -45.45 44.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.416 1.086 . . . . 0.0 109.425 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 43.5 m -61.31 -38.47 86.98 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 20.2 t80 -67.28 -52.58 38.97 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.911 1.285 . . . . 0.0 107.699 178.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -48.24 69.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.394 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -61.71 -53.9 49.79 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.819 0.736 . . . . 0.0 111.42 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -58.14 -40.51 81.52 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.806 -0.558 . . . . 0.0 111.425 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.69 -33.61 71.1 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.852 0.861 . . . . 0.0 110.144 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.64 -32.86 73.97 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.912 1.285 . . . . 0.0 108.912 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 77.3 mt -54.75 -25.31 26.95 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.112 0.869 . . . . 0.0 112.387 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.3 tt -74.1 -30.27 62.26 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.219 1.408 . . . . 0.0 111.054 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.39 96.0 2.88 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.952 -1.092 . . . . 0.0 112.01 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 0.997 0 CA-C-O 116.185 -1.864 . . . . 0.0 109.643 179.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.465 0.287 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.21 -9.14 19.85 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.227 -0.92 . . . . 0.0 112.283 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -79.49 -12.46 59.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.866 1.266 . . . . 0.0 113.646 -179.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.72 106.13 1.13 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.877 1.271 . . . . 0.0 111.008 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 47.6 tp -72.0 118.01 14.34 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.832 0.853 . . . . 0.0 108.777 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.2 mp -113.92 162.45 16.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.369 1.867 . . . . 0.0 107.388 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -135.23 124.25 24.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.13 96.05 1.13 Allowed Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.49 1.516 . . . . 0.0 108.782 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.31 103.51 1.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.489 2.793 . . . . 0.0 112.021 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -138.61 156.16 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.514 -1.366 . . . . 0.0 109.14 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -135.31 103.11 5.39 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 104.743 -2.317 . . . . 0.0 104.743 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 114.53 0.59 Allowed Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 106.716 -2.554 . . . . 0.0 106.716 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.0 tpt85 -64.52 -51.04 64.95 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 120.519 2.16 . . . . 0.0 110.535 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.46 -32.47 71.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.805 0.73 . . . . 0.0 110.684 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -66.64 -50.93 61.35 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 110.28 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -56.87 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.877 0.871 . . . . 0.0 109.015 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -55.65 -49.5 72.74 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.418 0.287 . . . . 0.0 110.587 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.6 ttm -61.17 -47.25 87.04 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.67 0.668 . . . . 0.0 111.281 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.64 -32.07 73.44 Favored 'General case' 0 C--O 1.227 -0.099 0 CA-C-O 118.53 -0.748 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -71.23 -53.97 12.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.468 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.05 -48.83 77.59 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.121 0.968 . . . . 0.0 111.181 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.0 mt -71.98 -36.96 59.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 O-C-N 121.527 -0.733 . . . . 0.0 111.574 -178.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -66.31 -52.44 47.21 Favored 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 121.063 -1.023 . . . . 0.0 109.228 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.64 -37.31 87.14 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.938 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -56.13 -52.11 65.5 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.289 0.95 . . . . 0.0 109.459 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -65.98 -48.43 71.27 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.11 0.564 . . . . 0.0 111.666 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -50.59 73.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-N 118.416 0.553 . . . . 0.0 111.149 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.11 -38.86 92.6 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 117.692 -1.147 . . . . 0.0 109.786 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.43 -28.94 67.41 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.22 1.008 . . . . 0.0 110.208 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -90.98 -30.79 16.62 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.468 -0.77 . . . . 0.0 111.018 178.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -78.67 -25.32 44.87 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 118.149 -0.929 . . . . 0.0 113.206 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -77.45 163.39 64.42 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -85.32 152.32 10.65 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 121.581 1.521 . . . . 0.0 108.786 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.46 -2.97 0.14 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.315 2.246 . . . . 0.0 115.544 -179.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -47.89 -58.66 4.1 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.323 1.449 . . . . 0.0 113.351 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.2 m -66.6 -32.58 74.01 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.55 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.0 mm -62.27 -47.42 93.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.99 -53.94 51.86 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.661 0.785 . . . . 0.0 110.909 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.6 m -58.08 -50.17 74.38 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.384 1.874 . . . . 0.0 110.51 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.97 -49.41 77.96 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.507 0.723 . . . . 0.0 110.014 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.0 mtp85 -58.92 -43.19 91.05 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -61.32 -55.06 36.02 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.317 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -53.19 -54.31 37.76 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.924 0.89 . . . . 0.0 110.381 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -53.6 -47.92 69.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.037 1.335 . . . . 0.0 111.153 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -67.42 -46.09 74.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.71 0.804 . . . . 0.0 111.484 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -59.4 -42.37 91.61 Favored 'General case' 0 CA--C 1.528 0.1 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -59.81 -29.48 68.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 118.033 -0.984 . . . . 0.0 111.746 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -65.42 -54.41 29.06 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 106.146 -1.798 . . . . 0.0 106.146 177.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.31 -49.28 67.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.865 0.866 . . . . 0.0 109.084 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -58.5 -30.04 66.72 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.2 1.0 . . . . 0.0 113.551 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.08 -34.49 29.35 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.743 1.156 . . . . 0.0 109.376 179.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 mp -67.98 -45.61 73.64 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -69.46 167.03 17.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.014 1.726 . . . . 0.0 108.814 179.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -131.34 53.51 1.98 Allowed 'General case' 0 N--CA 1.462 0.142 0 O-C-N 121.374 -0.829 . . . . 0.0 109.426 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -148.98 161.08 42.63 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 125.724 1.61 . . . . 0.0 107.659 179.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.8 p -79.17 163.41 25.05 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.953 0.901 . . . . 0.0 110.616 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.9 t -68.72 139.08 55.37 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.3 tt -161.11 136.63 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 179.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -146.4 158.68 43.92 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.259 1.566 0 C-N-CA 128.596 2.758 . . . . 0.0 105.905 178.581 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.908 0 N-CA-C 110.744 -0.942 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 37.2 m -135.9 -179.23 5.53 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.528 1.931 . . . . 0.0 109.64 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -63.86 70.42 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 127.599 2.36 . . . . 0.0 114.364 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -139.66 -34.66 0.56 Allowed 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 129.148 2.979 . . . . 0.0 107.997 178.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . 0.252 2.7 t70 55.56 -138.45 1.05 Allowed 'General case' 0 C--O 1.236 0.39 0 C-N-CA 126.794 2.037 . . . . 0.0 110.738 -179.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.2 m -153.39 158.33 41.31 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 120.983 1.72 . . . . 0.0 107.977 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -111.0 139.57 46.24 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -124.75 144.1 50.42 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.874 1.67 . . . . 0.0 110.691 -177.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.6 mp -131.17 145.77 52.08 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.487 1.515 . . . . 0.0 108.872 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -145.64 107.4 4.28 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.133 1.773 . . . . 0.0 108.357 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 70.7 t -155.63 151.16 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 127.306 2.242 . . . . 0.0 108.498 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -107.51 101.71 11.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 177.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.73 114.54 0.87 Allowed Glycine 0 CA--C 1.523 0.563 0 CA-C-O 116.851 -2.083 . . . . 0.0 108.092 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -68.17 -58.48 4.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.854 2.827 . . . . 0.0 113.963 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -62.74 -46.44 88.07 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -54.97 -44.53 74.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 124.302 1.001 . . . . 0.0 112.031 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -65.21 -48.58 72.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 120.078 1.308 . . . . 0.0 110.789 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -58.7 -49.44 77.58 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.645 1.111 . . . . 0.0 110.816 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 68.8 mt -61.51 -53.68 45.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.312 1.445 . . . . 0.0 111.311 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 8.8 mt -63.58 -35.83 81.79 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 117.476 -1.25 . . . . 0.0 110.573 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 30.5 mtp -62.13 -46.66 88.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 120.491 1.496 . . . . 0.0 110.87 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -64.21 -51.83 61.78 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.924 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 85.3 mt -60.68 -34.82 74.91 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.5 tppt? -63.73 -53.83 44.91 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -62.51 -45.75 91.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.7 0.625 . . . . 0.0 111.95 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 22.5 m -57.09 -38.53 73.5 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.524 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -45.28 72.59 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.851 0.751 . . . . 0.0 109.77 179.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -58.84 -44.54 90.97 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.85 -32.82 69.96 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.535 -0.728 . . . . 0.0 110.086 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 27.0 ttt -66.97 -40.99 87.6 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.73 -31.37 72.33 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 118.46 0.573 . . . . 0.0 110.638 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 tp -71.53 -34.28 69.91 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.341 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.2 m -94.51 148.95 35.82 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 119.424 1.011 . . . . 0.0 112.636 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.5 -91.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.918 0 N-CA-C 107.395 -1.809 . . . . 0.0 107.395 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -160.96 57.82 0.91 Allowed Pre-proline 0 CA--C 1.546 0.793 0 CA-C-N 120.99 1.723 . . . . 0.0 111.341 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.37 -88.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.868 2.379 . . . . 0.0 112.365 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.91 -25.77 67.3 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.365 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.6 t -56.83 -55.0 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.521 1.129 . . . . 0.0 108.712 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.16 -42.1 84.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.405 1.002 . . . . 0.0 110.53 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.6 -49.76 69.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.889 0.476 . . . . 0.0 111.256 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -70.36 -48.62 55.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.681 1.592 . . . . 0.0 110.344 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -56.54 -41.44 76.83 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.289 0.95 . . . . 0.0 110.47 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -63.58 -51.74 64.03 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.275 0.943 . . . . 0.0 108.823 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -55.3 -41.92 72.98 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.492 0.717 . . . . 0.0 109.602 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.54 -28.12 63.65 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.386 -0.821 . . . . 0.0 110.475 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -63.05 -36.36 83.32 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 34.1 mt -66.48 -2.74 4.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.798 0.839 . . . . 0.0 111.861 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -99.8 -9.82 22.52 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.726 2.01 . . . . 0.0 110.11 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -114.95 116.8 29.08 Favored 'General case' 0 CA--C 1.517 -0.318 0 O-C-N 120.823 -1.173 . . . . 0.0 108.246 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 12.8 mtp85 . . . . . 0 C--O 1.247 0.941 0 N-CA-C 105.908 -1.886 . . . . 0.0 105.908 -179.799 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 121.565 0.698 . . . . 0.0 111.61 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 1.1 t70 -103.39 19.79 19.05 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.935 1.294 . . . . 0.0 110.815 179.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 65.5 t0 -130.92 40.34 3.49 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.367 2.267 . . . . 0.0 109.547 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -102.0 105.67 16.47 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 103.083 -2.932 . . . . 0.0 103.083 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.59 106.9 0.72 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.64 165.58 12.64 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 125.145 1.378 . . . . 0.0 108.973 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -135.06 149.66 50.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.251 1.421 . . . . 0.0 107.481 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.6 89.73 45.0 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.05 111.28 3.24 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.6 2.867 . . . . 0.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 50.2 t -145.61 162.28 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 124.123 0.969 . . . . 0.0 109.03 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1011 ' ' ARG . . . . . 0.414 HH11 ' HG2' ' C' 1011 ' ' ARG . 8.7 ptt-85 -134.91 104.76 6.1 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 103.438 -2.801 . . . . 0.0 103.438 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.04 108.94 0.33 Allowed Glycine 0 C--O 1.227 -0.292 0 CA-C-O 117.206 -1.886 . . . . 0.0 109.15 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 26.8 tpt85 -61.03 -52.76 63.61 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.818 2.309 . . . . 0.0 112.565 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.52 -30.83 53.06 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.348 -0.845 . . . . 0.0 112.192 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -40.29 76.82 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 41.3 t80 -62.33 -51.33 68.05 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -49.84 -57.36 7.56 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.011 0.924 . . . . 0.0 110.952 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 7.9 tmm? -60.39 -49.06 79.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.7 -34.42 78.26 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 119.15 0.886 . . . . 0.0 111.267 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.0 mm? -68.14 -48.28 65.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.542 1.065 . . . . 0.0 109.613 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -58.8 -48.78 80.08 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.317 0.647 . . . . 0.0 110.447 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.4 mt -67.79 -44.33 85.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 118.191 0.45 . . . . 0.0 111.292 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -63.08 -46.07 89.13 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 119.003 0.82 . . . . 0.0 109.028 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -60.37 -48.74 80.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.893 0.877 . . . . 0.0 108.773 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1025 ' ' SER . . . . . 0.45 ' HG ' ' HB2' ' D' 1122 ' ' MET . 20.4 t -53.45 -52.07 60.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.718 0.807 . . . . 0.0 111.247 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.44 -58.06 6.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.289 1.435 . . . . 0.0 112.831 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -46.67 88.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -177.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.29 -39.59 92.74 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 117.69 -1.148 . . . . 0.0 109.684 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -59.12 -31.75 69.22 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.034 0.833 . . . . 0.0 109.322 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -80.68 -30.56 36.48 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.846 0.748 . . . . 0.0 110.842 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -75.88 -45.63 34.49 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.318 1.047 . . . . 0.0 113.135 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 4.6 pp -64.23 149.89 93.56 Favored Pre-proline 0 C--O 1.24 0.558 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -70.45 150.03 63.38 Favored 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 122.181 1.921 . . . . 0.0 108.835 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -3.65 0.31 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.582 2.353 . . . . 0.0 116.85 -178.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 11.5 m170 -47.72 -57.75 5.16 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.778 1.631 . . . . 0.0 114.346 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 1.9 m -65.41 -36.2 83.21 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.52 -1.362 . . . . 0.0 110.948 -179.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.4 mm -59.47 -44.26 92.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 119.613 1.097 . . . . 0.0 108.209 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.29 -58.32 9.14 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.455 1.102 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 53.1 m -61.33 -31.34 71.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.609 0.764 . . . . 0.0 111.924 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.11 -53.72 18.75 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.73 -41.25 81.44 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 122.993 0.517 . . . . 0.0 110.46 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -55.67 -57.54 11.54 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.253 1.021 . . . . 0.0 110.557 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -68.2 -35.78 78.52 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.887 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -57.79 -48.6 79.23 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.391 0.996 . . . . 0.0 109.545 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -68.27 -29.81 68.69 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.492 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -72.05 -50.48 28.03 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 120.248 1.386 . . . . 0.0 109.494 177.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -52.15 -43.6 64.16 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 127.178 2.191 . . . . 0.0 114.207 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 64.3 m80 -59.08 -45.25 91.32 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.031 0.832 . . . . 0.0 109.535 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.69 -40.13 80.19 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.634 -0.698 . . . . 0.0 109.62 179.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 36.4 m170 -58.73 -39.85 82.07 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.407 1.003 . . . . 0.0 110.37 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 36.1 mt -73.6 -30.67 63.14 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 118.652 -0.689 . . . . 0.0 110.662 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 8.1 mt -70.66 -45.05 65.84 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -72.47 177.37 4.67 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.637 1.975 . . . . 0.0 109.774 179.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 67.3 mttm -133.19 44.76 2.79 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 126.176 1.79 . . . . 0.0 109.008 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -142.65 154.77 44.66 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.097 0.959 . . . . 0.0 108.567 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 15.5 p -76.16 166.75 23.02 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 122.005 0.907 . . . . 0.0 110.061 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 40.2 t -74.8 153.56 38.7 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 18.1 tt -155.18 157.24 4.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -146.45 158.52 43.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 C--O 1.258 1.551 0 C-N-CA 129.991 3.316 . . . . 0.0 105.021 178.589 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.524 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 2.8 t -157.88 -156.55 0.58 Allowed 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 126.686 1.994 . . . . 0.0 106.488 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.84 72.79 2.76 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.536 0.684 . . . . 0.0 110.379 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -139.65 -22.23 0.89 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.775 2.43 . . . . 0.0 110.729 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1097 ' ' ASP . . . . . 0.437 ' C ' ' HG1' ' D' 1098 ' ' THR . 3.7 t70 43.89 -129.79 0.84 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 128.515 2.726 . . . . 0.0 113.518 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D 1098 ' ' THR . . . . . 0.437 ' HG1' ' C ' ' D' 1097 ' ' ASP . 79.6 m -158.35 158.72 34.83 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.865 1.666 . . . . 0.0 108.778 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.09 144.46 49.3 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.56 161.12 32.22 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.822 1.249 . . . . 0.0 112.248 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.0 mp -145.36 133.07 21.01 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.34 106.75 9.73 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 104.351 -2.463 . . . . 0.0 104.351 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 40.1 t -152.49 142.25 14.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 118.52 0.6 . . . . 0.0 109.601 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.8 100.62 9.82 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.39 115.06 0.84 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.365 -2.694 . . . . 0.0 106.365 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -57.77 10.68 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.682 2.741 . . . . 0.0 111.823 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 22.0 mmtt -63.31 -48.55 77.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -52.16 -44.17 64.48 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 123.929 0.892 . . . . 0.0 111.71 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 27.8 t80 -67.08 -50.08 62.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.061 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.33 -49.28 74.8 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.169 0.895 . . . . 0.0 110.945 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.79 -53.43 48.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 124.79 1.236 . . . . 0.0 109.61 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.75 -28.03 68.74 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.162 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 7.7 mtp -64.89 -51.8 60.0 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 120.401 1.455 . . . . 0.0 109.834 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -48.22 82.58 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 123.412 0.445 . . . . 0.0 110.245 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.211 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -55.78 -54.93 38.41 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.733 0.813 . . . . 0.0 108.896 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -58.74 -53.83 53.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.764 1.226 . . . . 0.0 110.425 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 38.2 m -56.78 -42.71 79.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.323 -0.846 . . . . 0.0 112.575 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.81 -34.8 78.98 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.761 1.164 . . . . 0.0 110.367 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -68.2 -40.35 82.21 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -69.85 -35.34 74.64 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.28 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1122 ' ' MET . . . . . 0.45 ' HB2' ' HG ' ' C' 1025 ' ' SER . 8.2 ttt -61.27 -49.98 74.87 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.2 -28.84 68.41 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.011 0.823 . . . . 0.0 111.301 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.8 tm? -68.97 -32.91 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.387 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 32.3 m -91.08 147.04 34.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 119.897 1.226 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -72.32 -79.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.927 2.418 . . . . 0.0 111.058 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -165.44 64.24 0.98 Allowed Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.003 1.321 . . . . 0.0 109.834 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -80.78 -106.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 123.664 2.909 . . . . 0.0 113.264 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.62 -32.12 68.73 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.757 1.223 . . . . 0.0 110.145 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 14.1 t -54.24 -53.79 26.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.124 1.37 . . . . 0.0 109.277 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.32 -40.41 95.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.795 1.638 . . . . 0.0 110.981 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -61.91 -50.6 71.54 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.67 -33.39 74.83 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.197 0.599 . . . . 0.0 109.945 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -59.17 -47.23 86.06 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -60.58 -51.99 67.05 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -53.75 -44.71 70.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.794 1.238 . . . . 0.0 112.509 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.23 -29.16 57.45 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.245 -0.909 . . . . 0.0 111.055 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 30.7 tp60 -63.89 -35.3 80.2 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.258 -0.901 . . . . 0.0 109.312 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.14 -31.94 61.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.446 0.699 . . . . 0.0 111.357 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.15 -16.36 63.62 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.405 0.682 . . . . 0.0 112.49 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -104.46 83.59 2.07 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 120.587 -1.321 . . . . 0.0 109.623 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 . . . . . 0 C--O 1.255 1.36 0 C-N-CA 126.875 2.07 . . . . 0.0 110.714 179.306 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.482 1.164 0 CA-C-O 122.964 1.364 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.424 ' C ' ' H ' ' A' ' 4' ' ' GLU . 6.5 p-10 -59.41 11.19 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 1 C-N-CA 132.725 4.41 . . . . 0.0 114.841 179.288 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -72.71 5.28 3.24 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.707 -1.246 . . . . 0.0 110.441 178.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' A' ' 2' ' ' ASP . 8.0 pt-20 -61.66 108.72 1.03 Allowed 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 127.749 2.42 . . . . 0.0 106.58 178.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.6 tp -76.7 101.58 5.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 124.206 1.002 . . . . 0.0 108.771 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.6 mt -94.53 158.67 15.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 106.76 -1.571 . . . . 0.0 106.76 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -129.69 123.04 30.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -98.07 99.34 6.81 Favored Pre-proline 0 N--CA 1.447 -0.586 0 C-N-CA 124.033 0.933 . . . . 0.0 109.346 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.06 126.85 10.19 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.383 2.056 . . . . 0.0 107.259 177.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.3 t -146.05 146.27 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 119.203 0.911 . . . . 0.0 109.825 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.6 ptt85 -135.97 101.17 4.64 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.44 130.96 2.22 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 105.209 -3.156 . . . . 0.0 105.209 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.6 tpp85 -70.18 -52.07 26.23 Favored 'General case' 0 CA--C 1.524 -0.047 0 CA-C-N 120.869 2.334 . . . . 0.0 111.08 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -70.37 -34.72 72.93 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -57.28 -42.66 82.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.825 0.85 . . . . 0.0 108.717 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -67.0 -53.13 34.27 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 118.521 -0.752 . . . . 0.0 109.115 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -52.84 -57.23 10.91 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.162 0.985 . . . . 0.0 111.798 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -57.76 -53.6 56.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.594 0.758 . . . . 0.0 111.683 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -46.81 83.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.946 0.899 . . . . 0.0 112.119 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tt -67.79 -55.5 12.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.809 1.643 . . . . 0.0 111.275 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.26 -48.44 74.0 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 118.505 -0.76 . . . . 0.0 111.548 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.9 mt -61.37 -46.32 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 119.289 0.95 . . . . 0.0 108.913 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.3 tmtt? -55.9 -39.24 71.31 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-O 116.889 -1.529 . . . . 0.0 110.087 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.638 ' HG2' ' HH ' ' B' ' 133' ' ' TYR . 79.0 mt-10 -64.98 -39.5 93.58 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.71 1.141 . . . . 0.0 111.316 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.64 -52.03 66.88 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.787 0.722 . . . . 0.0 110.996 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -70.09 -37.74 75.49 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.183 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -61.77 -54.14 46.47 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-O 117.879 -1.057 . . . . 0.0 109.136 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.43 -38.98 91.52 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.577 1.08 . . . . 0.0 110.566 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.3 ttt -58.05 -32.93 68.48 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.387 0.54 . . . . 0.0 109.8 178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -88.91 -39.37 13.83 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.296 1.038 . . . . 0.0 111.468 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.438 1.095 . . . . 0.0 111.402 -179.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -136.84 75.96 47.87 Favored Pre-proline 0 CA--C 1.535 0.377 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -81.06 48.02 2.76 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 124.378 3.385 . . . . 0.0 112.16 -178.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -145.17 -58.85 0.35 Allowed 'General case' 0 C--O 1.221 -0.44 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.255 -179.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -47.82 -57.21 5.91 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.086 1.354 . . . . 0.0 112.984 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.72 -44.18 77.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 119.19 0.904 . . . . 0.0 112.747 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.8 mm -66.37 -43.62 91.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 124.831 1.252 . . . . 0.0 110.337 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.01 -52.81 63.97 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.208 2.203 . . . . 0.0 108.488 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.9 m -65.18 -39.47 92.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.947 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.08 -46.78 87.4 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 119.974 1.261 . . . . 0.0 108.977 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -48.35 69.26 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.165 0.986 . . . . 0.0 109.258 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -64.04 -55.68 20.5 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.201 1.4 . . . . 0.0 111.531 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -58.33 -38.19 76.64 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.919 1.236 . . . . 0.0 112.346 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -63.37 -51.2 66.86 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.01 -41.24 97.85 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.276 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -50.83 -39.86 54.34 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.919 1.288 . . . . 0.0 112.491 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -57.8 -43.21 85.52 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.586 0.63 . . . . 0.0 110.177 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -75.15 -44.78 44.88 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.93 0.892 . . . . 0.0 109.126 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -51.99 -41.62 62.32 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 126.728 2.011 . . . . 0.0 110.744 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -57.88 -31.16 66.45 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.183 0.993 . . . . 0.0 111.847 179.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.0 mt -93.51 -34.23 13.46 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.597 1.159 . . . . 0.0 111.364 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 25.2 tp -71.79 -54.77 9.12 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.421 1.089 . . . . 0.0 111.052 -179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.5 38.0 0.14 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.061 2.144 . . . . 0.0 112.217 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -61.02 107.04 0.66 Allowed 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -45.88 141.41 3.08 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.348 1.459 . . . . 0.0 111.678 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.3 m -140.89 159.7 41.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.681 1.992 . . . . 0.0 106.09 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 t -83.65 172.65 12.09 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.183 0.447 . . . . 0.0 109.884 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.6 tt -155.74 167.64 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 127.688 2.395 . . . . 0.0 106.424 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -145.06 159.13 43.44 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 125.578 1.551 . . . . 0.0 108.032 179.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--O 1.257 1.489 0 C-N-CA 129.252 3.021 . . . . 0.0 105.46 179.007 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.388 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 72.3 m -144.29 116.01 8.21 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.069 1.348 . . . . 0.0 109.449 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -119.87 13.5 12.3 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 127.091 2.156 . . . . 0.0 111.59 179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -51.78 -47.05 64.34 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.517 1.527 . . . . 0.0 114.312 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -151.5 146.6 26.02 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.206 1.002 . . . . 0.0 109.53 -178.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 5.1 m -156.99 159.52 38.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.688 1.995 . . . . 0.0 106.631 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -101.37 144.84 29.7 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -126.16 159.03 34.02 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.52 0.728 . . . . 0.0 109.802 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.0 mp -139.69 152.28 46.57 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -142.89 98.49 3.29 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.167 1.787 . . . . 0.0 107.968 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.53 150.81 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.496 0.719 . . . . 0.0 111.074 -178.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -116.66 102.77 9.73 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.81 124.36 2.35 Favored Glycine 0 C--N 1.331 0.257 0 N-CA-C 107.564 -2.214 . . . . 0.0 107.564 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -67.62 -58.08 5.3 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 120.481 2.14 . . . . 0.0 110.424 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.9 -40.92 91.96 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 121.533 -0.729 . . . . 0.0 109.579 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -55.27 -50.55 69.22 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.437 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.62 -47.39 86.41 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.671 -178.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -53.86 49.82 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.764 0.793 . . . . 0.0 111.092 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 89.9 mt -61.01 -56.06 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.104 1.761 . . . . 0.0 111.506 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -61.6 -39.53 91.55 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 118.469 -0.777 . . . . 0.0 111.219 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 15.3 ttt -66.96 -52.33 44.2 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.168 0.895 . . . . 0.0 108.873 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -52.32 -52.05 55.26 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.183 0.593 . . . . 0.0 110.466 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.85 -38.38 79.74 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.207 -0.901 . . . . 0.0 112.859 -178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.3 tptp -66.36 -41.84 88.91 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 120.525 1.511 . . . . 0.0 110.232 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.43 -44.36 97.26 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.803 1.241 . . . . 0.0 107.831 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 24.7 t -61.12 -44.9 96.63 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.999 1.32 . . . . 0.0 109.799 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -68.42 -31.83 71.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 117.223 -1.37 . . . . 0.0 110.319 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -60.91 -43.13 99.0 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 121.222 1.828 . . . . 0.0 107.723 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.24 -53.95 41.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.823 0.849 . . . . 0.0 110.373 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 17.2 tpt -62.36 -30.25 71.04 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -77.38 -29.19 53.13 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.921 -1.112 . . . . 0.0 110.032 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.94 -33.45 22.68 Favored 'General case' 0 C--N 1.344 0.349 0 O-C-N 121.241 -0.912 . . . . 0.0 113.34 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -95.83 148.83 35.17 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 126.59 1.956 . . . . 0.0 112.184 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -70.49 -179.54 3.32 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.423 2.082 . . . . 0.0 111.037 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -113.21 46.91 0.35 Allowed Pre-proline 0 CA--C 1.557 1.232 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -64.4 -65.99 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.879 2.386 . . . . 0.0 113.036 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.48 -26.69 68.04 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.298 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.25 -56.74 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.595 1.089 . . . . 0.0 109.092 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -65.91 -31.95 73.17 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.805 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -51.15 43.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.589 -0.72 . . . . 0.0 111.479 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . 0.638 ' HH ' ' HG2' ' A' ' 24' ' ' GLU . 0.2 OUTLIER -66.63 -34.09 77.11 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.744 1.156 . . . . 0.0 109.811 -179.466 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -60.32 -48.65 80.85 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.745 0.818 . . . . 0.0 109.225 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.44 -41.6 65.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 123.048 0.539 . . . . 0.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -58.13 -46.08 86.24 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.928 0.891 . . . . 0.0 109.471 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -76.1 -28.59 57.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.59 0.756 . . . . 0.0 110.084 179.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -61.74 -31.6 71.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.259 0.936 . . . . 0.0 109.12 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -6.52 0.98 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.982 1.313 . . . . 0.0 113.272 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 18.2 tp -88.56 -0.73 57.55 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.018 1.327 . . . . 0.0 109.963 177.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -68.68 172.36 6.44 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 124.963 1.305 . . . . 0.0 112.095 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 . . . . . 0 C--O 1.25 1.096 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 178.452 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.467 0.396 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -55.95 -8.53 0.45 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 128.868 2.867 . . . . 0.0 114.918 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -72.33 0.8 9.07 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.377 1.071 . . . . 0.0 111.17 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -58.17 111.83 1.33 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.997 1.319 . . . . 0.0 108.888 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 24.6 tp -72.42 102.53 3.21 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.123 0.969 . . . . 0.0 109.384 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 59.4 mt -109.42 170.85 7.8 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 124.293 1.037 . . . . 0.0 109.436 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -138.05 152.73 49.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.37 100.04 17.0 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -79.6 115.66 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.567 2.845 . . . . 0.0 110.138 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 78.1 t -144.74 152.11 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 119.649 1.113 . . . . 0.0 110.194 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.15 102.51 5.21 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.17 113.66 0.55 Allowed Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 104.107 -3.597 . . . . 0.0 104.107 179.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -51.13 69.08 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 120.057 1.928 . . . . 0.0 113.048 -177.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -75.34 -34.14 61.16 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.299 1.039 . . . . 0.0 109.358 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 5.5 m -59.28 -50.21 74.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.962 1.305 . . . . 0.0 107.963 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.0 t80 -58.7 -51.21 70.91 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.857 1.663 . . . . 0.0 109.404 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.4 -42.33 99.35 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.49 1.041 . . . . 0.0 112.752 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.0 ttm -60.64 -50.59 72.89 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.76 -44.69 93.74 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.215 1.406 . . . . 0.0 111.569 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.42 -55.75 30.73 Favored 'General case' 0 CA--C 1.512 -0.486 0 C-N-CA 124.322 1.049 . . . . 0.0 111.482 -179.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -41.38 79.29 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.982 0.356 . . . . 0.0 111.543 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 81.2 mt -66.99 -43.18 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 121.655 0.74 . . . . 0.0 110.3 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -66.51 -44.83 81.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 120.794 -1.191 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -62.97 -39.61 95.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 117.997 -1.002 . . . . 0.0 111.169 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 55.4 p -61.18 -50.44 73.13 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.08 0.855 . . . . 0.0 110.409 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -68.82 -42.47 77.2 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.911 -178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.62 -51.0 71.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 42.7 tp -62.25 -43.78 98.05 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.786 0.721 . . . . 0.0 109.744 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 22.3 ttt -57.89 -35.26 70.77 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.642 0.777 . . . . 0.0 111.137 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -79.28 -49.14 12.93 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.311 1.444 . . . . 0.0 111.14 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 24.2 t80 -71.63 -23.87 61.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.749 2.02 . . . . 0.0 113.862 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 8.4 tp -142.12 73.61 21.92 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -76.25 -4.89 15.65 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 124.11 3.206 . . . . 0.0 112.513 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -82.95 -69.73 0.61 Allowed 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 121.361 -0.837 . . . . 0.0 111.308 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -48.16 -52.75 19.35 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 -176.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -50.07 74.3 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 120.978 1.717 . . . . 0.0 111.552 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.8 mm -63.82 -34.99 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -61.19 -53.4 57.43 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.861 0.755 . . . . 0.0 109.005 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 13.2 m -67.33 -35.48 79.5 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.864 -0.522 . . . . 0.0 110.793 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.3 t80 -58.77 -52.68 64.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -37.31 81.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 123.979 0.912 . . . . 0.0 109.728 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -53.5 57.15 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.078 0.951 . . . . 0.0 109.472 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -67.02 -46.08 75.57 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.19 0.996 . . . . 0.0 111.032 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -42.23 85.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.317 1.047 . . . . 0.0 109.21 179.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -65.7 -51.47 59.1 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -52.42 -39.27 60.78 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.338 1.055 . . . . 0.0 113.429 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -55.22 -46.82 75.97 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.362 0.983 . . . . 0.0 109.103 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 73.7 m80 -75.42 -39.36 59.02 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.341 1.056 . . . . 0.0 110.917 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -57.02 -41.75 79.11 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 125.414 1.486 . . . . 0.0 110.319 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 6.8 m170 -58.8 -20.59 51.48 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.198 0.908 . . . . 0.0 111.929 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 3.9 mt -93.91 -48.91 6.06 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 125.127 1.371 . . . . 0.0 109.813 178.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 66.3 tp -65.75 -63.21 1.14 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.018 1.327 . . . . 0.0 111.493 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.51 130.49 39.69 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.543 1.537 . . . . 0.0 107.347 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 12.4 ttpp -151.55 131.05 12.99 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -54.0 140.91 29.83 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 30.6 m -144.24 155.5 43.89 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 105.172 -2.159 . . . . 0.0 105.172 179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.67 169.89 16.45 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.343 0.52 . . . . 0.0 110.832 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 17.0 tt -158.19 166.53 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 128.29 2.636 . . . . 0.0 106.062 179.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -145.27 159.18 43.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.479 1.511 . . . . 0.0 108.174 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 54.2 m . . . . . 0 C--O 1.258 1.505 0 C-N-CA 129.326 3.051 . . . . 0.0 105.496 179.094 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.691 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 3.5 m -144.57 107.68 4.54 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -135.47 92.98 2.9 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 129.996 3.318 . . . . 0.0 104.023 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -138.93 -47.15 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.472 1.109 . . . . 0.0 109.88 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 3.5 t70 -140.46 125.24 18.16 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.04 1.736 . . . . 0.0 106.423 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 8.3 m -146.13 142.06 28.12 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -102.23 142.12 33.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -122.94 151.17 42.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 7.3 mp -128.33 150.06 50.24 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 105.62 -1.992 . . . . 0.0 105.62 178.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tm0? -145.33 98.37 3.14 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 125.897 1.679 . . . . 0.0 106.975 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.83 140.66 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 119.074 0.852 . . . . 0.0 111.573 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -103.91 103.95 13.87 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 105.165 -2.161 . . . . 0.0 105.165 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.16 114.08 0.86 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 104.301 -3.52 . . . . 0.0 104.301 178.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -61.95 -57.52 11.4 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.491 2.145 . . . . 0.0 111.901 -178.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mttp -72.22 -35.52 68.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.494 -0.754 . . . . 0.0 109.081 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.16 -51.32 69.79 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.013 -0.994 . . . . 0.0 111.035 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.8 t80 -66.71 -43.24 84.82 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.429 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.76 -54.0 40.09 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.407 1.003 . . . . 0.0 111.817 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.06 -54.07 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 125.614 1.565 . . . . 0.0 111.657 -178.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -37.54 87.68 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 117.719 -1.134 . . . . 0.0 111.873 -178.084 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 15.1 ttt -65.3 -51.26 61.83 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -52.32 -51.74 57.01 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 123.454 0.702 . . . . 0.0 109.664 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 68.1 mt -65.23 -36.54 84.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.397 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.6 tptp -64.98 -48.4 74.16 Favored 'General case' 0 C--O 1.228 -0.079 0 CA-C-N 120.123 1.328 . . . . 0.0 109.449 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -59.02 -46.6 87.8 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.96 1.304 . . . . 0.0 108.047 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 40.7 t -57.09 -45.95 82.96 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.53 1.132 . . . . 0.0 109.97 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 2.6 mm? -70.89 -30.52 66.9 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.578 -1.201 . . . . 0.0 111.059 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -62.88 -42.6 99.83 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 121.529 1.968 . . . . 0.0 107.982 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -54.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.105 0.962 . . . . 0.0 109.567 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 13.7 tpt -60.12 -30.09 69.05 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.307 0.643 . . . . 0.0 112.711 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -76.38 -35.45 58.64 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 119.084 0.856 . . . . 0.0 110.207 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.21 -31.71 33.81 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.801 1.038 . . . . 0.0 113.801 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.2 t -94.61 147.93 34.04 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 125.378 1.471 . . . . 0.0 112.934 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -67.31 -173.09 0.4 Allowed 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 123.674 2.916 . . . . 0.0 110.818 178.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -122.92 43.48 0.76 Allowed Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -65.62 -47.16 4.31 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.106 1.871 . . . . 0.0 113.09 -178.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 26.0 tp -68.89 -39.7 79.59 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 119.372 0.987 . . . . 0.0 109.217 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -59.26 -50.41 79.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.39 0 CA-C-O 117.377 -1.296 . . . . 0.0 109.722 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -55.09 -51.56 65.99 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.343 1.429 . . . . 0.0 109.758 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 5.3 t -57.26 -49.88 74.66 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.161 1.384 . . . . 0.0 111.549 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.6 t80 -68.95 -41.95 77.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.336 1.455 . . . . 0.0 112.041 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 10.1 tmm_? -53.3 -47.5 69.19 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.087 1.355 . . . . 0.0 109.885 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -70.82 -53.93 13.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.125 0.97 . . . . 0.0 110.125 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -51.48 -47.27 63.26 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.656 0.782 . . . . 0.0 112.658 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -73.57 -31.62 63.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.313 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -61.81 -34.02 75.17 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.674 1.124 . . . . 0.0 109.687 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.13 -14.68 1.74 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 48.7 tp -73.17 -7.33 50.93 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.8 1.64 . . . . 0.0 111.14 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -63.49 166.71 6.31 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.654 1.581 . . . . 0.0 111.069 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 90.6 mtt-85 . . . . . 0 C--O 1.241 0.647 0 N-CA-C 102.408 -3.182 . . . . 0.0 102.408 178.859 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 66.5 m . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 120.779 0.323 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -74.61 -18.99 60.47 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 126.422 1.889 . . . . 0.0 112.265 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -70.17 10.31 0.45 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.892 2.077 . . . . 0.0 115.85 -177.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -87.56 96.49 10.42 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 178.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.01 108.65 1.26 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.589 0.631 . . . . 0.0 110.272 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.78 168.33 10.56 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.43 1.109 . . . . 0.0 109.643 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -135.99 142.3 44.49 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.384 1.873 . . . . 0.0 106.999 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 39.3 tp -130.5 96.04 25.2 Favored Pre-proline 0 CA--C 1.539 0.527 0 C-N-CA 123.989 0.916 . . . . 0.0 108.747 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.46 116.76 3.62 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.537 2.825 . . . . 0.0 108.799 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.9 t -145.48 160.83 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.885 1.674 . . . . 0.0 109.804 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -134.4 105.02 6.37 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.9 104.88 0.23 Allowed Glycine 0 C--O 1.227 -0.334 0 N-CA-C 106.403 -2.679 . . . . 0.0 106.403 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -64.24 -52.96 56.18 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 121.196 2.498 . . . . 0.0 113.021 -177.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.91 -30.71 69.24 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.47 -0.769 . . . . 0.0 110.864 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -43.34 81.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 126.115 1.766 . . . . 0.0 109.299 -179.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -61.85 -49.05 77.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.138 0.975 . . . . 0.0 108.533 178.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -60.61 -43.14 97.78 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.744 0.247 . . . . 0.0 111.423 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 8.8 tmm? -63.73 -49.95 71.05 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.841 0.857 . . . . 0.0 110.359 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 mp -61.65 -52.24 65.15 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.191 -0.909 . . . . 0.0 112.179 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -42.14 94.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.463 1.029 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -59.94 -48.61 81.0 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.205 0.526 . . . . 0.0 110.48 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.3 mt -73.62 -32.15 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.021 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -59.23 -57.54 12.57 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -36.54 73.05 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 117.054 -1.45 . . . . 0.0 109.309 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 p -55.8 -48.0 76.15 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.285 1.402 . . . . 0.0 111.327 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -42.37 62.48 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.306 1.842 . . . . 0.0 113.716 -178.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -68.88 -52.47 29.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.609 -0.682 . . . . 0.0 109.988 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.94 -39.57 92.53 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.607 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.25 66.37 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.083 0.856 . . . . 0.0 109.703 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.02 -23.99 66.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.66 -23.46 29.45 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.446 1.099 . . . . 0.0 111.523 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp -132.93 67.42 77.81 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 127.776 2.431 . . . . 0.0 105.909 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -76.71 46.4 1.87 Allowed 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 124.603 3.536 . . . . 0.0 112.151 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -48.7 154.14 0.72 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.97 1.308 . . . . 0.0 112.577 -179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -50.99 -28.08 9.15 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.97 0.908 . . . . 0.0 113.296 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.7 m -56.91 -50.03 73.79 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.555 1.07 . . . . 0.0 108.952 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.8 mt -65.78 -53.64 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 126.108 1.763 . . . . 0.0 108.826 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -52.43 -53.3 47.13 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.202 1.001 . . . . 0.0 111.721 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.1 m -64.83 -47.06 79.36 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.887 0.875 . . . . 0.0 110.494 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -61.35 -41.39 96.98 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 118.965 0.802 . . . . 0.0 111.28 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -60.37 -48.55 81.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.441 1.019 . . . . 0.0 110.171 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.79 -46.04 89.84 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 123.176 0.59 . . . . 0.0 110.083 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -62.02 -47.65 83.81 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 124.451 1.1 . . . . 0.0 110.821 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -54.88 -44.52 74.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.556 1.142 . . . . 0.0 110.512 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -57.4 -50.78 71.91 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.43 -45.52 92.71 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 117.86 0.3 . . . . 0.0 111.268 179.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -55.26 -32.03 62.03 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.295 1.438 . . . . 0.0 111.919 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -60.12 -27.92 67.43 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.788 1.176 . . . . 0.0 110.826 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -70.39 -41.92 72.41 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 120.173 -1.579 . . . . 0.0 109.208 177.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -85.24 13.39 6.48 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.543 1.937 . . . . 0.0 112.615 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.3 tt -52.67 -32.1 40.66 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.016 1.327 . . . . 0.0 113.287 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.43 -67.11 0.45 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.629 0.772 . . . . 0.0 110.795 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 57.34 -171.05 0.1 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.028 1.331 . . . . 0.0 109.555 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.2 tptp -139.93 74.34 1.46 Allowed 'General case' 0 C--N 1.338 0.105 0 O-C-N 120.406 -1.434 . . . . 0.0 109.412 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -95.76 174.3 7.04 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 124.262 1.025 . . . . 0.0 110.118 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.8 t -163.88 110.6 1.1 Allowed 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 177.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.6 m -135.27 159.91 40.06 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.671 0.788 . . . . 0.0 110.025 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.3 tt -152.95 -5.66 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.8 mp0 -83.69 159.61 21.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.814 1.188 . . . . 0.0 110.646 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 C--O 1.256 1.398 0 C-N-CA 128.496 2.718 . . . . 0.0 106.189 178.131 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.525 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 12.6 m -74.25 166.95 22.58 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.716 0.77 . . . . 0.0 110.091 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -157.21 101.6 1.91 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.977 1.311 . . . . 0.0 108.438 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -139.05 -11.38 1.27 Allowed 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.877 1.271 . . . . 0.0 112.079 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -88.23 147.22 24.95 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 7.1 m -139.94 145.1 37.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.03 129.91 48.46 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -104.31 159.41 15.73 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.841 1.656 . . . . 0.0 109.466 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.9 mt -149.12 142.51 25.23 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.871 1.668 . . . . 0.0 107.831 179.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -146.03 108.21 4.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.5 m -154.51 150.18 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.106 1.362 . . . . 0.0 109.488 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.87 101.57 8.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.225 1.375 . . . . 0.0 108.916 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.0 115.85 0.88 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-O 115.887 -2.618 . . . . 0.0 109.918 178.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -65.24 -56.91 10.09 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 122.364 3.082 . . . . 0.0 111.023 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -63.55 -47.75 80.3 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 -52.64 -48.81 66.17 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.326 -0.845 . . . . 0.0 111.349 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.94 -43.74 94.93 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.954 1.252 . . . . 0.0 112.074 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.48 -48.82 79.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.863 1.21 . . . . 0.0 110.332 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 85.0 mt -61.23 -53.71 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 124.43 1.092 . . . . 0.0 110.757 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.66 -31.69 73.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 117.911 -1.042 . . . . 0.0 111.601 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 16.2 mtp -64.41 -52.38 58.42 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.265 1.393 . . . . 0.0 109.468 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -58.14 -43.23 87.18 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.6 mt -63.2 -50.67 69.38 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.419 0.688 . . . . 0.0 111.941 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . 0.443 ' O ' ' HE2' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -69.69 -50.84 39.96 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 119.447 1.021 . . . . 0.0 112.669 -178.52 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -56.64 -46.78 80.81 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 118.909 0.777 . . . . 0.0 110.443 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.8 t -64.21 -36.17 83.18 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.721 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -69.83 -43.31 72.26 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -60.25 -33.98 73.06 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.898 1.226 . . . . 0.0 109.784 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -73.15 -44.05 60.62 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.2 tpt -63.98 -25.77 68.28 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.465 1.106 . . . . 0.0 109.7 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.5 -46.32 17.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.665 1.986 . . . . 0.0 109.606 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -75.4 -32.33 60.72 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.098 0.863 . . . . 0.0 113.118 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -91.63 147.85 36.06 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.46 -176.8 1.52 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.367 2.045 . . . . 0.0 110.429 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.96 56.58 0.37 Allowed Pre-proline 0 CA--C 1.551 1.006 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.36 -74.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.263 2.642 . . . . 0.0 113.109 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.8 tt -56.12 -44.35 79.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 25.5 t -50.97 -53.79 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 126.959 2.104 . . . . 0.0 112.103 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.52 -42.66 91.75 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.307 0.958 . . . . 0.0 111.421 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 29.5 m -64.39 -44.34 91.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.464 0.575 . . . . 0.0 109.727 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -56.92 -51.93 67.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.829 1.652 . . . . 0.0 108.78 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -54.18 -46.96 72.51 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 117.48 -1.248 . . . . 0.0 111.245 -178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -68.56 -49.83 56.46 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 120.997 1.726 . . . . 0.0 112.086 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -56.98 -37.67 71.95 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.837 0.455 . . . . 0.0 110.975 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -77.57 -41.98 36.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 110.051 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -54.23 -32.52 56.14 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.912 1.233 . . . . 0.0 110.442 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.28 -19.64 55.74 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.854 -0.529 . . . . 0.0 111.828 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.3 tt -70.05 -29.05 65.98 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 120.727 -1.233 . . . . 0.0 110.308 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.45 91.85 6.01 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.787 1.635 . . . . 0.0 107.916 -179.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? . . . . . 0 C--O 1.247 0.936 0 C-N-CA 127.908 2.483 . . . . 0.0 109.493 -179.099 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 16.9 m . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 120.787 0.327 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 8.5 t0 -103.33 -2.52 26.95 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.209 1.404 . . . . 0.0 112.561 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.44 -12.13 60.18 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.539 0.736 . . . . 0.0 112.224 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.94 98.78 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.725 1.61 . . . . 0.0 112.508 -178.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.0 tt -68.05 120.08 13.69 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.34 167.55 10.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 123.373 1.558 . . . . 0.0 109.702 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -136.12 148.01 48.04 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 126.905 2.082 . . . . 0.0 106.287 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 9.0 tp -137.11 94.57 12.43 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.38 111.17 3.22 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.209 3.273 . . . . 0.0 109.035 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 54.0 t -145.35 156.01 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -135.65 105.04 6.01 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.132 -0.98 . . . . 0.0 109.869 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.7 114.96 0.6 Allowed Glycine 0 CA--C 1.529 0.919 0 N-CA-C 106.503 -2.639 . . . . 0.0 106.503 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -67.86 -50.68 55.16 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 122.73 3.265 . . . . 0.0 111.086 -179.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -41.49 85.86 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -48.72 79.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 124.518 1.127 . . . . 0.0 110.055 -179.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 55.0 t80 -57.26 -54.74 43.38 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.921 0.889 . . . . 0.0 110.864 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -62.57 -37.52 86.5 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 12.0 tmm? -66.14 -49.8 66.19 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.627 -0.671 . . . . 0.0 109.444 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.21 -45.2 93.99 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.494 0.717 . . . . 0.0 110.308 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -61.69 -54.37 43.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.022 0.929 . . . . 0.0 111.327 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -54.97 -48.37 73.33 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.809 0.844 . . . . 0.0 111.238 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 96.7 mt -71.46 -40.59 72.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 119.113 -0.47 . . . . 0.0 111.011 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -47.4 85.83 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 119.532 1.06 . . . . 0.0 108.16 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.03 -46.39 85.41 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.517 1.136 . . . . 0.0 108.754 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 34.1 p -54.39 -50.06 68.41 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 118.398 0.544 . . . . 0.0 111.656 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -46.47 89.14 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 122.114 0.959 . . . . 0.0 111.57 -178.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -52.64 64.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.834 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.86 -48.56 71.17 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.154 1.781 . . . . 0.0 112.937 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -41.38 63.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.845 1.658 . . . . 0.0 109.185 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -87.72 -25.09 23.63 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 118.16 -0.924 . . . . 0.0 111.671 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -75.69 -23.04 56.15 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.89 1.677 . . . . 0.0 111.15 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 39.5 tp -126.8 70.87 73.73 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 125.837 1.655 . . . . 0.0 106.907 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -75.97 73.83 4.72 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 123.117 2.545 . . . . 0.0 111.25 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -77.69 163.72 25.93 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 124.39 1.076 . . . . 0.0 109.957 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 50.7 m170 -64.07 -26.57 68.61 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.699 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 3.0 m -56.63 -47.44 79.67 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.2 mt -69.58 -49.94 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 C-N-CA 126.534 1.933 . . . . 0.0 109.783 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -55.02 -54.45 42.87 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.809 0.844 . . . . 0.0 111.252 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.9 m -59.92 -46.09 90.48 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.336 0.655 . . . . 0.0 109.741 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 23.0 t80 -59.1 -45.3 91.21 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.632 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -48.82 80.1 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.654 0.782 . . . . 0.0 110.435 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -44.03 91.54 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 121.876 -0.515 . . . . 0.0 110.541 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -64.44 -42.44 95.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.539 -0.743 . . . . 0.0 110.727 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -60.74 -35.19 75.74 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.644 1.178 . . . . 0.0 110.744 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -64.95 -54.42 30.92 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.25 -41.45 99.06 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.4 -0.188 . . . . 0.0 110.629 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -52.72 -35.15 55.35 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.172 1.389 . . . . 0.0 111.66 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 1.3 t60 -58.25 -33.77 69.73 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 120.131 1.332 . . . . 0.0 110.354 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -70.72 -34.85 72.34 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 120.931 -1.106 . . . . 0.0 111.215 178.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -93.02 -0.86 57.07 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.498 1.919 . . . . 0.0 114.378 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 7.9 tt -44.98 -29.64 0.87 Allowed 'General case' 0 C--O 1.234 0.245 0 C-N-CA 130.021 3.328 . . . . 0.0 116.303 -177.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 6.6 mp -59.37 -54.1 50.57 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 118.835 0.743 . . . . 0.0 112.003 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 6.2 tt0 58.43 -173.41 0.09 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.32 1.048 . . . . 0.0 109.066 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 6.2 tptt -136.64 35.77 2.67 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.064 -1.648 . . . . 0.0 109.404 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -58.36 158.33 7.49 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 126.243 1.817 . . . . 0.0 113.632 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 2.7 t -158.42 94.51 1.28 Allowed 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 105.888 -1.893 . . . . 0.0 105.888 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 68.8 m -134.92 135.42 41.54 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 14.2 tt -142.68 15.5 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 124.397 1.079 . . . . 0.0 111.572 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -114.81 159.65 20.37 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.865 1.266 . . . . 0.0 110.368 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 55.0 m . . . . . 0 C--O 1.255 1.374 0 C-N-CA 127.791 2.436 . . . . 0.0 106.322 179.029 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.105 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 18.3 m -75.96 163.23 27.38 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 126.146 1.778 . . . . 0.0 111.161 -178.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 31.8 t70 -151.32 94.74 2.06 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.683 0.793 . . . . 0.0 110.456 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -139.15 25.82 2.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 127.542 2.337 . . . . 0.0 109.143 -179.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 15.6 t70 -139.66 139.99 36.79 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.868 1.667 . . . . 0.0 107.402 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 65.6 m -139.98 156.56 46.58 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.201 1.4 . . . . 0.0 107.727 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -111.09 140.69 45.43 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.845 0.831 . . . . 0.0 108.78 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.56 159.71 31.39 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.474 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.9 mt -146.23 146.95 30.97 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 177.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -143.63 112.84 6.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 17.4 m -155.47 151.33 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 C-N-CA 125.806 1.642 . . . . 0.0 109.258 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 102.19 11.73 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.71 108.97 0.53 Allowed Glycine 0 C--N 1.335 0.499 0 CA-C-O 117.043 -1.976 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -58.02 9.01 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 121.425 2.613 . . . . 0.0 112.573 -179.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -71.16 -42.77 68.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.575 -0.703 . . . . 0.0 109.144 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -54.05 -49.29 69.32 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.596 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 78.1 t80 -62.31 -44.65 96.01 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.335 0.97 . . . . 0.0 110.901 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.7 -45.31 94.67 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.836 0.744 . . . . 0.0 112.4 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.9 mt -66.97 -50.9 60.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.768 1.627 . . . . 0.0 109.457 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.59 -36.94 82.11 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 118.257 -0.878 . . . . 0.0 109.985 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 22.7 mtp -60.59 -52.55 64.7 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 119.464 1.029 . . . . 0.0 109.162 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -60.77 -42.01 96.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.486 -0.769 . . . . 0.0 111.229 -179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.1 mt -66.25 -46.61 76.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.601 0.637 . . . . 0.0 111.911 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.8 tptt -69.3 -54.04 16.63 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 117.122 -1.418 . . . . 0.0 111.328 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -53.17 -47.59 68.69 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 108.376 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 30.9 t -55.15 -54.28 45.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.334 0.654 . . . . 0.0 110.43 179.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -30.76 71.79 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 118.86 -0.591 . . . . 0.0 110.741 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.27 -49.07 79.07 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 120.075 1.307 . . . . 0.0 108.093 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.59 -41.18 80.0 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.124 -0.941 . . . . 0.0 108.525 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.8 tpt -64.37 -20.9 66.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.702 1.137 . . . . 0.0 111.402 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -83.12 -37.36 23.87 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.151 0.98 . . . . 0.0 108.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.22 -32.82 17.24 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 67.1 t -89.84 141.16 28.03 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 126.16 1.784 . . . . 0.0 109.35 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.78 177.25 5.07 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 123.332 2.688 . . . . 0.0 112.28 179.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -111.31 53.2 0.36 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.81 -70.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.482 2.121 . . . . 0.0 112.666 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.39 -39.07 82.21 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.5 t -52.16 -56.34 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.033 1.733 . . . . 0.0 110.654 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.43 -44.02 75.87 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.516 1.053 . . . . 0.0 111.84 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 36.8 m -57.13 -42.15 80.37 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 47.7 t80 -69.82 -44.37 70.11 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.651 1.581 . . . . 0.0 109.012 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -54.5 -48.83 71.4 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 117.911 -1.043 . . . . 0.0 110.362 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -66.48 -53.9 29.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.952 0.796 . . . . 0.0 110.992 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -54.86 -38.83 67.96 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.779 0.832 . . . . 0.0 113.203 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.47 -37.39 31.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.422 0.689 . . . . 0.0 109.966 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -57.74 -38.05 74.65 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.667 0.667 . . . . 0.0 110.049 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.4 mt -59.48 -15.23 16.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.895 0.878 . . . . 0.0 113.194 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -78.45 -16.93 57.03 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.171 0.988 . . . . 0.0 110.365 178.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.54 106.17 13.96 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.773 1.629 . . . . 0.0 108.194 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? . . . . . 0 C--O 1.246 0.896 0 CA-C-O 115.639 -2.124 . . . . 0.0 109.228 -179.263 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.466 0.357 0 CA-C-O 120.805 0.336 . . . . 0.0 111.449 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.79 -60.6 2.15 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 178.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -138.28 -51.63 0.59 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -174.25 112.97 0.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 103.768 -2.678 . . . . 0.0 103.768 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.12 101.08 0.26 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.188 0.995 . . . . 0.0 109.895 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mp -92.74 173.73 7.62 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -133.35 120.31 20.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.11 0.964 . . . . 0.0 108.902 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.6 tp -104.22 101.21 25.2 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 124.178 0.991 . . . . 0.0 109.442 179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -80.8 118.92 3.52 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.312 2.675 . . . . 0.0 110.248 178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -144.64 156.49 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 125.483 1.513 . . . . 0.0 107.03 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.6 103.67 5.53 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.082 -1.011 . . . . 0.0 109.497 178.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.11 125.19 1.29 Allowed Glycine 0 C--O 1.226 -0.349 0 N-CA-C 106.013 -2.835 . . . . 0.0 106.013 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -51.26 59.79 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 121.129 2.465 . . . . 0.0 109.642 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -72.63 -30.77 64.6 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.211 1.004 . . . . 0.0 110.559 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 m -66.83 -51.56 54.14 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.297 1.439 . . . . 0.0 109.277 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -63.69 -50.37 69.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.478 0.711 . . . . 0.0 109.774 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -57.99 -57.54 12.38 Favored 'General case' 0 C--O 1.231 0.1 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -63.16 -39.29 94.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.697 0.681 . . . . 0.0 112.751 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.2 mt -72.85 -35.1 67.16 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 118.134 -0.936 . . . . 0.0 111.125 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -69.71 -41.47 75.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.095 1.316 . . . . 0.0 107.765 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -56.38 -48.75 76.22 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.473 1.109 . . . . 0.0 109.713 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.69 -46.76 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.482 0.713 . . . . 0.0 109.983 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -53.94 -50.18 67.02 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 124.003 0.921 . . . . 0.0 110.103 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -71.57 -42.89 67.25 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.77 -1.11 . . . . 0.0 111.623 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.8 t -53.7 -51.48 63.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.573 1.078 . . . . 0.0 108.79 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.47 -56.91 14.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 124.695 1.247 . . . . 0.0 110.553 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -56.24 -43.24 78.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.972 0.806 . . . . 0.0 112.58 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.62 -43.91 75.34 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.85 1.204 . . . . 0.0 110.454 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.54 -38.5 84.69 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.029 0.932 . . . . 0.0 109.258 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.99 -37.72 84.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.689 1.196 . . . . 0.0 110.214 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -79.72 -24.04 41.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.556 1.142 . . . . 0.0 112.92 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 27.6 tp -122.09 65.85 21.74 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 120.297 1.408 . . . . 0.0 112.439 -178.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.97 144.55 34.43 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.246 1.964 . . . . 0.0 109.167 178.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.32 172.12 19.18 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.308 1.843 . . . . 0.0 107.184 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -48.35 -47.89 36.83 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 125.123 1.369 . . . . 0.0 114.159 -178.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.0 m -55.83 -43.84 77.35 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.104 1.32 . . . . 0.0 110.808 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.07 -55.03 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.039 1.335 . . . . 0.0 109.594 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.3 -42.85 99.36 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 m -65.72 -31.9 73.16 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -49.98 70.43 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 178.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -55.87 -48.5 75.44 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.003 0.921 . . . . 0.0 109.862 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -64.07 -41.81 97.21 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.63 0.772 . . . . 0.0 111.24 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.332 -0.162 0 O-C-N 121.137 -0.977 . . . . 0.0 110.66 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -66.5 -35.53 80.48 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -69.76 -31.22 69.05 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.532 1.133 . . . . 0.0 111.525 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -56.2 -37.36 69.53 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 111.979 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -54.12 -29.74 46.06 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.325 0.65 . . . . 0.0 111.297 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -54.61 -26.19 31.19 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.957 1.703 . . . . 0.0 111.678 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -70.57 -59.8 2.63 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -58.97 -36.41 74.8 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.26 1.024 . . . . 0.0 110.469 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -55.73 -24.41 34.73 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.954 2.102 . . . . 0.0 112.322 178.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 tp -62.25 -34.96 77.52 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.978 0.511 . . . . 0.0 111.494 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -55.06 114.85 1.92 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 124.257 1.023 . . . . 0.0 109.535 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -70.8 -26.24 63.22 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.119 0.968 . . . . 0.0 112.708 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -70.45 -165.37 0.1 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.887 0.875 . . . . 0.0 109.61 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 m 71.68 -22.68 0.2 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.041 1.736 . . . . 0.0 114.255 178.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.5 t -97.6 112.37 24.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.708 1.14 . . . . 0.0 111.231 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.4 tt -161.62 -15.3 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 126.451 1.901 . . . . 0.0 111.526 178.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 44.2 mm-40 -146.66 151.52 37.37 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 128.441 2.696 . . . . 0.0 105.985 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.0 m . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.484 -1.246 . . . . 0.0 107.69 179.022 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.091 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.5 t -81.59 -95.93 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -125.36 -11.95 6.84 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.834 0.854 . . . . 0.0 111.642 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -92.01 -18.82 23.1 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 125.252 1.421 . . . . 0.0 110.409 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 39.91 67.85 0.44 Allowed 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 128.718 2.807 . . . . 0.0 111.397 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m -57.51 138.43 55.15 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.401 1.08 . . . . 0.0 109.116 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -102.02 137.02 40.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.626 1.171 . . . . 0.0 108.901 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -114.15 149.83 35.08 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.931 1.693 . . . . 0.0 108.466 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mt -144.91 145.87 31.76 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.126 1.37 . . . . 0.0 108.041 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -151.73 110.76 3.88 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.413 0.685 . . . . 0.0 111.514 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -154.02 150.87 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.246 1.818 . . . . 0.0 107.704 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 24.2 ptt85 -99.18 101.86 13.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.79 1.177 . . . . 0.0 110.092 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.35 114.55 0.81 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 116.128 -2.484 . . . . 0.0 113.323 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 tpp85 -67.35 -56.77 8.37 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 122.751 3.275 . . . . 0.0 111.052 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -64.99 -50.62 65.61 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.996 1.718 . . . . 0.0 108.503 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -47.35 64.73 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.743 2.817 . . . . 0.0 109.393 -178.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -66.64 -47.39 72.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.157 0.89 . . . . 0.0 111.187 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -57.04 -43.08 81.61 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.342 0.973 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 60.2 mt -61.25 -54.69 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.813 1.245 . . . . 0.0 107.727 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.81 -37.36 76.21 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 117.871 -1.061 . . . . 0.0 112.524 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 60.0 mtp -65.44 -54.23 31.52 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 119.921 1.237 . . . . 0.0 111.298 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 13.9 ptpt -61.85 -43.0 99.72 Favored 'General case' 0 C--N 1.34 0.175 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.74 -51.48 58.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.427 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -54.84 -58.86 5.87 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.466 0.707 . . . . 0.0 110.672 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -52.68 -49.22 65.73 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.659 1.984 . . . . 0.0 111.432 -179.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 12.4 t -62.07 -43.58 98.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.086 0.403 . . . . 0.0 110.987 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 11.7 tp -62.98 -40.15 96.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.587 -0.721 . . . . 0.0 109.149 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -47.06 86.91 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -59.35 -52.3 66.22 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.717 0.807 . . . . 0.0 111.692 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 8.0 tmm? -62.73 -28.22 69.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.678 0.791 . . . . 0.0 111.349 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.78 -22.18 22.27 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.302 1.441 . . . . 0.0 113.214 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.93 -33.73 17.16 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.39 1.45 . . . . 0.0 111.145 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 3.7 t -94.94 147.5 33.17 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -65.79 -170.83 0.19 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.604 2.869 . . . . 0.0 111.182 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -112.19 78.0 2.32 Favored Pre-proline 0 CA--C 1.544 0.738 0 O-C-N 120.214 -1.554 . . . . 0.0 113.226 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -77.97 -97.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.73 2.953 . . . . 0.0 112.483 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.1 tt -55.76 -40.73 72.98 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.744 1.218 . . . . 0.0 109.881 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -53.37 -46.11 57.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.48 1.112 . . . . 0.0 111.238 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.15 -42.05 73.03 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 121.1 -1.0 . . . . 0.0 110.36 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.5 t -57.83 -46.62 84.47 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -67.29 -39.48 85.98 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.623 1.569 . . . . 0.0 111.11 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -47.8 70.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 119.311 0.96 . . . . 0.0 109.024 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.44 -50.96 61.61 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -51.22 -44.15 61.59 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.309 1.043 . . . . 0.0 112.422 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.1 tm0? -76.59 -40.68 48.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.85 0.86 . . . . 0.0 110.666 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -53.64 -34.84 59.96 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.885 0.874 . . . . 0.0 111.435 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.02 -10.21 3.98 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.1 tt -93.14 -22.25 19.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.439 1.895 . . . . 0.0 109.94 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -83.82 177.04 8.51 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 120.261 -1.525 . . . . 0.0 110.006 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 127.362 2.265 . . . . 0.0 105.909 179.483 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.463 0.214 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 4.0 t70 -69.9 -59.09 3.14 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 178.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 10.6 t70 -142.17 -53.25 0.42 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.824 0.675 . . . . 0.0 112.824 177.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -176.86 124.47 0.15 Allowed 'General case' 0 CA--C 1.523 -0.08 0 C-N-CA 126.525 1.93 . . . . 0.0 106.868 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 5.0 tp -61.49 105.08 0.48 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.0 1.32 . . . . 0.0 111.366 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 14.4 mt -93.36 133.73 36.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -103.45 103.34 13.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.937 1.295 . . . . 0.0 107.824 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.6 tp -97.79 111.8 59.89 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 117.609 -1.186 . . . . 0.0 110.586 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -81.89 115.74 2.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.504 2.803 . . . . 0.0 111.686 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 37.6 t -143.88 148.97 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 120.039 1.291 . . . . 0.0 109.357 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.42 102.74 5.05 Favored 'General case' 0 C--N 1.346 0.428 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.06 136.36 4.06 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-O 115.104 -3.053 . . . . 0.0 105.475 176.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -53.46 14.69 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 122.991 3.396 . . . . 0.0 106.96 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.62 -30.23 66.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 2.4 m -66.58 -52.23 47.73 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.14 0.882 . . . . 0.0 108.947 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.48 -52.65 62.65 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -57.27 -56.54 20.53 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 124.025 0.93 . . . . 0.0 112.829 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ttm -60.53 -34.8 74.64 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.165 1.348 . . . . 0.0 112.045 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.1 mt -68.66 -53.06 24.73 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -50.09 74.85 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 124.131 0.972 . . . . 0.0 111.523 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -55.59 -48.45 74.82 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.885 1.274 . . . . 0.0 110.243 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 54.7 mt -70.09 -37.25 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 121.695 -0.628 . . . . 0.0 109.963 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -62.64 -51.64 66.47 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.247 1.019 . . . . 0.0 110.791 179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.63 -36.99 76.63 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.368 1.067 . . . . 0.0 108.617 -178.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 42.4 t -56.5 -48.6 76.83 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.829 1.195 . . . . 0.0 107.854 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tm? -67.55 -54.05 23.18 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.479 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.26 -52.26 63.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.692 0.678 . . . . 0.0 112.644 -178.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 85.3 mt -64.9 -47.7 76.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.233 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -57.59 -41.7 81.69 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.38 -33.46 74.3 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.085 -1.01 . . . . 0.0 110.004 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -72.16 -18.61 61.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.072 0.949 . . . . 0.0 109.766 178.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 45.6 tp -128.3 70.46 79.15 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.842 1.257 . . . . 0.0 109.11 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -80.18 142.04 14.96 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.384 2.056 . . . . 0.0 108.371 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -162.01 172.62 15.64 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.031 1.732 . . . . 0.0 108.078 -179.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -50.16 -34.54 22.75 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 116.087 -1.911 . . . . 0.0 114.171 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 85.5 m -57.64 -45.2 85.76 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 122.29 2.314 . . . . 0.0 109.534 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.86 -54.59 32.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 C-N-CA 125.297 1.439 . . . . 0.0 108.623 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.31 -33.88 73.0 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 51.5 m -69.92 -52.56 23.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -47.3 76.9 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.699 0.682 . . . . 0.0 110.397 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -61.42 -49.36 77.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.626 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -68.97 -29.28 67.47 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 118.943 0.792 . . . . 0.0 112.939 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -66.97 -35.69 80.52 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.324 0.965 . . . . 0.0 108.584 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -78.61 -40.93 33.07 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -54.81 -40.93 70.01 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.803 1.241 . . . . 0.0 110.357 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -53.51 -35.3 60.51 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.047 1.339 . . . . 0.0 112.193 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -55.09 -28.65 54.04 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.79 1.236 . . . . 0.0 111.178 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -50.67 -29.91 12.34 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.76 1.224 . . . . 0.0 111.414 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -64.13 -56.73 12.78 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.013 0.925 . . . . 0.0 109.014 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 30.6 m170 -64.9 -34.9 79.49 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.263 0.625 . . . . 0.0 109.681 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.4 -28.34 69.18 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.18 0.992 . . . . 0.0 111.218 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 11.2 tp -57.39 -31.8 66.18 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.498 0.719 . . . . 0.0 110.747 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -59.96 154.01 19.89 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.771 1.629 . . . . 0.0 110.529 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -114.87 -25.04 8.37 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.52 1.128 . . . . 0.0 111.983 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -68.54 174.79 3.87 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.652 0.739 . . . . 0.0 110.822 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 27.7 m 67.51 -13.56 0.23 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.631 1.972 . . . . 0.0 115.149 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 8.0 t -87.3 85.26 7.16 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 120.46 1.482 . . . . 0.0 108.427 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 17.9 tt -141.93 -19.71 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -125.61 158.98 33.32 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 125.372 1.469 . . . . 0.0 108.993 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 3.8 t . . . . . 0 C--O 1.247 0.973 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 -179.447 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.244 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 3.8 t -69.44 -51.12 39.25 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 14.6 t70 -154.75 -40.02 0.09 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.512 0.725 . . . . 0.0 111.876 -179.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -68.92 -16.07 63.65 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 117.251 -1.356 . . . . 0.0 114.479 -178.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 7.2 m-20 38.54 77.93 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 128.622 2.769 . . . . 0.0 111.966 -179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 30.1 m -62.05 152.27 33.07 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 125.414 1.486 . . . . 0.0 110.805 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -107.83 130.28 55.0 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.127 0.971 . . . . 0.0 110.913 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -109.96 144.02 39.08 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 127.584 2.354 . . . . 0.0 107.636 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 12.5 mt -140.98 143.48 34.51 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.267 1.427 . . . . 0.0 109.211 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -145.37 110.32 5.16 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.773 1.229 . . . . 0.0 110.21 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 26.2 t -151.11 151.27 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.492 1.517 . . . . 0.0 110.316 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -110.9 101.89 10.43 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 120.346 1.43 . . . . 0.0 107.312 176.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.55 108.93 0.51 Allowed Glycine 0 CA--C 1.521 0.451 0 CA-C-O 116.607 -2.219 . . . . 0.0 109.649 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -59.91 -58.2 9.58 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 121.697 2.749 . . . . 0.0 115.434 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.76 -47.47 66.15 Favored 'General case' 0 CA--C 1.508 -0.649 0 O-C-N 121.124 -0.985 . . . . 0.0 108.927 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -53.96 -43.4 69.87 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.998 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.6 t80 -66.12 -49.22 68.26 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.377 0.99 . . . . 0.0 110.886 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -52.76 -49.64 65.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.877 0.846 . . . . 0.0 110.625 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 64.4 mt -57.8 -53.78 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 126.058 1.743 . . . . 0.0 107.994 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.1 mp -59.0 -40.5 85.08 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.659 -1.162 . . . . 0.0 112.279 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 58.2 mtp -58.68 -53.22 60.79 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 120.442 1.474 . . . . 0.0 110.577 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -64.15 -40.57 96.43 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 119.981 -0.688 . . . . 0.0 112.313 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 55.3 mt -70.95 -33.39 70.43 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.705 -0.622 . . . . 0.0 112.518 -178.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 23.9 tptt -64.88 -58.6 5.74 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -49.74 -48.76 49.97 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 127.693 2.397 . . . . 0.0 110.93 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 20.7 t -56.3 -54.05 50.02 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.474 1.11 . . . . 0.0 111.695 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.19 -42.61 91.27 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.862 0.465 . . . . 0.0 110.842 -178.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.05 -41.24 91.89 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.223 1.009 . . . . 0.0 110.988 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 1.1 mm? -65.24 -53.63 41.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.854 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 55.8 mmm -57.8 -27.62 63.29 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -85.12 -36.71 20.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.67 -32.14 28.29 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.275 0.943 . . . . 0.0 113.19 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.37 149.22 40.69 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 126.446 1.898 . . . . 0.0 108.134 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -65.44 174.09 5.65 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.993 2.462 . . . . 0.0 111.036 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -112.51 61.89 0.65 Allowed Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.359 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.68 -86.87 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.1 3.2 . . . . 0.0 111.408 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.1 -43.53 82.32 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.131 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.0 m -51.24 -40.86 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-O 118.213 -0.898 . . . . 0.0 112.124 -177.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.45 -41.84 45.99 Favored 'General case' 0 C--N 1.338 0.102 0 CA-C-N 118.748 0.704 . . . . 0.0 110.165 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -49.91 73.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 77.3 t80 -64.91 -40.01 94.4 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 127.028 2.131 . . . . 0.0 108.813 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -43.51 67.84 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.599 1.091 . . . . 0.0 108.238 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -77.62 -44.92 26.69 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.86 0.864 . . . . 0.0 111.867 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -56.79 -49.85 74.09 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.53 1.132 . . . . 0.0 110.441 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -64.02 -46.58 83.82 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.425 2.29 . . . . 0.0 108.787 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -55.32 -32.02 62.15 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.22 1.008 . . . . 0.0 111.57 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -2.42 1.37 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.98 -14.38 16.51 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.044 1.738 . . . . 0.0 108.854 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -95.35 175.8 6.44 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 119.783 -1.823 . . . . 0.0 108.015 178.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 36.1 ptt-85 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 125.613 1.565 . . . . 0.0 107.991 179.74 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 N--CA 1.471 0.584 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.93 32.8 0.32 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.35 1.06 . . . . 0.0 110.735 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -115.75 11.04 15.55 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.156 1.782 . . . . 0.0 114.257 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.67 108.53 5.73 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.2 tp -65.68 94.88 0.21 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.935 1.694 . . . . 0.0 108.847 -179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.76 137.25 36.91 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.754 1.221 . . . . 0.0 112.182 -178.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -104.19 159.23 15.87 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -142.08 101.04 5.82 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.36 125.88 10.55 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.256 1.971 . . . . 0.0 110.105 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.2 t -144.99 134.95 18.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 123.237 0.615 . . . . 0.0 110.179 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 ptt85 -136.91 102.85 4.99 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.92 117.63 0.75 Allowed Glycine 0 N--CA 1.45 -0.427 1 N-CA-C 102.786 -4.126 . . . . 0.0 102.786 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmm-85 -57.89 -51.37 69.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 121.359 2.58 . . . . 0.0 111.457 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -66.48 -40.82 89.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.906 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.86 -45.64 92.92 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.46 -0.775 . . . . 0.0 111.361 -179.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -58.93 -47.49 84.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.71 1.204 . . . . 0.0 109.814 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.67 -57.16 12.58 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.933 0.77 . . . . 0.0 110.736 179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.0 ptm -65.16 -42.84 93.36 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.26 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.01 -45.29 87.09 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.21 0.913 . . . . 0.0 111.175 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.5 -53.39 58.12 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 123.611 0.764 . . . . 0.0 109.496 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -40.91 97.17 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -178.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 91.5 mt -67.91 -45.33 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -63.96 -44.35 93.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.281 -0.636 . . . . 0.0 109.281 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -61.03 -50.87 71.56 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.146 -0.93 . . . . 0.0 109.428 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.3 p -53.19 -40.0 64.09 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.84 1.2 . . . . 0.0 111.177 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.09 -49.96 25.56 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.475 0.58 . . . . 0.0 111.664 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.44 -53.76 53.62 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.889 1.676 . . . . 0.0 110.61 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.96 -43.33 95.11 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.499 1.519 . . . . 0.0 109.718 -179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.8 ttt -63.47 -35.82 81.73 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.413 0.685 . . . . 0.0 110.55 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -78.29 -31.14 48.77 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.347 -0.845 . . . . 0.0 111.57 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -76.46 -35.04 58.66 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.424 0.69 . . . . 0.0 111.252 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 tp -128.73 76.45 78.8 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.65 -50.38 0.37 Allowed 'Trans proline' 0 N--CA 1.447 -1.218 0 N-CA-C 107.095 -1.925 . . . . 0.0 107.095 178.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 59.78 176.66 0.09 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 122.284 1.04 . . . . 0.0 109.186 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -70.08 -22.79 63.01 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 120.172 -1.58 . . . . 0.0 109.927 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.2 m -63.91 -52.4 60.06 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 117.988 -1.006 . . . . 0.0 111.065 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 35.7 mm -71.68 -42.04 71.1 Favored 'Isoleucine or valine' 0 C--N 1.346 0.413 0 CA-C-N 120.134 1.334 . . . . 0.0 108.934 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -57.1 -42.26 80.44 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.347 0.522 . . . . 0.0 111.071 -178.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.3 m -64.28 -52.44 58.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 109.667 178.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -50.75 71.25 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 123.628 0.771 . . . . 0.0 111.738 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 18.4 ttp85 -62.6 -38.6 90.81 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 118.2 -0.905 . . . . 0.0 109.777 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -56.62 -52.81 63.45 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 119.63 1.104 . . . . 0.0 110.564 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -65.28 -41.73 93.87 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 123.339 0.399 . . . . 0.0 110.635 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -61.77 -41.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.989 0.813 . . . . 0.0 110.254 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -66.0 -29.96 70.42 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.099 0.96 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -47.51 61.22 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.0 tm0? -60.68 -41.11 94.45 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.168 0.987 . . . . 0.0 109.155 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 14.0 t-160 -55.91 -34.7 65.82 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.77 1.628 . . . . 0.0 111.43 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -66.06 -45.16 82.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.805 1.184 . . . . 0.0 109.242 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -64.48 -38.71 91.98 Favored 'General case' 0 N--CA 1.458 -0.042 0 C-N-CA 122.963 0.505 . . . . 0.0 110.937 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.22 -28.86 70.03 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.474 1.11 . . . . 0.0 110.528 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.43 7.36 42.6 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.56 1.544 . . . . 0.0 111.61 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -75.68 91.53 2.9 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -160.03 134.48 7.57 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 105.525 -2.028 . . . . 0.0 105.525 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -53.23 -55.99 20.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.313 0.645 . . . . 0.0 112.043 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 63.32 -164.11 0.26 Allowed 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.5 p -77.23 2.86 14.28 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.6 tt -135.5 167.44 25.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-N 120.855 1.661 . . . . 0.0 110.946 -178.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -68.98 98.68 0.98 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.256 -0.902 . . . . 0.0 111.808 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 71.4 m . . . . . 0 C--O 1.257 1.461 0 C-N-CA 130.539 3.535 . . . . 0.0 106.145 178.67 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 CA-C-O 119.675 -0.514 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 23.7 t -129.25 -162.16 1.18 Allowed 'General case' 0 C--O 1.241 0.617 0 C-N-CA 127.189 2.196 . . . . 0.0 106.157 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -65.64 120.07 12.27 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 177.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -77.61 15.03 0.88 Allowed 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -178.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -128.98 165.48 21.04 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 126.012 1.725 . . . . 0.0 108.536 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.09 173.01 17.08 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 126.239 1.816 . . . . 0.0 108.843 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -129.56 129.64 44.71 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -114.38 167.81 10.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.339 1.055 . . . . 0.0 109.567 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 20.1 tp -149.22 154.71 39.51 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.882 178.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -150.41 98.81 2.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.957 1.703 . . . . 0.0 110.342 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.9 t -146.74 150.05 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 119.899 -1.751 . . . . 0.0 108.62 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -116.34 100.24 7.75 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 122.284 1.04 . . . . 0.0 108.701 177.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.38 107.79 0.46 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 106.819 -2.513 . . . . 0.0 106.819 177.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -56.78 15.16 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 121.512 2.656 . . . . 0.0 111.932 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -67.01 -47.0 72.79 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -52.06 -45.51 64.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.017 1.327 . . . . 0.0 112.269 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -69.96 -43.44 71.52 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.238 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -56.74 -48.18 78.37 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.948 0.88 . . . . 0.0 110.42 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 63.9 mt -65.12 -52.35 54.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 125.29 1.436 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -36.02 82.29 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.392 -1.766 . . . . 0.0 112.269 -178.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 9.5 mtm -64.12 -52.29 59.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.86 1.664 . . . . 0.0 108.55 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -48.24 -52.13 22.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.039 0.936 . . . . 0.0 109.423 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 80.6 mt -68.33 -32.8 73.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 30.3 tptt -70.35 -52.08 25.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.32 -1.487 . . . . 0.0 109.451 -178.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -54.45 -52.34 62.15 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 127.783 2.433 . . . . 0.0 106.165 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 29.3 t -52.76 -48.11 66.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.733 1.213 . . . . 0.0 112.595 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -52.47 57.73 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.66 -37.96 83.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.332 0.969 . . . . 0.0 111.263 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.49 -40.82 93.53 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 117.983 -1.008 . . . . 0.0 109.486 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 54.3 ttp -66.46 -28.94 68.98 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.868 0.758 . . . . 0.0 109.546 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.18 -32.75 65.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.462 1.028 . . . . 0.0 112.075 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 -32.76 26.08 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 4.0 p -85.26 148.1 49.1 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.08 0.952 . . . . 0.0 109.664 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -63.31 173.6 4.07 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.939 1.371 . . . . 0.0 110.133 178.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.43 55.16 1.71 Allowed Pre-proline 0 CA--C 1.548 0.877 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.73 -49.61 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 123.116 2.544 . . . . 0.0 114.35 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -28.51 69.55 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.118 -0.989 . . . . 0.0 108.46 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 11.4 t -61.4 -49.84 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -55.2 -51.36 66.78 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.602 1.561 . . . . 0.0 111.152 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 m -67.91 -46.31 71.91 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -57.98 -49.22 77.57 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.244 0.617 . . . . 0.0 109.409 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -43.26 67.87 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.903 1.681 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.09 -57.08 5.37 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.122 0.487 . . . . 0.0 111.844 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -61.09 -29.72 69.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.309 0.643 . . . . 0.0 112.094 -178.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.22 -37.73 52.73 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 178.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -58.55 -33.07 69.5 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.741 1.155 . . . . 0.0 109.395 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.43 -21.02 49.48 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 119.11 -0.471 . . . . 0.0 111.243 178.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.73 -10.7 59.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.144 1.378 . . . . 0.0 112.075 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -121.49 173.93 7.08 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.321 -1.487 . . . . 0.0 107.728 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.179 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.464 0.253 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -88.29 2.97 51.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.899 0.772 . . . . 0.0 111.524 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 4.3 p30 -79.9 5.22 14.4 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 126.143 1.777 . . . . 0.0 113.508 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -80.58 91.13 5.76 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.946 -1.096 . . . . 0.0 112.838 -178.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 18.9 tp -67.37 108.99 2.97 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.838 0.855 . . . . 0.0 109.283 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.4 mt -104.42 153.3 21.27 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -126.08 101.4 6.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.43 1.092 . . . . 0.0 109.175 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.03 113.0 40.05 Favored Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -91.49 122.44 0.71 Allowed 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 123.21 2.607 . . . . 0.0 109.751 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.1 t -142.27 154.59 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 125.834 1.653 . . . . 0.0 109.398 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 26.0 ptt180 -136.73 101.81 4.72 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 121.399 1.909 . . . . 0.0 111.034 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.18 138.28 5.05 Favored Glycine 0 N--CA 1.46 0.235 0 CA-C-O 116.326 -2.374 . . . . 0.0 107.645 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -52.1 27.62 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 121.008 2.404 . . . . 0.0 111.294 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.46 -41.9 92.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.364 0.529 . . . . 0.0 109.796 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -47.63 84.87 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.415 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 52.8 t80 -65.11 -40.81 95.04 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.439 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -55.11 -57.68 10.73 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.986 0.812 . . . . 0.0 108.994 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 24.6 ptm -67.65 -35.42 78.86 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.8 -41.63 91.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.533 1.061 . . . . 0.0 110.844 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.33 -47.93 58.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 178.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -56.6 -48.61 77.05 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.128 0.971 . . . . 0.0 112.888 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 93.3 mt -70.33 -35.89 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 119.304 0.956 . . . . 0.0 110.242 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -36.34 83.46 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.6 -54.84 10.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 117.871 -1.062 . . . . 0.0 110.607 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.5 p -53.51 -43.59 68.43 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.363 1.438 . . . . 0.0 113.856 -178.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.98 -47.52 51.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.812 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -64.35 -46.09 84.94 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 67.5 mt -62.16 -44.9 95.6 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.963 0.905 . . . . 0.0 109.909 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -59.25 -41.68 89.34 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.755 0.822 . . . . 0.0 109.079 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -75.08 -25.28 58.47 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.784 0.434 . . . . 0.0 111.169 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.56 -39.17 58.57 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.373 0.988 . . . . 0.0 110.849 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 59.0 tp -127.62 71.48 77.58 Favored Pre-proline 0 C--O 1.236 0.347 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.98 -57.76 0.12 Allowed 'Trans proline' 0 N--CA 1.444 -1.401 0 N-CA-C 108.491 -1.388 . . . . 0.0 108.491 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 1.5 tt0 61.31 -176.58 0.12 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.496 1.118 . . . . 0.0 108.36 -178.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -29.29 70.63 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 120.427 -1.421 . . . . 0.0 112.828 -179.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.41 58.25 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.448 1.022 . . . . 0.0 111.883 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 47.6 mm -73.25 -40.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-O 118.548 -0.739 . . . . 0.0 110.51 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -58.98 -49.2 78.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.874 0.761 . . . . 0.0 110.474 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.0 m -61.45 -40.16 93.46 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.972 0.509 . . . . 0.0 110.965 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -53.83 26.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.825 0.45 . . . . 0.0 111.196 -179.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 16.7 ttp85 -62.26 -40.71 97.09 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.212 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -59.05 -47.87 83.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.646 0.657 . . . . 0.0 109.334 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -65.09 -45.54 84.79 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.612 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -56.37 -48.32 77.07 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.71 0.804 . . . . 0.0 110.0 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -58.49 -40.36 82.55 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.978 0.911 . . . . 0.0 110.22 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -69.1 -46.1 68.57 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.976 0.91 . . . . 0.0 110.771 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 14.7 tm0? -56.93 -46.96 81.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.354 1.062 . . . . 0.0 108.611 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 45.3 t-80 -58.34 -26.06 62.67 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.488 1.515 . . . . 0.0 112.3 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -58.7 -45.24 89.94 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 119.735 1.152 . . . . 0.0 108.047 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -67.51 -29.67 69.14 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.954 0.502 . . . . 0.0 111.58 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 2.4 tt -67.52 -48.74 66.17 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.1 -8.35 58.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.187 0.595 . . . . 0.0 112.563 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -61.64 97.57 0.08 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.401 1.48 . . . . 0.0 110.762 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -169.61 149.1 3.82 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 125.638 1.575 . . . . 0.0 107.252 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -61.47 -66.63 0.51 Allowed 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.707 1.203 . . . . 0.0 110.641 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1056 ' ' THR . . . . . 0.429 HG22 ' H ' ' C' 1057 ' ' SER . 1.2 m 65.71 -167.06 0.22 Allowed 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 -178.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C 1057 ' ' SER . . . . . 0.429 ' H ' HG22 ' C' 1056 ' ' THR . 0.1 OUTLIER -73.82 20.15 0.1 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.982 1.713 . . . . 0.0 113.001 -179.953 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 15.0 tt -141.73 171.03 12.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 O-C-N 120.689 -1.257 . . . . 0.0 109.644 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -82.51 98.59 9.01 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 4.1 m . . . . . 0 C--O 1.246 0.91 0 C-N-CA 126.487 1.915 . . . . 0.0 110.068 -179.841 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.694 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 43.8 m -148.84 -167.72 2.9 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.965 2.106 . . . . 0.0 106.552 178.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.46 127.51 32.52 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.689 1.196 . . . . 0.0 109.285 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -83.08 2.19 36.45 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.091 -1.006 . . . . 0.0 110.259 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.46 160.42 21.22 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.813 1.645 . . . . 0.0 111.016 -178.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.52 167.07 31.58 Favored 'General case' 0 C--O 1.242 0.658 0 C-N-CA 127.068 2.147 . . . . 0.0 106.383 178.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -131.74 129.74 41.02 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -112.43 174.11 6.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.258 0.623 . . . . 0.0 112.317 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 17.4 tp -150.32 153.35 35.95 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.713 178.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.15 98.82 2.74 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.88 2.072 . . . . 0.0 109.065 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 60.9 t -153.18 147.03 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.384 -0.823 . . . . 0.0 108.861 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -103.98 102.84 12.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.659 -1.276 . . . . 0.0 108.406 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.13 110.53 0.63 Allowed Glycine 0 C--O 1.223 -0.586 0 CA-C-O 117.289 -1.839 . . . . 0.0 111.695 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -67.42 -57.17 7.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 121.225 2.512 . . . . 0.0 110.189 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -69.79 -42.57 73.59 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 122.143 0.973 . . . . 0.0 109.538 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.05 -43.06 99.45 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.764 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 10.2 t80 -69.99 -37.96 75.88 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 120.086 1.312 . . . . 0.0 110.829 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -56.17 -47.49 78.16 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.425 1.011 . . . . 0.0 109.493 178.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 22.5 mt -62.42 -50.16 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.826 1.25 . . . . 0.0 109.15 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -49.04 77.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 125.457 1.503 . . . . 0.0 112.082 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.31 -52.16 63.09 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 120.957 1.708 . . . . 0.0 109.114 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -48.79 -51.82 27.23 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.157 0.583 . . . . 0.0 111.12 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 41.8 mt -71.25 -39.67 71.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 33.6 tptt -65.27 -46.1 81.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 120.121 1.328 . . . . 0.0 110.161 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -57.18 -54.92 41.36 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.856 1.662 . . . . 0.0 106.691 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 5.5 t -52.74 -43.93 66.07 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.081 0.952 . . . . 0.0 111.765 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.81 -49.01 62.06 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -63.07 -42.05 99.57 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 5.3 mp -65.42 -45.66 83.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.846 -1.074 . . . . 0.0 108.852 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 22.7 ttp -64.35 -22.57 67.0 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.749 1.613 . . . . 0.0 111.362 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -72.25 -40.36 67.75 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.71 -33.08 35.56 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.53 147.98 68.89 Favored Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 124.752 1.221 . . . . 0.0 109.867 -179.204 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.92 -174.16 1.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.543 2.162 . . . . 0.0 110.162 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.253 13.3 pt20 -126.63 54.04 10.84 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.48 -52.51 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.935 2.423 . . . . 0.0 112.51 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.45 -41.78 85.9 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.4 t -53.74 -50.27 52.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 C-N-CA 124.401 1.08 . . . . 0.0 110.529 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.29 70.22 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.491 0.662 . . . . 0.0 111.606 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 27.8 t -60.46 -46.28 90.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.792 0.837 . . . . 0.0 110.786 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.25 -45.24 81.29 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 124.716 1.206 . . . . 0.0 110.926 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.74 -45.26 66.92 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 124.5 1.12 . . . . 0.0 108.747 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -65.75 -55.96 14.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.229 0.468 . . . . 0.0 111.02 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.74 -30.88 64.0 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.579 -0.701 . . . . 0.0 112.408 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 -35.58 34.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.103 0.961 . . . . 0.0 108.772 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -58.12 -33.17 68.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.45 1.023 . . . . 0.0 108.935 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.42 -17.68 59.86 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.191 0.451 . . . . 0.0 112.135 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tt -80.82 -35.3 33.09 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.411 1.484 . . . . 0.0 108.912 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -89.69 163.86 14.94 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.571 0.7 . . . . 0.0 110.192 179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? . . . . . 0 C--O 1.251 1.164 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 178.022 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.6 p . . . . . 0 CA--C 1.541 0.631 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -92.83 -7.98 44.81 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.461 -1.399 . . . . 0.0 112.916 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.9 m-20 -134.07 39.33 3.12 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -78.85 85.5 4.83 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.355 1.062 . . . . 0.0 108.699 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.5 tp -64.13 102.74 0.53 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.6 mt -112.77 167.71 10.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.833 2.053 . . . . 0.0 107.709 -179.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -130.26 159.43 36.92 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.808 0.843 . . . . 0.0 109.799 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.4 tp -140.39 94.72 8.41 Favored Pre-proline 0 CA--C 1.538 0.482 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.115 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.85 110.3 3.0 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 124.303 3.336 . . . . 0.0 111.653 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -139.32 151.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.535 1.134 . . . . 0.0 109.215 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -135.98 101.81 4.84 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.3 115.79 0.64 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 106.269 -2.732 . . . . 0.0 106.269 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.55 -52.01 66.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 121.315 2.558 . . . . 0.0 109.828 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -68.96 -30.72 69.2 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.4 m -63.39 -53.13 57.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.068 0.947 . . . . 0.0 109.182 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -64.87 -47.6 77.28 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.73 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -53.41 -44.87 69.07 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.422 0.556 . . . . 0.0 111.722 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.5 mtp -73.79 -43.78 57.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.554 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mp -55.24 -50.88 68.33 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.058 0.845 . . . . 0.0 109.186 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -52.71 63.2 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 126.759 2.023 . . . . 0.0 111.289 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -55.5 -49.38 72.71 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.005 0.821 . . . . 0.0 112.225 -178.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.9 mt -66.12 -48.84 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -55.13 -47.21 75.36 Favored 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.06 0.944 . . . . 0.0 111.0 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -59.03 -50.14 75.2 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.047 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.8 p -53.81 -51.44 63.5 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.937 1.244 . . . . 0.0 112.936 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -62.57 -49.74 74.06 Favored 'General case' 0 C--N 1.345 0.41 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.47 -43.31 94.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.638 -178.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.87 -36.71 85.22 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.634 -0.666 . . . . 0.0 109.778 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -60.26 -44.39 95.34 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -78.69 -17.33 56.08 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.987 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -81.46 -24.13 37.0 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.003 1.274 . . . . 0.0 109.735 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.8 tp -127.36 71.69 76.87 Favored Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.14 0.976 . . . . 0.0 109.006 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.3 150.92 81.4 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.166 1.911 . . . . 0.0 110.049 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -159.5 165.73 32.39 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.302 1.041 . . . . 0.0 110.607 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -58.23 -40.6 82.15 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.52 1.128 . . . . 0.0 111.098 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.3 m -57.08 -51.13 70.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.234 1.414 . . . . 0.0 109.905 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 66.8 mt -59.1 -45.19 92.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 124.99 1.316 . . . . 0.0 108.92 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -60.23 -45.46 93.14 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.4 m -61.26 -48.19 82.58 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.109 0.963 . . . . 0.0 108.525 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.4 -50.42 71.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.784 0.833 . . . . 0.0 109.179 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttt-85 -56.09 -47.04 78.8 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 119.221 -0.419 . . . . 0.0 110.985 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -56.93 15.03 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.429 1.092 . . . . 0.0 110.423 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -55.76 -35.86 66.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.357 1.063 . . . . 0.0 111.352 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -69.51 -48.74 59.52 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -60.26 -38.8 84.65 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.59 1.156 . . . . 0.0 111.183 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -26.13 66.6 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.037 0.935 . . . . 0.0 110.715 178.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.71 -39.12 76.5 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 120.129 1.331 . . . . 0.0 110.743 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -64.54 -42.28 95.82 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.4 1.455 . . . . 0.0 109.757 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -62.55 -42.46 99.55 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -65.65 -37.35 86.3 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.095 0.558 . . . . 0.0 111.063 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.1 mt -68.09 -26.37 65.79 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.827 1.251 . . . . 0.0 110.611 178.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.6 tp -101.73 16.73 24.91 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.407 1.483 . . . . 0.0 110.366 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 45.7 56.84 5.5 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.954 3.302 . . . . 0.0 113.821 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -105.37 153.04 22.2 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -49.82 98.85 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.125 1.37 . . . . 0.0 111.727 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.8 p -148.03 -62.58 0.26 Allowed 'General case' 0 CA--C 1.527 0.078 0 C-N-CA 124.793 1.237 . . . . 0.0 110.416 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m 56.09 79.2 0.18 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.598 1.559 . . . . 0.0 110.214 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.4 tt -116.93 136.88 52.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 O-C-N 121.856 -0.528 . . . . 0.0 110.962 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -72.43 158.98 34.74 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 124.101 0.96 . . . . 0.0 110.825 179.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.15 1.78 . . . . 0.0 107.457 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.518 0 N-CA-C 108.264 -1.934 . . . . 0.0 108.264 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 48.4 m -136.29 -179.59 5.77 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -108.36 146.75 32.54 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -17.31 56.37 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -72.73 168.81 17.99 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.612 0.72 . . . . 0.0 111.272 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 51.7 m -100.96 155.06 18.18 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.945 2.098 . . . . 0.0 107.868 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -120.68 130.58 54.15 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 121.675 0.75 . . . . 0.0 109.445 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -112.26 159.12 18.93 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 127.529 2.332 . . . . 0.0 109.846 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.431 ' HB3' ' HE2' ' D' 1116 ' ' LYS . 28.5 mt -150.65 142.27 23.59 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 179.082 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -147.69 106.92 3.87 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.117 1.767 . . . . 0.0 112.068 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . 0.433 ' HB ' ' HE3' ' D' 1116 ' ' LYS . 53.2 t -155.22 149.75 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 120.39 1.45 . . . . 0.0 110.425 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.1 102.42 14.95 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 102.575 -3.12 . . . . 0.0 102.575 176.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.65 109.78 0.56 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 115.671 -2.738 . . . . 0.0 106.44 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -68.32 -56.98 6.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 121.873 2.837 . . . . 0.0 112.002 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -64.31 -46.55 83.06 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.29 -51.19 60.0 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 125.062 1.345 . . . . 0.0 110.781 -178.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -65.78 -45.74 81.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 119.753 1.161 . . . . 0.0 112.497 -178.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -55.55 -53.65 53.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.964 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.0 -57.17 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 124.902 1.281 . . . . 0.0 109.452 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 49.6 mt -57.08 -27.99 62.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.823 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.5 mmm -72.39 -52.16 17.25 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.35 -45.44 69.13 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.6 mt -67.03 -31.47 72.02 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -68.01 -56.55 8.51 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -52.89 -57.0 11.72 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 128.64 2.776 . . . . 0.0 110.319 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 11.6 t -54.47 -52.12 62.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.083 1.353 . . . . 0.0 111.6 -179.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.99 -30.75 70.95 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.485 1.039 . . . . 0.0 111.161 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -65.8 -45.43 82.41 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 120.998 1.726 . . . . 0.0 108.347 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 30.1 mt -63.14 -49.86 72.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.13 0.972 . . . . 0.0 109.582 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 ttt -56.86 -35.49 68.95 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.654 0.782 . . . . 0.0 110.605 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -72.43 -33.03 66.8 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.383 1.073 . . . . 0.0 112.458 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.1 pp -93.15 -31.37 14.81 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 66.3 t -84.32 145.68 46.03 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 125.476 1.51 . . . . 0.0 108.392 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.74 -176.7 1.01 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.549 2.833 . . . . 0.0 111.959 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.78 34.76 0.21 Allowed Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.1 -44.87 21.85 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 122.857 2.056 . . . . 0.0 112.766 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.5 -26.17 67.04 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 13.9 t -72.23 -47.76 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -59.24 -51.7 68.84 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.785 1.234 . . . . 0.0 111.319 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 19.4 m -62.08 -49.15 77.09 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 122.358 -0.214 . . . . 0.0 110.822 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -63.09 -38.37 90.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.306 -0.246 . . . . 0.0 110.996 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -44.69 87.57 Favored 'General case' 0 C--N 1.337 0.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -66.18 -44.44 83.98 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.244 0.618 . . . . 0.0 109.996 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -59.66 -55.29 36.29 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.172 0.989 . . . . 0.0 111.233 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -37.49 84.8 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -58.21 -34.84 70.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.719 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.86 -25.33 68.23 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 120.314 1.415 . . . . 0.0 111.457 178.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.3 -25.29 51.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.461 1.028 . . . . 0.0 112.911 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -127.83 105.65 8.58 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 119.622 1.101 . . . . 0.0 109.267 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 126.161 1.784 . . . . 0.0 107.762 -179.882 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 97.9 p . . . . . 0 C--O 1.224 -0.244 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -73.07 0.17 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 121.247 1.839 . . . . 0.0 110.436 -178.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -76.59 40.25 0.23 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.483 1.513 . . . . 0.0 111.669 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.43 77.38 1.91 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 126.03 1.732 . . . . 0.0 107.986 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.73 109.32 0.9 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.14 151.36 34.5 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 105.709 -1.96 . . . . 0.0 105.709 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -117.83 101.28 8.18 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.36 0.982 . . . . 0.0 109.461 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 10.3 tp -75.52 112.04 17.22 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 117.154 -1.403 . . . . 0.0 109.845 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -88.84 117.46 0.88 Allowed 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 124.46 3.44 . . . . 0.0 111.514 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.8 t -145.75 149.24 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.129 0.877 . . . . 0.0 112.981 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -133.64 100.41 4.78 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 175.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.57 104.19 0.22 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 105.633 -2.987 . . . . 0.0 105.633 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 24.2 tpt180 -57.27 -51.43 69.41 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 121.122 2.461 . . . . 0.0 111.8 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.7 -41.5 87.92 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 118.593 0.633 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -62.53 -35.98 81.14 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.131 0.972 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 35.0 t80 -69.45 -50.45 45.47 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.825 -1.172 . . . . 0.0 109.298 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -56.33 -54.51 44.65 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.502 1.121 . . . . 0.0 110.297 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 45.9 mtp -63.45 -38.05 89.64 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.506 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.88 -46.15 86.18 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.106 1.321 . . . . 0.0 110.021 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.33 -48.21 76.42 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 123.924 0.89 . . . . 0.0 111.431 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -55.65 -49.09 73.82 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.612 0.765 . . . . 0.0 110.783 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 95.6 mt -66.54 -49.62 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -53.38 -44.43 68.61 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 124.132 0.973 . . . . 0.0 111.164 -179.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -62.65 -48.67 78.32 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.42 -179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 86.4 p -53.64 -46.85 70.66 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.822 1.192 . . . . 0.0 112.781 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.93 -58.08 5.14 Favored 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 123.331 0.652 . . . . 0.0 112.552 -179.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.94 -52.47 62.89 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.372 1.069 . . . . 0.0 111.398 -178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.9 -43.33 94.88 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.496 -0.752 . . . . 0.0 111.757 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 17.0 tmm? -62.95 -43.76 97.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 118.72 0.691 . . . . 0.0 110.956 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -67.51 -23.45 65.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.684 0.675 . . . . 0.0 111.02 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.93 -23.01 39.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.282 0.633 . . . . 0.0 110.407 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 24.5 tp -116.55 66.46 3.48 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 124.687 1.195 . . . . 0.0 110.609 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -68.22 142.43 55.42 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 121.249 1.3 . . . . 0.0 109.162 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.2 163.27 38.68 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.376 1.47 . . . . 0.0 107.903 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -72.19 -24.74 61.46 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.387 0.994 . . . . 0.0 111.345 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 57.0 m -61.63 -50.62 71.81 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 72.1 mt -59.79 -47.12 92.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 126.341 1.856 . . . . 0.0 108.726 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -54.51 -48.22 72.17 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.779 1.632 . . . . 0.0 111.033 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.0 m -66.3 -46.13 78.02 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.122 0.969 . . . . 0.0 108.87 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -42.72 81.11 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 124.011 0.925 . . . . 0.0 110.192 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -58.54 -46.76 86.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.51 -41.81 96.2 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.643 -1.17 . . . . 0.0 111.0 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.34 -49.46 72.16 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.951 1.25 . . . . 0.0 109.111 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -60.33 -47.25 86.82 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.072 0.949 . . . . 0.0 110.28 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -64.65 -29.73 70.73 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.73 0.812 . . . . 0.0 111.977 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -43.66 92.24 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.685 1.194 . . . . 0.0 110.764 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -55.93 -40.81 73.65 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.238 0.615 . . . . 0.0 111.653 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -59.94 -44.08 94.59 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.493 0.717 . . . . 0.0 109.27 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -70.59 -35.69 73.17 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.684 -0.635 . . . . 0.0 111.956 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 1.3 t60 -57.4 -33.25 67.65 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.127 1.371 . . . . 0.0 110.406 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 52.5 mt -55.96 -47.41 77.66 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 9.7 mp -79.39 16.18 1.08 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.034 1.334 . . . . 0.0 111.821 179.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 56.11 23.08 6.54 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.835 2.454 . . . . 0.0 113.813 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -66.66 153.06 44.12 Favored 'General case' 0 CA--C 1.519 -0.225 0 O-C-N 121.186 -0.947 . . . . 0.0 108.676 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 7.5 pm0 -55.48 108.62 0.45 Allowed 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 178.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 4.9 p -144.08 -40.62 0.28 Allowed 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 124.275 1.03 . . . . 0.0 110.991 -178.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 3.9 m 28.03 68.26 0.07 Allowed 'General case' 0 C--O 1.238 0.454 0 C-N-CA 129.651 3.18 . . . . 0.0 111.586 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 20.6 tt -114.98 131.73 66.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 125.67 1.588 . . . . 0.0 110.75 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.71 158.53 35.21 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 5.3 p . . . . . 0 C--O 1.257 1.487 0 C-N-CA 124.127 0.971 . . . . 0.0 109.492 179.312 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.455 0 N-CA-C 108.764 -1.734 . . . . 0.0 108.764 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 19.3 m -152.99 158.53 42.17 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -71.37 167.76 18.87 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.36 0.22 24.77 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -177.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 35.7 t0 -81.54 159.51 24.12 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.278 0.944 . . . . 0.0 113.317 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 29.0 m -82.56 149.13 27.65 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.862 1.265 . . . . 0.0 109.426 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -107.16 134.8 49.73 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.59 144.67 47.99 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 128.206 2.602 . . . . 0.0 112.437 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 62.2 mt -147.57 155.16 41.55 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.353 1.461 . . . . 0.0 110.145 178.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -152.16 108.84 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.565 1.546 . . . . 0.0 111.927 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 95.0 t -153.19 150.15 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-N 120.344 1.429 . . . . 0.0 109.757 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.54 102.92 12.82 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.2 113.68 0.79 Allowed Glycine 0 N--CA 1.454 -0.141 0 N-CA-C 106.65 -2.58 . . . . 0.0 106.65 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -64.92 -57.03 9.86 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 121.265 2.533 . . . . 0.0 110.538 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 19.8 mttp -63.18 -42.5 99.37 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.965 0.802 . . . . 0.0 108.98 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -60.03 -40.75 90.42 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.296 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 28.8 t80 -65.25 -43.7 90.51 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 120.372 1.442 . . . . 0.0 109.23 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -58.37 -53.75 54.82 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.113 0.87 . . . . 0.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.75 -57.91 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.197 1.399 . . . . 0.0 110.132 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 66.8 mt -59.47 -35.85 74.87 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 117.15 -1.405 . . . . 0.0 111.309 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -49.46 74.42 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 120.557 1.526 . . . . 0.0 108.602 178.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 51.8 mttm -53.57 -50.94 64.47 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.29 -33.01 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1116 ' ' LYS . . . . . 0.433 ' HE3' ' HB ' ' B' ' 103' ' ' VAL . 27.8 tptt -64.79 -57.96 7.52 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -52.28 -49.39 64.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.487 1.915 . . . . 0.0 108.319 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 28.7 t -52.96 -55.02 26.54 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.238 1.815 . . . . 0.0 114.281 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.56 -36.47 82.73 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.473 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -68.81 -38.1 79.68 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.738 1.154 . . . . 0.0 110.222 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 46.7 mt -65.33 -44.93 86.24 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.923 -0.486 . . . . 0.0 109.882 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttt -61.86 -38.32 87.8 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.244 1.018 . . . . 0.0 110.693 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.47 -44.08 79.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.749 -0.594 . . . . 0.0 110.643 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.3 pp -75.65 -31.78 59.95 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.42 147.37 34.28 Favored Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 120.105 1.32 . . . . 0.0 110.064 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -73.2 177.48 7.78 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.057 1.838 . . . . 0.0 108.95 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.61 47.12 0.28 Allowed Pre-proline 0 CA--C 1.556 1.178 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -178.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.45 -48.03 0.64 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.091 1.861 . . . . 0.0 112.981 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.92 -25.89 68.35 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 17.2 t -72.12 -48.15 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 126.22 1.808 . . . . 0.0 108.755 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.67 -41.41 81.48 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.505 0.722 . . . . 0.0 110.145 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 50.8 m -70.84 -50.23 37.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.352 1.061 . . . . 0.0 110.877 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.53 -35.59 78.16 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.323 0.965 . . . . 0.0 110.368 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.61 -47.16 86.68 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -60.84 -48.12 83.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.499 1.045 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -56.57 -57.86 10.56 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.312 1.045 . . . . 0.0 111.448 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -34.86 78.95 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.859 -0.526 . . . . 0.0 111.976 -178.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.87 -27.53 68.29 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.42 -38.75 85.05 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.92 3.16 7.14 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.581 1.952 . . . . 0.0 112.338 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -140.64 124.12 16.89 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 121.332 1.878 . . . . 0.0 112.776 -178.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 . . . . . 0 C--O 1.252 1.227 1 C-N-CA 132.323 4.249 . . . . 0.0 106.422 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.3 p . . . . . 0 N--CA 1.466 0.361 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -59.9 -63.43 1.3 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.859 1.264 . . . . 0.0 109.305 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.85 -49.82 19.22 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 76.36 168.11 0.26 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.903 2.081 . . . . 0.0 111.574 179.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 13.0 tp -73.16 94.7 1.98 Allowed 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mt -93.32 161.24 14.48 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.029 0.931 . . . . 0.0 110.761 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -134.16 118.61 17.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.627 1.571 . . . . 0.0 108.756 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 43.6 tp -108.96 100.2 38.87 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 123.796 0.838 . . . . 0.0 110.532 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.74 125.42 7.45 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.202 2.601 . . . . 0.0 111.16 178.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.2 t -145.15 146.18 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.788 1.635 . . . . 0.0 107.919 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -126.01 100.19 6.25 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.4 126.14 1.37 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -66.99 -52.68 39.75 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 120.781 2.291 . . . . 0.0 109.712 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.95 -33.72 75.2 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 122.4 0.28 . . . . 0.0 110.751 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -45.87 92.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -67.03 -40.05 87.11 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.089 0.404 . . . . 0.0 111.435 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -60.48 -57.36 13.07 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.588 0.755 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.4 ppp? -62.87 -38.94 92.88 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.822 -0.608 . . . . 0.0 110.591 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.38 -50.6 72.24 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mt -59.51 -47.31 86.03 Favored 'General case' 0 C--O 1.23 0.066 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.298 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -62.59 -47.37 84.11 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.489 1.04 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.5 mt -65.03 -41.03 90.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 123.707 0.803 . . . . 0.0 110.371 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -62.47 -60.07 4.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.569 1.148 . . . . 0.0 108.726 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.19 -47.14 84.35 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.192 0.932 . . . . 0.0 110.557 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.7 t -52.46 -51.61 58.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.287 0.949 . . . . 0.0 112.631 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.46 -47.67 69.44 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.462 0.574 . . . . 0.0 109.484 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -55.25 -49.44 72.03 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 118.203 0.456 . . . . 0.0 111.665 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.26 -46.23 67.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 117.541 -1.219 . . . . 0.0 110.112 -178.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -36.02 72.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 120.134 1.334 . . . . 0.0 110.596 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -69.64 -35.59 75.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.104 1.362 . . . . 0.0 110.678 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -83.72 -36.86 23.36 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.673 0.789 . . . . 0.0 113.016 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.62 149.85 96.81 Favored Pre-proline 0 CA--C 1.536 0.406 0 CA-C-N 119.228 0.922 . . . . 0.0 108.55 179.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -67.74 165.58 27.2 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.63 1.553 . . . . 0.0 109.404 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -82.01 4.72 21.72 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.941 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -48.68 -57.86 5.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.672 1.123 . . . . 0.0 113.219 -178.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.9 m -59.84 -38.24 81.51 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.751 0.705 . . . . 0.0 110.963 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.58 -42.45 96.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.95 0.9 . . . . 0.0 109.16 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -62.82 -50.08 72.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.557 0.743 . . . . 0.0 109.132 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.46 -37.52 83.87 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.265 0.555 . . . . 0.0 110.191 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -66.73 -54.08 26.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.318 1.047 . . . . 0.0 111.362 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -63.94 -33.23 75.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.845 1.202 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -61.32 -57.99 10.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.678 -1.231 . . . . 0.0 107.678 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -65.17 -30.71 71.64 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.205 0.911 . . . . 0.0 113.206 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -58.17 -46.72 85.24 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -76.11 -51.34 12.43 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 111.593 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -49.42 -37.32 25.12 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 116.698 -1.62 . . . . 0.0 113.649 -177.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -54.48 -47.79 72.57 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 121.486 1.948 . . . . 0.0 112.565 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -61.29 -39.04 88.98 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.833 0.742 . . . . 0.0 109.64 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -68.84 -34.43 75.48 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.704 0.802 . . . . 0.0 110.912 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -63.0 -41.58 99.62 Favored 'General case' 0 C--N 1.338 0.08 0 CA-C-N 119.417 1.008 . . . . 0.0 109.138 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.6 mp -60.59 -32.01 71.13 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.263 0.483 . . . . 0.0 109.98 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 69.7 mt -76.18 2.21 13.73 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 117.162 -1.399 . . . . 0.0 113.368 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 14.31 82.14 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 129.79 3.236 . . . . 0.0 114.268 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -80.0 48.49 0.98 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.279 -0.888 . . . . 0.0 110.806 179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 41.35 54.56 3.51 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.357 2.263 . . . . 0.0 111.091 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.22 47.87 0.39 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.067 1.347 . . . . 0.0 111.708 -179.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.3 95.92 1.75 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.3 tt -160.21 156.44 3.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 127.186 2.194 . . . . 0.0 105.791 179.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -146.32 158.5 43.89 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.1 p . . . . . 0 C--O 1.257 1.46 0 C-N-CA 128.584 2.754 . . . . 0.0 103.622 179.368 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.462 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 20.0 m -94.86 -166.19 1.43 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.938 2.095 . . . . 0.0 109.011 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -67.15 167.22 12.48 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -55.91 -28.44 56.74 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.542 1.537 . . . . 0.0 111.449 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 44.55 77.09 0.08 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 126.709 2.004 . . . . 0.0 111.207 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.9 142.05 26.09 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.051 0.453 . . . . 0.0 110.491 179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -122.65 148.75 44.91 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.094 0.957 . . . . 0.0 109.425 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -134.3 160.18 38.69 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 124.603 1.161 . . . . 0.0 109.292 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 79.1 mt -144.3 161.19 39.57 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -150.57 110.11 4.02 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.287 1.835 . . . . 0.0 106.954 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . 0.413 ' HB ' ' HE3' ' D' 1116 ' ' LYS . 1.9 m -155.89 151.32 9.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.115 0.966 . . . . 0.0 111.473 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 -117.6 100.62 7.75 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 119.744 1.156 . . . . 0.0 111.682 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.4 119.65 1.25 Allowed Glycine 0 CA--C 1.521 0.427 0 CA-C-O 116.429 -2.317 . . . . 0.0 109.058 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -61.55 -56.89 15.09 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 121.451 2.626 . . . . 0.0 109.298 178.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -58.59 -47.13 85.33 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.23 0.612 . . . . 0.0 109.652 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -58.89 -44.71 91.22 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 112.525 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -64.13 -44.92 90.72 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 120.645 1.566 . . . . 0.0 110.596 -178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -56.37 -54.16 48.78 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 122.016 0.912 . . . . 0.0 111.694 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 57.6 mt -69.1 -49.18 64.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -177.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 76.7 mt -61.44 -38.17 86.2 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 119.75 1.159 . . . . 0.0 110.657 -179.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 69.4 mtp -61.42 -52.89 62.71 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.316 0.962 . . . . 0.0 110.032 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -63.34 -40.73 98.11 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.379 -178.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.84 -36.45 78.17 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.547 1.067 . . . . 0.0 111.207 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 7.2 tptp -70.66 -47.34 60.45 Favored 'General case' 0 N--CA 1.462 0.152 0 O-C-N 120.343 -1.473 . . . . 0.0 108.484 178.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -58.16 -51.59 69.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.411 1.485 . . . . 0.0 110.233 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.3 m -61.0 -39.94 91.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.509 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -41.96 89.92 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 119.128 0.876 . . . . 0.0 109.122 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.16 -36.72 84.97 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.48 0.582 . . . . 0.0 111.149 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -68.17 -47.97 66.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 33.1 ttp -65.9 -27.97 68.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 118.728 0.695 . . . . 0.0 109.993 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -68.63 -39.57 80.69 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.061 -0.971 . . . . 0.0 109.191 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.9 -24.23 44.3 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.993 1.27 . . . . 0.0 111.55 179.072 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.54 145.05 66.64 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.21 -84.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.841 0 N-CA-C 108.377 -1.432 . . . . 0.0 108.377 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -167.65 63.04 0.63 Allowed Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 125.013 1.325 . . . . 0.0 110.14 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -70.93 -106.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 124.049 3.166 . . . . 0.0 112.178 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.41 -25.6 66.06 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 120.906 -1.122 . . . . 0.0 109.168 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 t -54.98 -45.15 76.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.509 1.124 . . . . 0.0 108.559 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -74.9 -44.17 50.3 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.861 0.865 . . . . 0.0 110.998 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 22.9 t -61.96 -51.55 67.63 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.288 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.6 -39.5 93.83 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.072 0.949 . . . . 0.0 110.488 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -55.83 -46.98 77.99 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-N 118.999 0.818 . . . . 0.0 109.152 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -65.36 -51.89 57.44 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.89 -47.69 70.84 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.148 0.979 . . . . 0.0 112.996 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.98 -34.5 75.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.576 1.08 . . . . 0.0 109.053 179.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -28.05 69.2 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.039 -1.038 . . . . 0.0 109.536 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 58.9 mt -63.45 -15.65 58.34 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.087 0.858 . . . . 0.0 112.235 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.8 tt -77.1 -21.46 54.27 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.917 1.287 . . . . 0.0 110.302 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -96.07 172.63 7.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.994 1.318 . . . . 0.0 111.804 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 . . . . . 0 C--O 1.244 0.795 0 C-N-CA 127.511 2.324 . . . . 0.0 107.73 -179.296 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 81.2 p . . . . . 0 N--CA 1.463 0.221 0 CA-C-O 118.864 -0.588 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 38.8 t0 -69.39 -75.65 0.11 Allowed 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 125.685 1.594 . . . . 0.0 111.279 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.86 -44.3 77.44 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 125.251 1.42 . . . . 0.0 109.672 -176.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 7.3 tp10 76.17 167.78 0.26 Allowed 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 127.374 2.27 . . . . 0.0 112.673 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.5 tp -72.86 95.91 2.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.881 1.672 . . . . 0.0 106.787 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 46.3 mt -100.31 168.81 9.54 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -140.23 147.23 39.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.878 1.271 . . . . 0.0 108.743 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 33.3 tp -124.02 94.5 45.48 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.037 1.335 . . . . 0.0 108.02 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.56 121.48 5.59 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.764 2.309 . . . . 0.0 109.505 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.9 t -144.94 159.92 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.298 1.039 . . . . 0.0 109.674 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 12.7 ptt-85 -136.52 102.9 5.08 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.988 1.267 . . . . 0.0 109.186 176.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.97 139.01 5.5 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 117.613 -1.66 . . . . 0.0 110.274 178.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -71.03 -52.09 21.55 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.618 2.209 . . . . 0.0 106.901 177.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.3 -46.5 67.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.669 1.188 . . . . 0.0 107.817 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -56.41 -44.93 80.83 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.217 0.462 . . . . 0.0 111.308 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.2 t80 -65.29 -51.57 59.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.765 0.712 . . . . 0.0 111.0 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -54.97 -57.11 12.99 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.477 1.111 . . . . 0.0 111.414 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ppp? -61.02 -46.78 89.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.513 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 33.9 mt -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 117.747 -1.121 . . . . 0.0 110.427 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.63 -53.14 61.11 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 120.048 1.295 . . . . 0.0 110.632 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -55.58 -48.62 74.52 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.69 -43.07 86.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 122.996 0.518 . . . . 0.0 112.264 -178.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -66.57 -48.92 68.08 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 118.159 -0.924 . . . . 0.0 109.817 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.83 -44.86 91.96 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.238 -0.887 . . . . 0.0 108.611 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 16.2 t -56.97 -38.09 72.52 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.661 1.119 . . . . 0.0 111.737 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.5 tm? -71.09 -57.75 4.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.195 0.598 . . . . 0.0 110.743 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -56.35 -48.04 77.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.875 0.47 . . . . 0.0 110.119 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.14 -47.04 86.75 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 118.279 -0.867 . . . . 0.0 109.523 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.3 68.66 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.372 0.987 . . . . 0.0 110.907 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -71.58 -34.59 70.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.663 0.785 . . . . 0.0 111.734 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -77.84 -27.51 49.91 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.887 1.221 . . . . 0.0 110.637 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.2 mp -73.54 157.33 87.88 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.946 0.898 . . . . 0.0 109.357 178.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -77.49 161.77 31.1 Favored 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 121.873 1.715 . . . . 0.0 110.074 178.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -75.54 -2.78 30.61 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 117.671 -1.157 . . . . 0.0 113.833 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -48.31 -58.47 4.54 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 120.18 1.355 . . . . 0.0 112.985 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 23.8 m -65.49 -34.1 77.47 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.981 -1.074 . . . . 0.0 111.123 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.91 -44.94 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.268 1.427 . . . . 0.0 109.921 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.77 -56.75 13.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.584 1.153 . . . . 0.0 108.759 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 83.0 m -59.24 -36.43 75.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.339 -0.838 . . . . 0.0 110.67 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 32.0 t80 -61.09 -53.89 51.46 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.293 0.951 . . . . 0.0 109.158 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -41.67 94.47 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.975 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.58 -46.58 89.69 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.061 0.846 . . . . 0.0 110.708 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -66.41 -40.23 89.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.957 0.799 . . . . 0.0 110.625 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -57.74 -52.62 64.72 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.701 1.2 . . . . 0.0 108.822 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -64.15 -43.86 93.92 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.069 0.948 . . . . 0.0 111.017 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -57.95 -35.99 71.91 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 117.078 -1.439 . . . . 0.0 113.108 -179.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -54.99 -43.73 73.85 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 121.028 1.74 . . . . 0.0 111.423 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 8.6 m80 -62.62 -37.5 86.55 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 122.082 -0.386 . . . . 0.0 110.237 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 93.0 mm-40 -71.31 -40.87 70.52 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.339 -0.85 . . . . 0.0 111.199 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 62.9 m170 -53.83 -41.01 66.92 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 124.989 1.316 . . . . 0.0 112.292 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 7.6 mp -56.75 -25.83 55.85 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.229 0.922 . . . . 0.0 112.654 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 11.3 mp -90.1 -1.12 57.9 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.725 1.21 . . . . 0.0 112.883 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 23.82 73.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 128.972 2.909 . . . . 0.0 113.476 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -71.39 64.75 0.41 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.655 1.582 . . . . 0.0 110.518 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 55.8 tt0 25.22 58.89 0.05 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 129.112 2.965 . . . . 0.0 111.522 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 9.1 m -83.2 55.72 3.24 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 1.2 t -165.24 100.43 0.73 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 16.6 tt -166.78 156.47 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 127.789 2.436 . . . . 0.0 105.742 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -146.48 158.42 43.89 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 20.0 p . . . . . 0 C--O 1.255 1.368 0 C-N-CA 128.783 2.833 . . . . 0.0 103.518 179.277 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.921 0 N-CA-C 110.927 -0.869 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 15.9 m -103.31 -156.17 0.55 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.103 1.361 . . . . 0.0 108.024 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -68.7 175.39 3.57 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.64 1.176 . . . . 0.0 110.439 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -30.01 69.42 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.673 1.189 . . . . 0.0 108.095 177.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 26.2 t70 36.43 78.32 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 130.851 3.66 . . . . 0.0 113.726 178.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 40.6 m -157.62 136.8 11.77 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.498 1.919 . . . . 0.0 106.368 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -115.69 158.27 23.03 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -138.13 161.26 37.26 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.973 0.909 . . . . 0.0 108.961 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 69.3 mt -139.08 153.36 48.03 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -146.94 99.49 3.19 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 127.861 2.465 . . . . 0.0 105.798 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.49 151.09 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 124.467 1.107 . . . . 0.0 111.146 -178.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.49 102.06 8.01 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 122.212 1.006 . . . . 0.0 110.266 178.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.63 110.02 0.57 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.848 -2.501 . . . . 0.0 106.848 178.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 -55.53 -57.46 11.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 121.358 2.579 . . . . 0.0 112.43 -179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 98.7 mttt -66.37 -39.51 89.16 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.001 -0.437 . . . . 0.0 110.026 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -56.5 -50.71 71.0 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.976 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.08 -43.88 97.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.15 0.886 . . . . 0.0 111.464 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.33 -51.62 69.01 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.551 0.614 . . . . 0.0 110.823 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 83.9 mt -66.9 -54.53 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.58 1.152 . . . . 0.0 110.742 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.34 -32.66 68.73 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.189 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 31.4 mtp -66.3 -52.08 50.92 Favored 'General case' 0 C--N 1.345 0.383 0 CA-C-N 119.764 1.166 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -60.69 -41.56 95.4 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 119.303 -0.959 . . . . 0.0 110.712 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.07 -60.79 2.64 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.659 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1116 ' ' LYS . . . . . 0.413 ' HE3' ' HB ' ' B' ' 103' ' ' VAL . 15.7 tptp -53.88 -45.11 70.94 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.298 0.954 . . . . 0.0 112.724 -178.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.05 -49.75 74.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.661 0.6 . . . . 0.0 109.481 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.9 m -61.71 -34.84 76.5 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.85 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -66.07 -42.07 89.91 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.928 1.291 . . . . 0.0 108.508 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.32 -44.01 89.19 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.83 -38.02 89.09 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.424 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttp -77.26 -20.05 55.69 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 120.548 1.522 . . . . 0.0 109.957 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -81.89 -26.07 34.45 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.077 -1.014 . . . . 0.0 111.079 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -92.08 -33.55 14.74 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.316 -0.865 . . . . 0.0 110.441 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 80.5 t -85.32 147.14 46.47 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.93 -88.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.018 3.145 . . . . 0.0 114.818 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -170.64 58.64 0.29 Allowed Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.341 1.456 . . . . 0.0 110.864 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.3 -90.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.421 2.747 . . . . 0.0 113.39 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.6 -25.1 67.24 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.7 t -54.61 -56.4 10.54 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.675 1.19 . . . . 0.0 108.937 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 13.2 t0 -69.4 -44.64 71.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.683 0.674 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 7.6 t -55.82 -50.44 70.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.118 0.567 . . . . 0.0 111.621 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 17.9 t80 -69.08 -43.75 73.92 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -45.58 69.51 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 119.411 1.005 . . . . 0.0 110.56 179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -64.76 -53.12 52.15 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 119.623 1.101 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.5 -40.89 75.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.44 1.496 . . . . 0.0 111.39 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.04 -32.29 39.5 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.341 1.856 . . . . 0.0 110.251 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -57.08 -39.25 74.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 58.0 mt -53.62 -21.44 6.74 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.58 -10.46 59.57 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.489 1.116 . . . . 0.0 111.99 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' D' D 1141 ' ' GLN . . . . . 0.417 ' CD ' ' H ' ' D' 1142 ' ' ARG . 0.0 OUTLIER -102.15 172.84 6.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.564 1.146 . . . . 0.0 111.045 -179.632 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' D' D 1142 ' ' ARG . . . . . 0.417 ' H ' ' CD ' ' D' 1141 ' ' GLN . 10.0 ptt180 . . . . . 0 C--O 1.248 1.005 0 C-N-CA 127.921 2.488 . . . . 0.0 106.787 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -79.64 -3.41 47.04 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.323 -0.86 . . . . 0.0 109.55 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -103.51 -0.76 29.4 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.121 2.168 . . . . 0.0 113.762 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -112.14 122.4 47.63 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.94 127.29 32.12 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 43.0 mt -120.47 173.91 6.87 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.297 1.439 . . . . 0.0 109.634 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -139.84 149.82 43.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.12 96.55 47.57 Favored Pre-proline 0 CA--C 1.536 0.439 0 C-N-CA 124.772 1.229 . . . . 0.0 108.653 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.71 110.97 1.69 Allowed 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.3 3.333 . . . . 0.0 112.9 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.9 t -144.84 158.77 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.849 1.204 . . . . 0.0 110.46 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 50.0 ttt-85 -135.05 103.44 5.56 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.062 1.345 . . . . 0.0 108.651 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.22 132.6 2.65 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 108.181 -1.968 . . . . 0.0 108.181 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt85 -70.63 -51.35 28.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 121.132 2.466 . . . . 0.0 109.885 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.09 -36.3 77.43 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 m -63.29 -52.22 62.86 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.218 -0.896 . . . . 0.0 109.787 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -58.17 -47.79 82.3 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 119.719 1.145 . . . . 0.0 110.337 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -54.15 -57.19 12.07 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.803 0.69 . . . . 0.0 112.319 -179.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -66.95 -43.8 82.22 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.076 0.55 . . . . 0.0 111.929 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.2 tp -55.83 -49.21 73.89 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.785 0.834 . . . . 0.0 110.016 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 tt -70.48 -47.87 58.5 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.032 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -55.35 -44.84 76.33 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.887 1.221 . . . . 0.0 113.657 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -75.4 -32.17 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -68.29 -41.88 80.32 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.462 -1.399 . . . . 0.0 109.252 178.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.34 -55.5 17.88 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 125.653 1.581 . . . . 0.0 110.791 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 p -54.16 -43.41 70.59 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.626 0.648 . . . . 0.0 110.594 179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.01 -56.49 8.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.808 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -53.71 -43.39 68.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.406 1.003 . . . . 0.0 111.743 -178.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.9 -53.68 19.79 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.165 -0.922 . . . . 0.0 108.842 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -54.93 -49.08 72.19 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.122 1.328 . . . . 0.0 110.835 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -64.03 -27.18 68.94 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.047 0.84 . . . . 0.0 110.995 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -77.39 -49.26 15.26 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.516 1.053 . . . . 0.0 110.687 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.67 67.14 7.43 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 125.084 1.353 . . . . 0.0 113.027 -179.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -79.47 60.92 8.01 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 123.342 2.694 . . . . 0.0 108.459 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -142.46 -68.41 0.36 Allowed 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 t60 -48.63 -57.78 5.73 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.561 1.145 . . . . 0.0 112.992 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.74 -49.12 78.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.331 1.452 . . . . 0.0 111.813 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.6 mm -60.68 -43.51 95.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 124.924 1.289 . . . . 0.0 109.699 -178.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.62 -53.16 61.44 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 125.524 1.53 . . . . 0.0 108.407 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.6 m -63.3 -34.67 78.2 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.085 -0.96 . . . . 0.0 110.96 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -61.53 -49.16 77.81 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 120.618 1.554 . . . . 0.0 107.942 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.61 -45.86 92.28 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.238 1.015 . . . . 0.0 109.093 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -60.34 -44.8 95.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.543 1.537 . . . . 0.0 111.93 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.24 -45.89 91.29 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.076 1.351 . . . . 0.0 110.528 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -60.05 -50.95 71.7 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.05 -0.66 . . . . 0.0 110.635 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.52 -35.27 80.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 118.505 -0.759 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -52.03 -40.05 60.49 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-N 119.293 0.951 . . . . 0.0 111.022 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -52.81 -47.04 67.92 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.425 0.557 . . . . 0.0 109.88 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -75.11 -37.01 61.61 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 178.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -58.68 -36.61 74.45 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.339 -0.838 . . . . 0.0 111.247 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -61.04 -34.67 75.22 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.084 0.857 . . . . 0.0 110.598 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.8 tp -68.18 -29.59 68.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.134 0.574 . . . . 0.0 110.301 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.74 16.54 25.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.542 1.937 . . . . 0.0 110.881 179.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -59.84 149.21 32.0 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.118 -0.989 . . . . 0.0 110.954 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -131.01 176.38 8.3 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.719 1.208 . . . . 0.0 109.375 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -74.74 -173.23 1.78 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.479 1.112 . . . . 0.0 108.091 178.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.5 t -66.11 174.36 2.59 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 122.486 1.136 . . . . 0.0 111.528 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.1 t -93.27 -165.49 1.34 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.71 2.404 . . . . 0.0 107.204 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 tt -79.03 14.67 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.059 0 C-N-CA 124.538 1.135 . . . . 0.0 109.926 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 -102.49 119.9 39.61 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 127.034 2.133 . . . . 0.0 106.837 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.0 p . . . . . 0 C--O 1.258 1.509 0 CA-C-O 114.461 -2.685 . . . . 0.0 107.228 178.613 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.945 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 32.0 m -61.79 -33.82 74.8 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 117.767 0.784 . . . . 0.0 111.478 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 49.91 56.32 8.07 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.126 1.77 . . . . 0.0 111.634 178.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -67.34 -26.61 66.58 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -178.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.17 145.78 47.84 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.9 161.85 36.95 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -113.16 131.08 55.99 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -107.22 159.74 16.12 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.016 0.926 . . . . 0.0 112.574 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 mp -143.65 156.17 44.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 126.004 1.722 . . . . 0.0 106.97 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 100.85 2.86 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.452 1.901 . . . . 0.0 106.574 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 3.6 m -149.22 151.55 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -178.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt85 -118.52 101.7 8.34 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 122.68 1.228 . . . . 0.0 109.066 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.13 106.59 0.42 Allowed Glycine 0 N--CA 1.451 -0.366 1 N-CA-C 102.924 -4.07 . . . . 0.0 102.924 176.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -60.26 -56.69 18.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.099 2.949 . . . . 0.0 111.353 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -62.93 -39.9 95.98 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -61.99 -52.38 64.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.019 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.5 -51.39 59.73 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 120.206 1.366 . . . . 0.0 111.819 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -58.36 -53.49 57.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.671 0.668 . . . . 0.0 111.03 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.2 mt -61.3 -54.11 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 O-C-N 121.438 -0.789 . . . . 0.0 110.731 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 82.8 mt -54.97 -41.7 71.49 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.384 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 14.2 mtp -57.2 -51.26 70.05 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 120.928 1.695 . . . . 0.0 108.848 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.33 -52.33 66.1 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 122.611 0.365 . . . . 0.0 110.291 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 43.2 mt -58.6 -42.89 89.17 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 122.775 0.43 . . . . 0.0 111.12 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -62.5 -57.43 11.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.6 1.16 . . . . 0.0 110.889 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -60.45 -41.17 93.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 118.649 0.658 . . . . 0.0 110.016 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 2.9 t -61.02 -42.24 98.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.986 -0.446 . . . . 0.0 109.874 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.26 -35.92 71.57 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 117.351 -1.309 . . . . 0.0 109.92 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -63.52 -40.01 95.91 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.252 1.387 . . . . 0.0 108.931 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 36.3 mt -66.89 -53.35 33.07 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 5.7 tpt -56.89 -34.66 68.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.041 0.936 . . . . 0.0 110.355 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.43 -41.73 84.32 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.485 1.514 . . . . 0.0 110.857 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.45 -33.03 64.68 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.529 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 20.3 m -86.79 148.7 46.52 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-N 119.521 1.055 . . . . 0.0 111.831 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -75.94 -106.1 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.05 2.5 . . . . 0.0 106.875 178.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.73 74.44 7.12 Favored Pre-proline 0 CA--C 1.542 0.638 0 O-C-N 119.71 -1.869 . . . . 0.0 111.431 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -81.12 -100.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 124.725 3.617 . . . . 0.0 111.539 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.7 tt -56.11 -34.71 66.3 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 120.724 -1.235 . . . . 0.0 109.499 179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 73.5 t -51.83 -54.44 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 126.114 1.765 . . . . 0.0 109.698 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.09 -49.52 77.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.036 0.934 . . . . 0.0 110.007 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 25.9 t -56.03 -50.54 70.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.363 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -67.01 -35.01 78.97 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.541 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -58.08 -48.53 79.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.643 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.75 -42.6 70.27 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.078 0.854 . . . . 0.0 111.763 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -57.17 -45.42 83.69 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 118.64 0.655 . . . . 0.0 111.233 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -77.32 -31.72 54.8 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.092 0.957 . . . . 0.0 110.773 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -57.72 -37.78 74.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 119.792 1.178 . . . . 0.0 109.188 178.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.8 -18.21 53.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.737 0.815 . . . . 0.0 112.237 179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 19.9 tp -78.0 -19.21 54.87 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.461 1.104 . . . . 0.0 111.141 179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.88 173.55 7.71 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 121.036 -1.04 . . . . 0.0 109.84 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.176 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 98.3 p . . . . . 0 N--CA 1.47 0.572 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -96.6 -4.01 41.9 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.722 1.209 . . . . 0.0 108.54 177.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 25.9 t0 -109.02 -22.21 12.26 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.347 1.459 . . . . 0.0 113.103 -178.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -85.02 138.43 32.45 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.307 0.958 . . . . 0.0 109.004 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 26.9 tp -78.22 108.29 11.43 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.99 165.04 11.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.288 0.949 . . . . 0.0 111.456 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -142.58 156.67 45.12 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.455 1.502 . . . . 0.0 108.17 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -135.0 105.79 10.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.393 -179.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -79.58 116.5 3.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.437 2.758 . . . . 0.0 110.941 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.8 t -145.03 147.13 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.593 1.088 . . . . 0.0 111.039 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -133.97 101.61 5.12 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.5 126.97 1.49 Allowed Glycine 0 CA--C 1.519 0.315 0 N-CA-C 105.447 -3.061 . . . . 0.0 105.447 177.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -65.68 -51.57 58.4 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 121.54 2.67 . . . . 0.0 108.791 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.22 -42.82 83.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.338 0.655 . . . . 0.0 109.758 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 8.0 m -55.78 -47.71 76.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.213 1.405 . . . . 0.0 108.785 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.0 t80 -69.32 -50.48 46.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.515 1.126 . . . . 0.0 111.068 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.68 -51.0 66.88 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.952 1.301 . . . . 0.0 112.761 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.4 ttm -65.6 -51.3 60.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.804 0.442 . . . . 0.0 110.147 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -41.54 95.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.253 -178.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.79 -38.25 79.84 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.502 1.501 . . . . 0.0 108.85 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -59.38 -42.14 90.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.164 0.893 . . . . 0.0 108.735 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 94.1 mt -72.66 -38.28 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.797 0.839 . . . . 0.0 110.016 178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -61.45 -54.43 43.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 O-C-N 121.071 -1.018 . . . . 0.0 109.492 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -53.08 60.86 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.132 1.373 . . . . 0.0 111.058 -178.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 35.7 p -55.24 -51.56 66.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.99 -41.58 82.06 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 118.774 -0.632 . . . . 0.0 112.439 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.33 -44.93 95.36 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.59 -48.86 65.62 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.665 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 7.7 tmm? -55.36 -44.64 76.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.587 0.63 . . . . 0.0 109.977 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -79.9 -19.9 47.1 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 118.122 -0.942 . . . . 0.0 113.43 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 72.1 t80 -86.3 -27.73 24.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.437 1.017 . . . . 0.0 110.169 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 25.3 tp -135.62 61.26 42.03 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 125.548 1.539 . . . . 0.0 110.177 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.69 58.03 6.25 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.476 2.784 . . . . 0.0 107.707 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.36 -71.64 0.47 Allowed 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 127.984 2.514 . . . . 0.0 107.431 -178.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 71.2 t60 -52.7 -57.73 9.14 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.711 1.204 . . . . 0.0 113.884 -178.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -45.19 83.73 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.113 -0.992 . . . . 0.0 111.686 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 9.4 mm -64.13 -34.45 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 124.908 1.283 . . . . 0.0 110.037 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -69.77 -56.69 6.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 14.0 m -54.01 -40.87 67.38 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.571 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 3.7 t80 -60.25 -54.41 46.11 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.69 1.586 . . . . 0.0 109.819 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -34.72 78.03 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.518 0.727 . . . . 0.0 111.908 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -72.29 -46.64 54.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.811 1.244 . . . . 0.0 109.841 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -60.01 -42.12 93.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.336 1.054 . . . . 0.0 110.937 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -67.31 -47.59 70.12 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.136 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -57.74 -40.83 80.6 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.124 0.57 . . . . 0.0 110.493 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -54.49 -32.58 58.21 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.036 0.934 . . . . 0.0 111.623 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -56.34 -53.36 58.25 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.291 0.951 . . . . 0.0 110.009 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 9.2 m170 -72.63 -26.6 61.73 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 119.079 -0.486 . . . . 0.0 109.871 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -65.92 -36.41 83.3 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.988 0.813 . . . . 0.0 109.987 179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 32.6 m170 -59.11 -32.64 70.01 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 119.044 0.838 . . . . 0.0 111.215 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 46.2 tp -67.66 -28.04 67.37 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.753 0.706 . . . . 0.0 109.935 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.25 16.09 27.19 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.478 2.311 . . . . 0.0 110.743 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -55.61 99.29 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.648 1.179 . . . . 0.0 112.952 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -80.33 171.6 14.85 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -76.26 -172.37 2.06 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 177.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 6.8 t -64.79 173.97 2.04 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 122.393 1.092 . . . . 0.0 112.136 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 22.9 t -93.95 -166.39 1.49 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.712 2.405 . . . . 0.0 107.582 179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 16.6 tt -77.4 4.31 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 C-N-CA 124.451 1.101 . . . . 0.0 110.362 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 15.3 mp0 -90.35 123.46 34.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.234 1.813 . . . . 0.0 107.62 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 24.2 p . . . . . 0 C--O 1.255 1.373 0 CA-C-O 114.68 -2.581 . . . . 0.0 107.126 178.518 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.538 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 20.1 m -128.37 -42.34 1.5 Allowed 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 123.508 0.723 . . . . 0.0 111.363 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 41.0 m-20 49.91 60.0 4.12 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.685 1.594 . . . . 0.0 108.107 -179.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -64.01 -27.66 69.27 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 113.29 -1.777 . . . . 0.0 108.668 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -68.85 116.99 9.96 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 125.261 1.424 . . . . 0.0 107.41 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.89 163.61 16.29 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.977 0.911 . . . . 0.0 110.914 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -101.58 128.45 47.83 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.903 -2.629 . . . . 0.0 103.903 178.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -103.59 145.04 30.63 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.984 1.314 . . . . 0.0 108.874 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.6 mp -140.1 151.39 45.31 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -139.95 111.1 6.99 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.712 1.605 . . . . 0.0 108.861 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.82 150.86 10.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 124.485 1.114 . . . . 0.0 111.805 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -124.53 99.73 6.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 122.093 0.949 . . . . 0.0 108.501 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.43 119.76 1.4 Allowed Glycine 0 CA--C 1.509 -0.318 0 N-CA-C 105.932 -2.867 . . . . 0.0 105.932 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -63.52 -56.91 12.29 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 121.533 2.666 . . . . 0.0 108.426 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -69.36 -38.29 78.0 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.155 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.63 -52.57 65.1 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.709 -178.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.39 -41.86 98.97 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.149 -0.969 . . . . 0.0 111.832 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -60.66 -53.94 51.33 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.507 0.723 . . . . 0.0 111.555 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 55.1 mt -70.32 -45.92 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 118.459 -0.782 . . . . 0.0 109.679 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.66 -44.71 81.62 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 119.576 1.08 . . . . 0.0 110.363 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 27.1 mtp -60.53 -45.98 91.83 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.008 1.276 . . . . 0.0 109.736 178.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -56.63 -49.63 74.41 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 34.1 mt -60.17 -48.46 81.63 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.58 0.752 . . . . 0.0 111.243 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 24.3 ttpt -54.62 -59.62 4.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 110.653 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.54 -47.97 75.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.008 0.923 . . . . 0.0 110.07 -179.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 34.4 t -53.35 -53.22 54.21 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.005 0.922 . . . . 0.0 111.119 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.82 -30.94 66.02 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 117.614 -1.184 . . . . 0.0 111.89 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -62.41 -41.65 98.84 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.969 1.713 . . . . 0.0 108.384 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 35.8 mt -67.95 -47.04 69.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.6 tpt -57.01 -35.84 69.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.377 0.671 . . . . 0.0 111.639 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.23 -43.08 74.77 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.872 1.669 . . . . 0.0 110.438 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.33 -25.32 60.58 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 33.5 m -92.65 148.85 36.97 Favored Pre-proline 0 CA--C 1.537 0.474 0 CA-C-N 119.226 0.921 . . . . 0.0 108.992 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -74.13 -105.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.059 2.506 . . . . 0.0 108.041 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -151.07 66.04 7.05 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 120.239 -1.538 . . . . 0.0 106.946 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.22 -103.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.427 2.751 . . . . 0.0 113.064 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.3 tt -62.52 -25.73 68.18 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.96 -1.088 . . . . 0.0 109.438 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 45.8 t -53.86 -56.96 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 C-N-CA 125.69 1.596 . . . . 0.0 109.192 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.22 -39.12 86.23 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.08 0.237 . . . . 0.0 111.08 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 1.9 t -60.12 -50.9 71.87 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.609 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.23 -33.09 74.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.097 0.959 . . . . 0.0 109.345 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -48.5 80.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 117.089 -1.434 . . . . 0.0 110.009 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -72.13 -46.42 56.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 120.052 1.296 . . . . 0.0 110.918 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -46.54 64.72 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.497 0.719 . . . . 0.0 110.324 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . 0.295 1.7 tp60 -81.08 -26.03 36.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -59.46 -36.2 75.51 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 120.403 1.456 . . . . 0.0 107.183 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 31.0 mt -61.97 -18.08 59.17 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.103 0.961 . . . . 0.0 112.243 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 8.3 tp -68.09 -25.89 65.55 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.239 1.415 . . . . 0.0 111.635 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.38 172.6 9.01 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.721 1.608 . . . . 0.0 110.532 -179.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.331 0 CA-C-O 118.216 -0.897 . . . . 0.0 109.221 -179.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.467 0.39 0 CA-C-O 120.893 0.378 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.0 -38.73 89.22 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 129.083 2.953 . . . . 0.0 111.061 -178.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -93.09 1.11 57.36 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.813 1.645 . . . . 0.0 112.863 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -81.47 146.64 30.12 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.871 1.268 . . . . 0.0 111.233 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -84.74 121.52 27.8 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 45.2 mt -108.15 161.94 14.52 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -140.5 104.89 4.85 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tp -87.87 110.22 33.42 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.362 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -87.04 123.26 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.424 3.416 . . . . 0.0 112.045 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 t -146.1 154.81 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 O-C-N 120.546 -1.346 . . . . 0.0 107.682 178.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 -135.08 100.67 4.63 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 134.72 3.37 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 106.674 -2.571 . . . . 0.0 106.674 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -69.87 -52.76 22.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 121.397 2.599 . . . . 0.0 110.595 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -66.43 -42.94 86.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.598 0.759 . . . . 0.0 110.004 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 62.8 m -65.32 -34.04 77.39 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.213 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -73.07 -48.35 36.67 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.96 1.709 . . . . 0.0 108.774 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -53.43 -56.08 19.78 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 123.936 0.894 . . . . 0.0 110.553 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 20.9 ptm -60.85 -42.68 98.28 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.127 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.07 -47.01 81.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 119.989 1.268 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -55.84 19.81 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.538 0.608 . . . . 0.0 110.278 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.68 -47.7 79.27 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 125.614 1.566 . . . . 0.0 112.828 -178.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.42 -36.18 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.333 0.653 . . . . 0.0 109.89 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.7 -48.89 65.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.17 -1.581 . . . . 0.0 108.197 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -55.22 -52.03 64.68 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.426 1.49 . . . . 0.0 110.327 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.2 p -56.72 -41.53 77.63 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.7 0.682 . . . . 0.0 111.572 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.1 -48.72 61.82 Favored 'General case' 0 CA--C 1.521 -0.163 0 O-C-N 121.412 -0.805 . . . . 0.0 111.432 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.39 -53.98 51.08 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 126.762 2.025 . . . . 0.0 111.928 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.53 -38.72 90.47 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 117.303 -1.332 . . . . 0.0 110.184 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 10.8 tmm? -63.44 -45.17 92.13 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.034 1.288 . . . . 0.0 107.792 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.89 -22.41 66.99 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.59 0.632 . . . . 0.0 110.508 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.82 -25.7 22.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.478 -1.389 . . . . 0.0 111.132 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 mt -131.89 63.33 68.5 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 126.926 2.09 . . . . 0.0 107.722 -179.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -73.51 7.13 2.38 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 123.281 2.654 . . . . 0.0 114.561 -178.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -112.9 -56.31 2.43 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 119.518 1.054 . . . . 0.0 110.081 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -48.24 -52.63 20.25 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -178.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.43 -48.46 77.67 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.815 -0.553 . . . . 0.0 111.768 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.2 mm -62.52 -34.43 64.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.732 0.813 . . . . 0.0 111.203 -179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -61.72 -56.73 16.56 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.583 1.553 . . . . 0.0 108.472 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.7 m -61.35 -42.26 98.39 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -56.69 -53.42 57.94 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.438 0.695 . . . . 0.0 111.982 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -65.17 -39.62 93.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 118.762 -0.637 . . . . 0.0 110.821 -178.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.26 -49.26 78.33 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.34 -48.79 79.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.2 1.8 . . . . 0.0 110.559 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.16 -46.06 79.42 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 123.898 0.879 . . . . 0.0 110.148 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 tt0 -69.18 -42.64 75.58 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.021 1.328 . . . . 0.0 111.114 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -56.34 -52.1 65.79 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 125.69 1.596 . . . . 0.0 108.864 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -54.54 -49.32 70.56 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.485 0.714 . . . . 0.0 109.59 179.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -64.41 -28.19 69.52 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.192 0.905 . . . . 0.0 112.305 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -71.72 -59.6 2.67 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.085 -1.009 . . . . 0.0 108.98 178.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -58.42 -20.32 43.66 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.663 1.185 . . . . 0.0 112.715 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 54.6 tp -61.33 -30.06 70.27 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.729 1.611 . . . . 0.0 111.047 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.7 tp -92.23 -69.92 0.72 Allowed 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.45 0.568 . . . . 0.0 109.664 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -162.46 167.45 23.53 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.851 1.661 . . . . 0.0 107.042 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.9 ttpt 70.7 114.74 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 127.712 2.405 . . . . 0.0 110.412 -179.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -119.52 167.76 11.66 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 107.281 -1.378 . . . . 0.0 107.281 179.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.6 m -131.43 -64.81 0.79 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m 46.37 39.08 5.95 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.4 tt -61.01 141.48 17.3 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 O-C-N 121.635 -0.666 . . . . 0.0 109.619 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -129.55 158.27 39.73 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.432 1.893 . . . . 0.0 107.914 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.257 1.482 0 C-N-CA 126.512 1.925 . . . . 0.0 107.628 179.889 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.256 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 8.0 t -156.39 -178.78 7.58 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -137.34 73.94 1.46 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 102.741 -3.059 . . . . 0.0 102.741 178.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -127.38 -14.37 5.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -178.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -88.16 156.07 19.44 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 119.687 1.131 . . . . 0.0 110.397 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m -84.67 152.07 24.03 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -109.45 143.79 38.57 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -117.48 161.64 19.25 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.175 1.39 . . . . 0.0 110.23 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 12.0 tp -161.22 117.32 2.18 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.16 103.17 9.29 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.214 1.406 . . . . 0.0 109.367 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . 0.442 HG12 ' HE2' ' D' 1116 ' ' LYS . 93.4 t -150.03 150.62 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.29 1.036 . . . . 0.0 110.318 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -108.44 102.67 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.806 1.242 . . . . 0.0 108.673 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.5 122.16 1.72 Allowed Glycine 0 N--CA 1.467 0.723 0 CA-C-O 115.802 -2.665 . . . . 0.0 109.067 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -68.03 -59.62 3.12 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 122.504 3.152 . . . . 0.0 113.387 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -73.24 -43.86 60.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -51.39 -51.0 58.52 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.799 1.639 . . . . 0.0 110.471 -178.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -72.11 -39.77 68.63 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.764 1.165 . . . . 0.0 111.411 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.53 -53.48 50.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.871 0.843 . . . . 0.0 109.544 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 12.5 mt -61.6 -48.27 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.752 1.621 . . . . 0.0 109.427 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -57.49 -41.04 79.94 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 117.983 -1.008 . . . . 0.0 111.311 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 20.2 mtp -66.25 -44.73 82.86 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.357 1.435 . . . . 0.0 110.179 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -55.63 -45.98 77.5 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 73.3 mt -72.59 -27.39 62.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.032 1.333 . . . . 0.0 112.84 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -60.68 2.92 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.46 1.104 . . . . 0.0 109.032 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -63.09 -38.14 90.01 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 124.403 1.065 . . . . 0.0 108.755 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 41.9 t -52.78 -54.25 36.64 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.922 0.783 . . . . 0.0 112.219 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.15 -33.09 72.88 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.036 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.7 -43.08 97.68 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.02 1.282 . . . . 0.0 109.601 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.26 -50.22 66.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.742 1.217 . . . . 0.0 109.566 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 10.4 tpt -62.77 -29.94 71.08 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.668 0.387 . . . . 0.0 110.936 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -76.13 -41.7 49.21 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.637 0.775 . . . . 0.0 110.714 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 pp -78.12 -33.47 50.53 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -86.74 146.63 41.66 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 119.298 0.954 . . . . 0.0 109.208 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.31 -172.74 0.37 Allowed 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.2 2.6 . . . . 0.0 109.575 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -107.64 62.51 0.22 Allowed Pre-proline 0 CA--C 1.548 0.876 0 O-C-N 120.288 -1.507 . . . . 0.0 113.519 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.37 -87.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.757 2.304 . . . . 0.0 112.792 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.3 -39.48 83.14 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 121.486 -0.759 . . . . 0.0 110.239 -178.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 m -56.05 -48.02 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 117.051 -1.452 . . . . 0.0 111.716 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -75.39 -32.22 60.71 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 120.869 1.668 . . . . 0.0 111.795 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 t -65.41 -46.89 78.21 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -69.35 -39.39 78.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.168 0.987 . . . . 0.0 109.459 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.02 -48.68 77.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 119.24 0.927 . . . . 0.0 110.122 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -68.85 -46.53 68.26 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -57.89 -44.17 86.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.393 0.542 . . . . 0.0 111.404 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -72.99 -33.61 65.91 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.864 1.666 . . . . 0.0 110.626 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -61.8 -37.24 83.65 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 119.524 1.056 . . . . 0.0 110.08 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.79 -24.21 63.92 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.675 0.39 . . . . 0.0 110.474 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 11.8 tp -70.85 -12.96 61.85 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.623 1.169 . . . . 0.0 110.959 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -141.1 81.28 1.78 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.432 1.493 . . . . 0.0 109.424 179.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? . . . . . 0 C--O 1.247 0.959 0 C-N-CA 127.975 2.51 . . . . 0.0 108.423 -179.554 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 119.562 -0.256 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.05 -43.15 77.59 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 126.916 2.087 . . . . 0.0 113.368 -178.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.26 1.31 56.63 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.619 1.567 . . . . 0.0 113.093 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -79.05 138.65 38.09 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.721 0.808 . . . . 0.0 112.535 -178.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 58.1 tp -73.39 112.84 9.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 177.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.3 mt -107.43 162.18 14.16 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.067 1.347 . . . . 0.0 108.783 -179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -137.71 144.35 41.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.202 1.001 . . . . 0.0 108.544 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 13.8 tp -118.57 96.25 49.73 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.79 115.27 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 123.298 2.665 . . . . 0.0 109.452 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.7 t -143.51 153.14 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 123.677 0.791 . . . . 0.0 110.462 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 41.5 ttt-85 -132.93 101.79 5.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 103.92 -2.622 . . . . 0.0 103.92 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.66 121.94 1.0 Allowed Glycine 0 CA--C 1.516 0.155 0 N-CA-C 105.479 -3.048 . . . . 0.0 105.479 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -66.43 -52.32 47.71 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 121.913 2.856 . . . . 0.0 109.801 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.37 -47.76 75.29 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -55.26 -41.47 72.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.343 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 29.8 t80 -73.9 -50.0 22.22 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.799 1.181 . . . . 0.0 111.095 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -54.47 -50.71 67.1 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.87 0.759 . . . . 0.0 110.707 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 25.7 ptm -65.52 -43.06 91.22 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.433 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.66 -42.08 99.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 120.014 1.279 . . . . 0.0 109.804 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.48 -56.46 21.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -56.74 -48.8 76.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.247 0.619 . . . . 0.0 112.5 -178.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 97.9 mt -67.36 -36.32 76.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.362 1.065 . . . . 0.0 112.143 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -48.8 46.33 Favored 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 120.44 -1.412 . . . . 0.0 108.267 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.14 -41.94 97.65 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.727 0.811 . . . . 0.0 109.298 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 95.4 p -59.97 -46.38 89.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.495 1.043 . . . . 0.0 110.818 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 8.1 tt -67.89 -51.07 52.29 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.745 0.818 . . . . 0.0 111.647 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -59.91 -53.73 54.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 124.009 0.924 . . . . 0.0 111.513 -178.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.72 -31.65 72.77 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 119.112 0.869 . . . . 0.0 111.581 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -69.01 -45.57 70.19 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 178.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -65.34 -29.85 70.63 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.611 -0.68 . . . . 0.0 110.222 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.9 t80 -80.28 -31.87 38.24 Favored 'General case' 0 C--N 1.339 0.116 0 C-N-CA 124.193 0.997 . . . . 0.0 111.267 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 15.6 mt -129.7 68.95 81.24 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 124.999 1.32 . . . . 0.0 110.812 -178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -78.39 2.77 7.76 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.45 2.766 . . . . 0.0 115.181 -178.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -98.72 -46.47 5.67 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 120.626 1.557 . . . . 0.0 110.876 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 77.8 m80 -62.69 -58.66 6.72 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -177.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.87 -51.6 66.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.882 0.765 . . . . 0.0 111.573 -178.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.48 -37.75 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 124.254 1.021 . . . . 0.0 112.35 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -69.21 -53.84 17.86 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.285 0.948 . . . . 0.0 109.076 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.2 m -52.61 -43.69 65.53 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.447 0.567 . . . . 0.0 110.425 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 3.5 t80 -61.68 -54.27 44.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.306 1.442 . . . . 0.0 111.049 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -62.74 -33.46 75.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.959 0.345 . . . . 0.0 110.487 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -65.3 -44.93 86.35 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -59.14 -48.72 80.59 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 119.78 1.173 . . . . 0.0 109.535 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -53.81 -51.61 62.98 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.386 0.674 . . . . 0.0 111.16 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.84 -41.64 82.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.061 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.33 -40.81 96.64 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.1 0.864 . . . . 0.0 109.307 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -59.91 -47.29 86.39 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 2.2 m80 -59.98 -42.46 94.24 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.472 0.709 . . . . 0.0 110.111 178.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -62.29 -53.18 58.84 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.067 0.947 . . . . 0.0 110.427 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 49.3 m170 -65.21 -24.67 67.42 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.41 1.084 . . . . 0.0 111.012 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 40.9 tp -63.18 -28.95 70.4 Favored 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.064 -1.022 . . . . 0.0 109.484 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 49.1 tp -82.34 -65.43 1.01 Allowed 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 177.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.08 171.67 10.8 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.197 0.999 . . . . 0.0 109.642 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? 59.85 87.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.178 1.791 . . . . 0.0 112.503 178.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -82.14 99.67 9.37 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 2.5 m -65.8 -30.58 71.24 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 28.1 m 0.33 76.28 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 129.918 3.287 . . . . 0.0 117.68 -179.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 18.8 tt -79.93 154.26 4.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -136.06 159.42 41.76 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.498 1.119 . . . . 0.0 110.033 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.247 0.959 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.348 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 39.1 t -152.92 175.06 13.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.99 48.46 2.34 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 127.747 2.419 . . . . 0.0 107.7 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -79.57 -30.61 41.69 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.454 -0.779 . . . . 0.0 109.151 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.32 131.48 51.12 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 128.288 2.635 . . . . 0.0 112.566 -178.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 1.3 m -83.17 146.4 28.65 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -102.64 145.42 29.68 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.918 -1.114 . . . . 0.0 108.894 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -124.58 143.64 50.59 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 125.274 1.43 . . . . 0.0 107.324 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 9.4 tp -144.9 142.26 29.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 118.327 -0.844 . . . . 0.0 108.928 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -139.51 107.97 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.031 1.332 . . . . 0.0 109.138 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 82.7 t -149.81 147.12 16.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 119.001 0.818 . . . . 0.0 109.095 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -102.19 103.61 14.14 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.775 0.83 . . . . 0.0 111.598 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.82 117.34 1.06 Allowed Glycine 0 N--CA 1.464 0.52 0 CA-C-O 115.994 -2.559 . . . . 0.0 108.125 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -67.48 -57.07 7.19 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 122.827 3.314 . . . . 0.0 111.452 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 30.7 mttp -68.44 -44.8 74.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -51.76 -50.88 59.8 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.025 1.33 . . . . 0.0 110.265 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.68 -45.91 77.36 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.88 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -58.42 -48.37 80.91 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.881 1.219 . . . . 0.0 109.931 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 65.7 mt -56.34 -53.95 33.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 C-N-CA 124.858 1.263 . . . . 0.0 108.658 179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.85 -39.44 81.32 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.927 -179.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.6 mtp -65.21 -49.54 69.31 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 120.607 1.548 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -53.8 -46.6 71.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.88 0.848 . . . . 0.0 109.433 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.8 -27.2 61.01 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.404 0.682 . . . . 0.0 112.215 -179.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1116 ' ' LYS . . . . . 0.442 ' HE2' HG12 ' B' ' 103' ' ' VAL . 0.1 OUTLIER -63.04 -60.01 4.03 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.555 1.07 . . . . 0.0 109.696 -179.776 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.12 -42.74 99.08 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 31.1 t -52.76 -52.36 56.88 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.69 0.677 . . . . 0.0 112.55 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.21 -35.46 76.23 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.665 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -64.37 -48.39 75.65 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.013 1.279 . . . . 0.0 109.183 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 59.3 mt -58.16 -52.34 65.95 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.078 1.351 . . . . 0.0 111.548 178.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.9 tpt -64.16 -26.34 68.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.146 0.979 . . . . 0.0 111.392 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.86 -40.47 28.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.179 0.9 . . . . 0.0 109.85 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1124 ' ' LEU . . . . . . . . . . . . 0.32 2.0 pp -73.71 -32.42 63.89 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.2 t -94.31 148.39 34.97 Favored Pre-proline 0 CA--C 1.537 0.455 0 CA-C-N 119.068 0.849 . . . . 0.0 108.81 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.17 -164.21 0.09 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 123.715 2.944 . . . . 0.0 110.747 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -116.14 66.2 3.0 Favored Pre-proline 0 CA--C 1.547 0.851 0 O-C-N 120.183 -1.573 . . . . 0.0 113.737 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -79.96 -85.62 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 121.813 1.675 . . . . 0.0 112.662 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 7.9 tt -64.86 -38.12 89.93 Favored 'General case' 0 C--N 1.347 0.497 0 O-C-N 121.095 -1.003 . . . . 0.0 109.721 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 m -54.71 -36.06 35.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.542 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.39 -41.95 38.22 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 119.06 0.845 . . . . 0.0 109.433 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.95 -47.64 82.33 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.08 -51.38 68.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.985 0.914 . . . . 0.0 108.561 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -43.55 67.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 123.651 0.78 . . . . 0.0 110.447 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -62.84 -54.06 44.69 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 118.493 0.588 . . . . 0.0 110.031 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 10.0 tp60 -59.63 -37.28 78.2 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -40.82 43.94 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.082 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -58.91 -39.49 81.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.344 1.429 . . . . 0.0 107.397 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.03 -15.23 55.77 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.187 -0.946 . . . . 0.0 112.75 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 15.5 tp -83.52 -19.59 35.43 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.094 1.358 . . . . 0.0 110.855 179.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -140.2 96.81 3.11 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.637 1.575 . . . . 0.0 107.962 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? . . . . . 0 C--O 1.256 1.395 0 CA-C-O 114.888 -2.482 . . . . 0.0 104.405 -177.961 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 . . . . . 0 C--O 1.233 0.211 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.5 tp -74.02 94.32 2.36 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.3 mt -93.03 167.45 11.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -134.0 159.58 40.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.44 90.29 49.04 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -71.28 108.27 2.32 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 125.249 3.966 . . . . 0.0 108.645 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.0 t -138.5 148.64 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 124.338 1.055 . . . . 0.0 110.516 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.2 102.06 4.88 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 175.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.46 124.49 1.25 Allowed Glycine 0 CA--C 1.522 0.472 0 N-CA-C 104.955 -3.258 . . . . 0.0 104.955 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -52.19 26.84 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 120.34 2.07 . . . . 0.0 111.476 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.84 -42.17 95.14 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -56.9 -47.79 79.7 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.24 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.93 -53.99 51.74 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.835 0.743 . . . . 0.0 111.211 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -55.33 -47.59 75.45 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -69.68 -44.16 71.02 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 118.237 0.472 . . . . 0.0 112.267 -179.391 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.88 -44.11 94.04 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.22 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -50.36 63.27 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.947 0.794 . . . . 0.0 109.757 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.59 -50.1 73.95 Favored 'General case' 0 C--O 1.225 -0.202 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.83 -32.25 57.35 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 CA-C-N 119.672 1.124 . . . . 0.0 110.155 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.561 ' HE2' HG11 ' C' 1010 ' ' VAL . 19.3 tptp -66.59 -46.55 75.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.69 -54.24 34.73 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.786 1.234 . . . . 0.0 110.924 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 m -53.61 -44.72 69.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 119.941 1.246 . . . . 0.0 112.086 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.53 -50.95 48.18 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.616 0.644 . . . . 0.0 110.017 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -54.42 -47.88 72.27 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.386 1.074 . . . . 0.0 110.817 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -64.62 -43.77 92.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.907 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 54.2 ttp -55.61 -48.19 75.3 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.115 0.87 . . . . 0.0 109.676 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -76.54 -14.39 60.02 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -86.33 -54.26 4.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 119.631 1.105 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 CA--C 1.534 0.35 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.991 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.3 t60 . . . . . 0 CA--C 1.535 0.384 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.0 m -59.79 -47.52 85.35 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 123.417 0.687 . . . . 0.0 111.006 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.408 HG13 ' H ' ' A' ' 37' ' ' ILE . 8.3 mt -60.3 -44.55 95.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 126.395 1.878 . . . . 0.0 111.933 -177.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.07 -58.72 7.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.5 m -55.83 -41.01 73.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.622 0.769 . . . . 0.0 111.162 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -65.34 -53.93 36.43 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.986 0.914 . . . . 0.0 110.993 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -61.73 -41.58 97.82 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.582 -0.699 . . . . 0.0 110.502 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.94 -54.24 33.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.014 0.926 . . . . 0.0 109.415 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -58.5 -44.39 89.42 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 119.649 1.113 . . . . 0.0 110.707 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -58.03 -36.39 72.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.441 1.019 . . . . 0.0 109.662 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.27 -53.73 33.35 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 CA--C 1.535 0.395 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.815 -179.693 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 56.4 m . . . . . 0 N--CA 1.451 -0.412 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -101.62 138.52 38.5 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -117.22 145.63 43.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.428 1.491 . . . . 0.0 109.577 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.3 mt -136.06 128.83 30.97 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 125.027 1.331 . . . . 0.0 107.469 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -129.46 100.52 5.58 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.22 149.87 11.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 124.065 0.946 . . . . 0.0 108.797 -179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -114.11 102.36 10.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.4 0.68 . . . . 0.0 110.739 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.57 113.76 0.75 Allowed Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 116.396 -2.335 . . . . 0.0 108.72 177.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -60.59 -56.42 21.55 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.669 2.735 . . . . 0.0 110.501 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -63.06 -52.03 64.36 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -51.96 -49.62 62.85 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.825 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -63.24 -44.84 94.09 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 120.623 1.556 . . . . 0.0 111.596 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -57.06 -50.69 71.98 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.346 0.976 . . . . 0.0 110.4 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.472 HG21 HD11 ' C' 1022 ' ' ILE . 81.2 mt -62.01 -58.27 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 127.058 2.143 . . . . 0.0 110.609 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.61 -36.79 77.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 116.647 -1.644 . . . . 0.0 110.043 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 64.0 mtp -63.08 -52.88 60.97 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 121.423 1.919 . . . . 0.0 110.316 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.45 -43.21 97.1 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.513 0.597 . . . . 0.0 111.827 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 74.6 mt -69.66 -34.49 74.07 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.67 0.668 . . . . 0.0 110.815 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 116' ' ' LYS . . . . . 0.42 ' HB2' HD21 ' D' 1112 ' ' LEU . 0.2 OUTLIER -66.24 -54.16 28.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.684 0.794 . . . . 0.0 109.78 180.0 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -60.93 -41.94 97.21 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.011 1.325 . . . . 0.0 108.818 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.6 t -52.78 -52.97 54.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.827 0.851 . . . . 0.0 110.992 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.2 -38.64 82.17 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.92 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -46.09 88.37 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.577 1.081 . . . . 0.0 109.071 178.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 121' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' B' ' 121' ' ' LEU . 3.7 mm? -67.45 -45.07 77.08 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 117.151 -1.404 . . . . 0.0 108.01 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 6.3 tpt -53.89 -33.35 56.27 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 120.101 1.319 . . . . 0.0 110.383 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.47 -31.92 48.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.847 0.859 . . . . 0.0 111.107 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 51.1 tp -87.88 -33.43 18.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 4.1 m -93.46 148.08 34.85 Favored Pre-proline 0 C--O 1.235 0.313 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.59 175.41 9.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 120.981 1.121 . . . . 0.0 110.071 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.36 33.47 0.05 OUTLIER Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 117.538 2.422 . . . . 0.0 117.538 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.26 -57.23 0.79 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 123.07 2.132 . . . . 0.0 112.551 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -28.89 69.9 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.974 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 9.9 t -63.25 -56.54 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.109 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.218 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.46 -35.68 77.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.157 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 9.6 t -61.71 -50.26 73.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 109.247 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.79 -40.41 72.58 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.896 -0.502 . . . . 0.0 109.759 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -52.89 -48.22 67.34 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.145 1.378 . . . . 0.0 111.448 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -77.7 -46.18 22.62 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 123.362 0.665 . . . . 0.0 112.09 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -55.59 -39.03 70.19 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.8 tm0? -80.55 -29.61 37.12 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 125.306 1.443 . . . . 0.0 109.048 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.28 -30.06 64.38 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.546 1.521 . . . . 0.0 108.035 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 14.3 mt -59.38 -13.66 9.2 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 118.917 0.78 . . . . 0.0 112.797 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.546 0.812 0 C-N-CA 126.218 1.807 . . . . 0.0 108.94 177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 . . . . . 0 N--CA 1.464 0.243 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 61.5 tp -77.17 95.29 4.24 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 16.7 mt -96.48 127.41 42.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.723 2.009 . . . . 0.0 108.874 -178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -106.2 122.61 46.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.591 0.756 . . . . 0.0 109.465 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.3 mt -95.72 100.24 5.99 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 117.552 -1.213 . . . . 0.0 108.842 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -75.33 121.94 6.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.809 2.34 . . . . 0.0 110.252 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1010 ' ' VAL . . . . . 0.561 HG11 ' HE2' ' A' ' 23' ' ' LYS . 4.8 t -145.63 152.37 14.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 O-C-N 120.951 -1.093 . . . . 0.0 110.716 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.18 102.02 4.87 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.397 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.22 130.49 2.13 Favored Glycine 0 CA--C 1.52 0.365 0 CA-C-O 116.311 -2.383 . . . . 0.0 107.646 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -52.53 22.77 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.655 2.727 . . . . 0.0 111.911 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -72.54 -31.14 65.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.54 -41.55 98.45 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.822 0.849 . . . . 0.0 110.203 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 11.1 t80 -69.61 -52.04 29.57 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.057 0.844 . . . . 0.0 108.947 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -54.3 -57.42 11.29 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.81 -45.87 91.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.03 0.532 . . . . 0.0 111.999 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.5 mm? -67.29 -38.2 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.962 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.24 -49.03 47.52 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 119.988 1.267 . . . . 0.0 111.079 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.21 -46.97 75.93 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.407 1.003 . . . . 0.0 110.959 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1022 ' ' ILE . . . . . 0.472 HD11 HG21 ' B' ' 111' ' ' ILE . 84.5 mt -68.69 -45.39 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.2 tptp -58.02 -45.84 86.25 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 124.537 1.135 . . . . 0.0 110.615 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -67.36 -50.98 57.55 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.434 1.094 . . . . 0.0 108.894 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 30.2 m -53.96 -42.6 69.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.368 0.985 . . . . 0.0 111.134 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -68.89 -52.13 32.82 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.452 1.101 . . . . 0.0 109.894 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -58.55 -43.55 89.36 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 122.956 0.502 . . . . 0.0 110.886 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.09 -40.02 86.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.762 -1.113 . . . . 0.0 109.516 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 49.0 ttp -63.13 -35.73 81.26 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.005 0.821 . . . . 0.0 110.163 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -87.6 -12.87 44.37 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.28 0.945 . . . . 0.0 112.496 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 7.2 t80 -98.58 -57.85 2.1 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.859 1.264 . . . . 0.0 113.029 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.391 0 C-N-CA 123.727 0.811 . . . . 0.0 111.933 -178.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.0 t60 . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 44.4 m -59.14 -43.51 92.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.044 -0.979 . . . . 0.0 108.463 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 42.4 mt -61.54 -45.41 98.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 119.791 1.178 . . . . 0.0 109.334 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -56.26 -55.37 34.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.806 0.842 . . . . 0.0 110.266 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 41.2 m -65.24 -34.85 79.35 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.819 -0.55 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.68 -52.61 56.32 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.473 1.109 . . . . 0.0 109.929 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -55.65 -47.33 76.83 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -59.32 -57.15 14.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.915 0.886 . . . . 0.0 109.966 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -50.2 -50.47 49.39 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.722 0.809 . . . . 0.0 111.349 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -63.13 -40.7 98.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.612 0.642 . . . . 0.0 110.97 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -62.89 -43.95 97.42 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.545 0.738 . . . . 0.0 109.455 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 . . . . . 0 N--CA 1.448 -0.548 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.135 178.942 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.5 m . . . . . 0 CA--C 1.534 0.363 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -101.82 134.38 45.09 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -120.84 123.3 42.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 125.837 1.655 . . . . 0.0 109.209 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1101 ' ' LEU . . . . . 0.435 HD23 ' H ' ' D' 1102 ' ' GLN . 0.5 OUTLIER -126.65 147.83 49.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.174 0.99 . . . . 0.0 108.884 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' D' D 1102 ' ' GLN . . . . . 0.435 ' H ' HD23 ' D' 1101 ' ' LEU . 7.4 pm0 -136.06 110.87 8.73 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.098 2.159 . . . . 0.0 109.428 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -155.2 151.21 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.471 1.509 . . . . 0.0 110.639 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.67 102.44 7.6 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.732 1.151 . . . . 0.0 110.535 177.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.56 122.87 2.04 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 105.197 -3.161 . . . . 0.0 105.197 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.57 -58.19 5.7 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 120.989 2.395 . . . . 0.0 114.3 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -63.06 -41.02 99.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.596 0.635 . . . . 0.0 109.327 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 1.2 m120 -53.02 -48.58 67.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.288 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.6 t80 -63.76 -48.38 77.2 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 119.514 1.052 . . . . 0.0 111.727 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.0 -47.29 68.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.197 0.908 . . . . 0.0 111.313 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.4 mt -68.57 -57.56 8.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 126.104 1.762 . . . . 0.0 110.79 -179.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1112 ' ' LEU . . . . . 0.42 HD21 ' HB2' ' B' ' 116' ' ' LYS . 5.1 mp -56.68 -39.0 73.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 118.925 0.784 . . . . 0.0 110.797 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 42.1 mtp -63.55 -52.67 60.08 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.362 0.983 . . . . 0.0 110.237 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.08 -33.33 75.25 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.428 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1115 ' ' LEU . . . . . 0.429 HD22 ' CG2' ' C' 1022 ' ' ILE . 31.6 mt -70.32 -38.37 74.91 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 120.215 1.37 . . . . 0.0 109.951 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1116 ' ' LYS . . . . . 0.403 ' HE3' ' CG ' ' D' 1120 ' ' GLU . 21.8 tptt -62.67 -52.49 63.08 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -57.01 -42.37 80.22 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.412 1.485 . . . . 0.0 109.693 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 44.8 t -52.64 -54.63 30.71 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.529 1.132 . . . . 0.0 110.255 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.09 -43.39 74.61 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.411 -0.805 . . . . 0.0 110.977 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1120 ' ' GLU . . . . . 0.403 ' CG ' ' HE3' ' D' 1116 ' ' LYS . 2.0 mm-40 -55.36 -48.15 74.69 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.172 0.896 . . . . 0.0 111.7 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1121 ' ' LEU . . . . . 0.457 ' HA ' HD13 ' D' 1121 ' ' LEU . 3.4 mm? -72.35 -48.76 39.4 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 116.208 -1.853 . . . . 0.0 109.058 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.5 tpt -54.51 -33.06 59.2 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.846 1.657 . . . . 0.0 109.436 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -74.87 -32.96 62.01 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 117.897 -1.049 . . . . 0.0 110.572 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 43.7 tp -87.03 -32.55 19.95 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.179 1.354 . . . . 0.0 113.624 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 9.7 m -92.41 148.45 36.44 Favored Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 120.752 -1.218 . . . . 0.0 108.322 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -68.84 177.34 5.03 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 N-CA-C 109.426 -1.028 . . . . 0.0 109.426 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -113.4 47.71 0.38 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 116.361 1.986 . . . . 0.0 116.361 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.41 -51.18 0.77 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.744 2.296 . . . . 0.0 113.014 -178.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -29.6 69.43 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.136 -0.978 . . . . 0.0 110.625 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.6 t -61.17 -54.48 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 124.034 0.934 . . . . 0.0 108.669 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.63 -45.73 92.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.02 0.827 . . . . 0.0 111.428 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.8 t -59.07 -50.46 74.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.095 0.958 . . . . 0.0 110.484 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.1 t80 -68.39 -42.16 79.48 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.035 1.334 . . . . 0.0 110.853 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.49 -49.15 68.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 119.107 0.867 . . . . 0.0 111.023 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -74.43 -39.93 62.29 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.1 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -62.79 -29.9 71.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.822 0.449 . . . . 0.0 111.42 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -80.19 -39.06 29.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -56.75 -32.67 65.8 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.814 -0.554 . . . . 0.0 109.518 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 15.1 mt -64.26 -12.19 38.83 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.605 1.162 . . . . 0.0 113.097 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 CA--C 1.537 0.468 0 C-N-CA 124.618 1.167 . . . . 0.0 109.122 178.284 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.3 95.4 0.43 Allowed 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -104.14 129.16 51.85 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.292 1.037 . . . . 0.0 110.243 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -103.38 118.6 37.12 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -101.93 96.02 6.23 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 125.806 1.642 . . . . 0.0 111.118 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -75.38 113.95 3.88 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 125.12 3.88 . . . . 0.0 111.466 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.9 t -145.11 154.91 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.278 -0.889 . . . . 0.0 109.487 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -135.34 101.88 4.97 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 125.046 1.339 . . . . 0.0 107.817 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.94 121.36 0.97 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 107.64 -2.184 . . . . 0.0 107.64 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.92 -51.57 31.81 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 120.232 2.016 . . . . 0.0 108.45 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.98 -32.82 73.5 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -61.52 -53.37 57.27 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.135 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -67.65 -39.16 84.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.02 -57.23 12.56 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.332 0.515 . . . . 0.0 110.397 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -71.48 -33.38 69.24 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 119.322 -0.37 . . . . 0.0 111.494 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 tp -61.22 -53.34 58.11 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.172 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.88 -34.95 77.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.225 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.25 -49.22 72.6 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.602 1.092 . . . . 0.0 110.607 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.0 mt -83.25 -35.05 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 123.612 0.765 . . . . 0.0 112.169 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.52 -46.63 87.54 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 120.186 -1.571 . . . . 0.0 109.359 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -67.83 -48.9 64.9 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 117.346 -1.311 . . . . 0.0 109.812 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.3 p -53.03 -41.26 64.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 120.04 1.291 . . . . 0.0 112.158 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 26' ' ' LEU . 1.1 tm? -74.19 -49.67 22.53 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.898 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -54.46 -47.61 72.71 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.031 0.832 . . . . 0.0 109.913 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.426 HD22 HG22 ' B' ' 130' ' ' VAL . 55.8 mt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.709 1.604 . . . . 0.0 110.857 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.9 ttt -56.75 -47.1 80.84 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.586 1.154 . . . . 0.0 109.079 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -64.84 -40.28 94.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.866 1.267 . . . . 0.0 111.532 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.8 -30.33 65.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.696 1.199 . . . . 0.0 112.307 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.3 tp . . . . . 0 C--O 1.238 0.449 0 C-N-CA 123.657 0.783 . . . . 0.0 109.918 -179.362 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.0 m80 . . . . . 0 CA--C 1.538 0.498 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.6 m -57.15 -48.53 78.46 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.252 1.387 . . . . 0.0 107.798 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.4 mt -65.35 -44.48 94.69 Favored 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 124.38 1.072 . . . . 0.0 108.616 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.04 -39.27 77.97 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.449 0.568 . . . . 0.0 111.98 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.4 m -66.6 -52.48 44.81 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -55.76 -51.38 67.59 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 123.408 0.683 . . . . 0.0 111.042 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -53.21 -48.44 68.13 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.737 0.415 . . . . 0.0 111.3 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -64.02 -50.81 67.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.539 0.735 . . . . 0.0 111.924 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -61.53 -40.49 94.84 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.019 0.928 . . . . 0.0 111.846 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -45.37 67.95 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -58.02 -29.15 65.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.412 1.005 . . . . 0.0 111.709 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.763 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 59.2 m . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 120.517 0.198 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -123.37 142.24 51.17 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 124.488 1.115 . . . . 0.0 108.567 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -127.2 147.45 50.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.06 0.944 . . . . 0.0 109.777 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.16 144.87 51.15 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.357 1.863 . . . . 0.0 107.371 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.08 98.92 4.12 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.223 1.009 . . . . 0.0 112.321 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -151.72 150.35 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.174 -1.579 . . . . 0.0 112.108 -178.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.428 ' HB3' ' HA ' ' D' 1098 ' ' THR . 0.0 OUTLIER -124.2 100.85 6.9 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 121.924 0.869 . . . . 0.0 108.883 177.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.64 116.54 1.04 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 103.753 -3.739 . . . . 0.0 103.753 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.7 -56.78 14.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 120.473 2.137 . . . . 0.0 111.002 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -61.11 -48.96 79.25 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 -54.86 -45.5 74.57 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.428 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -61.83 -55.05 33.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.356 -1.307 . . . . 0.0 111.216 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -48.45 -54.32 14.6 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.291 1.036 . . . . 0.0 111.049 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.3 mt -60.62 -57.73 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 126.13 1.772 . . . . 0.0 110.028 -179.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.44 -25.77 67.44 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.195 -0.94 . . . . 0.0 112.136 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 5.5 ttt -68.91 -52.42 29.63 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.657 1.117 . . . . 0.0 108.218 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -65.58 -37.67 87.31 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 118.894 -1.123 . . . . 0.0 110.344 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.0 mt -63.89 -38.89 92.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.756 -0.59 . . . . 0.0 111.241 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -54.21 28.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 O-C-N 121.344 -0.848 . . . . 0.0 110.025 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -54.66 -42.83 71.79 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 125.377 1.673 . . . . 0.0 108.337 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 40.8 t -58.04 -48.65 79.45 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.242 1.017 . . . . 0.0 110.899 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.26 -43.43 86.48 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.65 0.659 . . . . 0.0 111.26 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.07 -45.63 91.24 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.198 0.908 . . . . 0.0 109.598 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -48.05 75.02 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.635 -0.666 . . . . 0.0 109.818 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -24.0 67.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.129 0.972 . . . . 0.0 111.098 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -89.31 -20.65 23.8 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.747 1.158 . . . . 0.0 110.521 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.08 -33.18 11.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 120.034 1.288 . . . . 0.0 112.149 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.1 t -95.49 148.08 34.04 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.729 1.612 . . . . 0.0 108.487 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.25 -178.1 3.98 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 123.481 2.788 . . . . 0.0 111.635 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -129.0 62.84 64.43 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 116.752 2.13 . . . . 0.0 116.752 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.19 -54.83 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.517 2.811 . . . . 0.0 113.728 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 tt -56.33 -34.09 66.24 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.627 0.771 . . . . 0.0 109.767 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.426 HG22 HD22 ' A' ' 28' ' ' LEU . 14.8 t -61.25 -47.57 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 126.101 1.76 . . . . 0.0 109.3 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -63.49 -36.29 83.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.646 1.112 . . . . 0.0 109.74 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 2.8 t -70.62 -39.05 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.881 0.472 . . . . 0.0 110.166 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -70.1 -50.76 37.57 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.315 1.446 . . . . 0.0 109.371 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.17 -48.12 68.25 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.447 1.499 . . . . 0.0 110.445 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 -68.34 -48.05 65.87 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.732 1.151 . . . . 0.0 110.648 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -56.0 -40.47 73.41 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.004 -0.435 . . . . 0.0 110.924 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -80.74 -27.71 36.74 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.541 1.137 . . . . 0.0 111.264 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -63.68 -33.3 75.32 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.654 1.57 . . . . 0.0 108.483 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.7 mt -63.96 -15.68 59.78 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.043 0.937 . . . . 0.0 111.756 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 CA--C 1.539 0.546 0 C-N-CA 125.094 1.357 . . . . 0.0 109.433 178.558 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 36.3 tt0 . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 21.9 tp -73.78 95.15 2.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.82 176.36 5.32 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.306 2.242 . . . . 0.0 109.276 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -138.42 144.83 40.36 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.633 1.573 . . . . 0.0 107.224 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.9 tp -126.11 105.78 25.32 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.418 1.487 . . . . 0.0 110.494 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -82.66 115.43 2.47 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 123.868 3.045 . . . . 0.0 111.43 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 96.4 t -139.93 150.86 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 120.299 -1.501 . . . . 0.0 108.056 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.39 104.77 5.71 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.205 0.602 . . . . 0.0 110.775 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -165.96 125.42 1.34 Allowed Glycine 0 CA--C 1.519 0.319 0 N-CA-C 105.881 -2.888 . . . . 0.0 105.881 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -68.52 -51.78 39.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 121.779 2.79 . . . . 0.0 109.881 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.0 -41.71 97.4 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.561 0.696 . . . . 0.0 109.138 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -61.93 -46.82 87.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 124.344 1.057 . . . . 0.0 111.647 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 17.1 t80 -66.77 -41.91 86.93 Favored 'General case' 0 C--O 1.23 0.065 0 CA-C-N 120.157 1.344 . . . . 0.0 111.863 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -55.54 -56.99 13.86 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.563 0.745 . . . . 0.0 110.716 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 tmm? -70.47 -40.26 73.77 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 118.507 -0.758 . . . . 0.0 112.594 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 8.5 tp -58.11 -40.95 82.49 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.242 0.928 . . . . 0.0 108.904 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 6.6 mt -66.87 -47.14 72.8 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.919 -1.039 . . . . 0.0 109.142 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -55.52 -49.14 73.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.382 0.992 . . . . 0.0 111.976 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.76 -36.89 66.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 O-C-N 121.866 -0.521 . . . . 0.0 111.183 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -66.59 -57.9 6.29 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.108 -0.995 . . . . 0.0 109.122 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -54.96 -55.23 33.08 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.327 1.451 . . . . 0.0 109.731 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 33.1 p -53.37 -49.9 66.2 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.958 1.254 . . . . 0.0 112.49 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.28 -52.07 63.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 118.197 0.453 . . . . 0.0 110.767 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.84 -40.67 80.66 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.452 0.701 . . . . 0.0 112.089 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 31.5 mt -71.36 -44.5 64.91 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.036 -1.04 . . . . 0.0 110.012 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -43.25 85.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -66.61 -44.45 82.06 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.404 1.882 . . . . 0.0 110.951 179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 t80 -68.64 -44.46 74.12 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 12.6 tp . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 124.621 1.168 . . . . 0.0 110.869 -178.287 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 13.3 m80 . . . . . 0 CA--C 1.534 0.363 0 CA-C-O 119.775 -0.155 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -51.55 66.81 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.75 1.22 . . . . 0.0 108.801 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 48.3 mt -65.39 -45.31 93.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 125.743 1.617 . . . . 0.0 108.676 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.48 -45.3 69.57 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 124.911 1.284 . . . . 0.0 111.314 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.7 m -65.68 -52.9 47.88 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.752 1.221 . . . . 0.0 109.784 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -55.78 -48.97 74.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.027 0.931 . . . . 0.0 111.208 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -55.22 -48.53 73.76 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.3 0.64 . . . . 0.0 110.468 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -33.72 75.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.97 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.76 -48.74 77.86 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.522 0.729 . . . . 0.0 109.089 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -60.25 -46.58 89.3 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.896 0.479 . . . . 0.0 109.718 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -58.64 -33.49 70.12 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.198 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 CA--C 1.541 0.6 0 CA-C-N 119.826 1.194 . . . . 0.0 108.443 178.696 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D 1098 ' ' THR . . . . . 0.428 ' HA ' ' HB3' ' B' ' 104' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.362 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -119.83 130.49 54.93 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -120.6 142.79 49.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.401 1.08 . . . . 0.0 109.227 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.31 134.83 54.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.703 1.201 . . . . 0.0 108.197 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -128.25 111.52 13.49 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.7 m -155.38 151.68 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 126.209 1.804 . . . . 0.0 108.71 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.88 101.68 7.38 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.86 122.32 1.81 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 106.833 -2.507 . . . . 0.0 106.833 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -67.51 -58.0 5.51 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 120.799 2.299 . . . . 0.0 113.683 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 51.6 mttm -65.83 -42.93 89.93 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -51.98 -49.01 64.08 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.227 -0.892 . . . . 0.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 75.2 t80 -62.94 -49.63 73.99 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.301 0.955 . . . . 0.0 112.558 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -56.77 -49.71 74.47 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.208 0.913 . . . . 0.0 110.551 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.8 mt -58.98 -48.81 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 1.8 mm? -62.3 -34.7 77.1 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.313 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -52.85 57.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.189 0.904 . . . . 0.0 108.562 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -62.97 -42.47 99.84 Favored 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.72 -0.792 . . . . 0.0 111.232 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 34.9 mt -64.1 -44.59 91.85 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 118.209 0.459 . . . . 0.0 112.157 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.62 -51.96 55.6 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 118.703 0.683 . . . . 0.0 110.475 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.05 -52.12 59.55 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.583 1.177 . . . . 0.0 108.815 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 42.2 t -56.5 -44.7 80.94 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.143 -1.408 . . . . 0.0 112.839 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.87 -44.9 91.68 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.899 1.227 . . . . 0.0 110.487 -179.285 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.77 -48.26 81.45 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.635 0.774 . . . . 0.0 109.511 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -44.95 89.26 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.2 1.0 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.4 -30.55 70.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.769 1.227 . . . . 0.0 111.47 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 40.0 tp10 -78.7 -34.69 45.85 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.843 -0.599 . . . . 0.0 109.914 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.1 pp -85.75 -29.81 23.58 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.1 p -94.2 144.26 27.74 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 119.917 1.235 . . . . 0.0 109.059 -178.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.65 175.51 7.92 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.484 1.456 . . . . 0.0 110.667 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -117.93 39.96 0.31 Allowed Pre-proline 0 CA--C 1.553 1.083 0 N-CA-C 118.07 2.619 . . . . 0.0 118.07 -176.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -57.54 -48.76 15.8 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.727 2.284 . . . . 0.0 115.08 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 9.1 tt -65.1 -38.98 92.45 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.4 t -58.11 -48.32 84.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 123.773 0.829 . . . . 0.0 109.01 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.85 -45.08 78.55 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 2.5 m -63.05 -48.0 80.58 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 119.183 -0.437 . . . . 0.0 110.238 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.38 -52.59 64.73 Favored 'General case' 0 C--O 1.227 -0.109 0 C-N-CA 124.834 1.253 . . . . 0.0 110.948 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -53.23 -46.04 68.94 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.37 1.868 . . . . 0.0 110.822 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.75 -50.78 26.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.626 0.648 . . . . 0.0 110.226 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -56.08 -35.15 66.66 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.818 -0.552 . . . . 0.0 110.888 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -78.1 -32.89 50.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.165 0.986 . . . . 0.0 110.286 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -59.57 -33.09 71.0 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.7 mt -61.2 -9.93 5.75 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.423 0.689 . . . . 0.0 112.544 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.744 0 C-N-CA 126.582 1.953 . . . . 0.0 109.665 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.9 tp -77.58 108.91 11.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.034 1.334 . . . . 0.0 111.429 -178.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -103.34 162.64 12.84 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -135.97 102.25 4.98 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.338 -0.852 . . . . 0.0 111.094 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mp -75.73 119.4 76.97 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 119.897 1.226 . . . . 0.0 108.626 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -86.85 117.42 1.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 122.836 2.358 . . . . 0.0 107.839 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.4 t -141.13 152.07 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 119.955 1.252 . . . . 0.0 108.763 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.16 102.9 5.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.93 124.58 1.24 Allowed Glycine 0 C--O 1.225 -0.444 0 CA-C-O 115.695 -2.725 . . . . 0.0 107.682 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -69.88 -52.0 28.45 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 122.617 3.209 . . . . 0.0 111.288 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -76.17 -30.85 58.24 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.816 1.246 . . . . 0.0 109.29 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 m -67.0 -51.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -58.88 -37.9 77.61 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 119.036 0.835 . . . . 0.0 109.912 179.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -57.64 9.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.472 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -64.95 -44.09 90.57 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.497 0.59 . . . . 0.0 111.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.04 -51.4 69.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.2 1.0 . . . . 0.0 108.49 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -70.77 -45.56 64.51 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.323 0.965 . . . . 0.0 111.85 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -56.31 -48.85 75.87 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.657 1.117 . . . . 0.0 113.367 -177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.7 mt -74.4 -32.97 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.718 -0.614 . . . . 0.0 109.352 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.89 -48.23 79.89 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.98 -45.46 93.55 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 125.554 1.541 . . . . 0.0 109.139 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.2 t -53.17 -51.35 62.33 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.747 0.819 . . . . 0.0 110.72 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tt -61.6 -55.56 29.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.865 0.866 . . . . 0.0 109.946 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.89 -51.63 65.4 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 124.547 1.139 . . . . 0.0 112.588 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.05 -41.55 86.31 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.141 -0.974 . . . . 0.0 112.521 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.89 -45.5 93.48 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -67.23 -31.51 71.92 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 118.36 -0.829 . . . . 0.0 111.378 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -71.39 -27.59 63.43 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.159 0.89 . . . . 0.0 109.767 178.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.2 mt . . . . . 0 C--O 1.241 0.631 0 CA-C-N 119.743 1.156 . . . . 0.0 109.417 178.497 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.236 0.363 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -45.68 79.02 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.759 -0.588 . . . . 0.0 112.026 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.2 mm -67.49 -34.76 70.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 123.849 0.86 . . . . 0.0 111.048 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -58.7 -54.85 42.47 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -58.74 -41.11 85.72 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.649 0.78 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -60.42 -53.4 57.99 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.22 0.918 . . . . 0.0 110.558 179.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.07 -40.46 81.09 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.074 0.55 . . . . 0.0 109.867 -178.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.55 -47.92 65.64 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.77 -0.633 . . . . 0.0 109.712 179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.41 -46.8 76.6 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.41 1.484 . . . . 0.0 110.995 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -62.36 -49.72 74.45 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.713 0.805 . . . . 0.0 110.47 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.08 -41.87 98.62 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.635 1.174 . . . . 0.0 111.253 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 123.064 0.546 . . . . 0.0 111.896 -179.191 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -102.74 129.61 49.43 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -105.68 155.14 19.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.71 145.91 26.94 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.27 108.6 5.27 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.367 1.867 . . . . 0.0 109.892 -179.045 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.576 HG11 ' HE3' ' D' 1116 ' ' LYS . 54.6 t -155.37 146.37 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.54 1.136 . . . . 0.0 109.372 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -97.27 104.77 16.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.07 108.06 0.5 Allowed Glycine 0 C--O 1.225 -0.45 0 CA-C-O 116.448 -2.306 . . . . 0.0 111.451 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -64.53 -57.23 9.74 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.546 3.173 . . . . 0.0 110.775 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -50.09 66.64 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.927 0.891 . . . . 0.0 109.908 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -56.71 -43.57 80.69 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 118.481 -0.771 . . . . 0.0 112.031 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -61.47 -49.96 74.69 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.225 0.921 . . . . 0.0 109.483 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.62 -53.73 54.28 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 124.04 0.837 . . . . 0.0 112.349 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.34 -58.03 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.601 1.56 . . . . 0.0 110.921 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.31 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 117.606 -1.188 . . . . 0.0 111.184 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -70.25 -44.81 67.72 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 120.821 1.646 . . . . 0.0 108.169 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.04 -47.6 71.4 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 18.5 mt -67.99 -39.54 83.23 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.013 0.925 . . . . 0.0 111.454 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -57.93 -59.07 5.81 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.751 1.62 . . . . 0.0 109.012 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -54.27 -50.3 67.57 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.769 2.028 . . . . 0.0 110.369 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 16.4 m -59.07 -36.25 74.75 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -38.42 64.14 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.097 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.96 -42.75 98.9 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.48 -42.64 99.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.25 -38.11 89.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.64 0.776 . . . . 0.0 110.85 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.63 -38.16 70.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.775 0.83 . . . . 0.0 111.404 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -32.97 28.24 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 65.4 t -93.72 141.28 23.59 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 119.3 0.955 . . . . 0.0 108.524 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -67.72 -164.38 0.1 OUTLIER 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 122.841 2.361 . . . . 0.0 110.389 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -108.77 47.3 0.2 Allowed Pre-proline 0 CA--C 1.555 1.154 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -67.89 -71.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.314 2.676 . . . . 0.0 112.602 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.76 -38.69 79.01 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 7.5 t -52.89 -55.86 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 126.777 2.031 . . . . 0.0 109.975 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -66.01 -43.39 87.84 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.314 1.046 . . . . 0.0 111.583 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.1 t -56.73 -49.92 73.77 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.513 0.725 . . . . 0.0 109.986 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -64.77 -48.79 73.24 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.686 1.594 . . . . 0.0 108.111 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.0 66.3 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.761 1.224 . . . . 0.0 112.098 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.32 -56.62 10.26 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.91 0.777 . . . . 0.0 110.692 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -53.98 -41.39 67.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.096 0.558 . . . . 0.0 110.94 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -69.56 -41.63 75.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.569 1.148 . . . . 0.0 110.261 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -56.96 -31.45 65.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 119.434 1.015 . . . . 0.0 109.871 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.37 -11.49 6.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.15 0.886 . . . . 0.0 112.45 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.54 0.559 0 C-N-CA 125.57 1.548 . . . . 0.0 109.638 178.236 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.59 106.58 8.32 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.373 1.869 . . . . 0.0 110.462 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.07 154.27 19.9 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.025 1.73 . . . . 0.0 109.072 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -119.16 145.32 46.09 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.217 0.917 . . . . 0.0 111.519 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.8 mt -117.79 90.3 35.89 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.711 1.604 . . . . 0.0 110.661 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.0 106.72 2.27 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.952 3.768 . . . . 0.0 110.769 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 15.3 t -139.41 156.91 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.339 1.456 . . . . 0.0 108.917 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.57 101.56 4.83 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 123.156 0.583 . . . . 0.0 110.026 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.87 121.92 1.02 Allowed Glycine 0 CA--C 1.522 0.512 0 N-CA-C 108.363 -1.895 . . . . 0.0 108.363 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -69.19 -51.84 33.96 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.277 2.039 . . . . 0.0 111.255 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -70.7 -33.46 70.91 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.48 0.657 . . . . 0.0 109.465 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 33.1 m -60.1 -51.29 70.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.319 1.448 . . . . 0.0 108.552 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.12 -44.52 95.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.751 1.221 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -55.91 -57.18 13.16 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.6 ppp? -65.24 -39.12 92.28 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.682 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 19.7 tp -60.07 -49.6 77.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.671 -0.681 . . . . 0.0 112.078 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.63 -45.86 88.33 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.594 0.634 . . . . 0.0 109.856 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -55.2 -45.58 75.86 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.266 0.626 . . . . 0.0 111.549 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 25.8 mt -76.27 -46.73 32.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.207 0.603 . . . . 0.0 111.169 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -59.6 -37.24 78.02 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.35 0.66 . . . . 0.0 110.221 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -66.64 -51.97 50.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.3 t -53.44 -51.52 62.4 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.693 0.797 . . . . 0.0 112.131 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.18 -53.64 54.42 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.609 0.764 . . . . 0.0 110.764 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -58.84 -51.03 71.74 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.159 0.584 . . . . 0.0 111.967 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.8 -38.03 89.6 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.655 0.782 . . . . 0.0 111.4 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.2 tmt? -62.04 -46.79 87.58 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -74.93 -20.27 59.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.702 0.683 . . . . 0.0 110.888 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -76.64 -38.09 55.22 Favored 'General case' 0 C--N 1.346 0.445 0 O-C-N 120.568 -1.332 . . . . 0.0 108.396 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 17.5 mt . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 177.532 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.467 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.92 71.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.148 1.34 . . . . 0.0 111.281 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.34 -36.95 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.687 1.195 . . . . 0.0 110.45 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.5 -52.46 61.16 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.131 1.772 . . . . 0.0 108.762 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.8 m -64.11 -40.81 97.0 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -56.59 -53.65 55.18 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.409 1.084 . . . . 0.0 109.614 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -63.09 -40.09 96.61 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.444 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -60.75 -48.83 80.05 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.879 0.763 . . . . 0.0 109.031 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -62.09 -50.77 70.6 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.276 1.43 . . . . 0.0 111.283 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -57.02 -43.79 82.21 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.386 1.074 . . . . 0.0 108.978 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -64.66 -54.32 33.63 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.791 0.837 . . . . 0.0 109.3 178.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 21.3 tt0 . . . . . 0 CA--C 1.529 0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 112.675 -178.562 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.541 0.614 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -102.22 128.91 48.54 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.63 160.87 13.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.165 1.386 . . . . 0.0 109.453 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1101 ' ' LEU . . . . . 0.496 HD23 ' H ' ' D' 1102 ' ' GLN . 0.5 OUTLIER -152.8 152.67 31.87 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.409 -1.432 . . . . 0.0 107.893 176.847 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D 1102 ' ' GLN . . . . . 0.496 ' H ' HD23 ' D' 1101 ' ' LEU . 1.1 tm0? -151.39 98.0 2.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.779 1.232 . . . . 0.0 109.032 -177.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 55.2 t -148.73 149.65 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.983 1.713 . . . . 0.0 108.35 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -118.94 102.06 8.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.403 1.456 . . . . 0.0 112.606 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.37 124.93 2.42 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 107.164 -2.374 . . . . 0.0 107.164 176.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -67.3 -57.15 7.18 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 120.641 2.22 . . . . 0.0 110.979 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.58 -47.98 83.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.84 -50.52 63.57 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.482 1.513 . . . . 0.0 112.402 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 66.7 t80 -64.31 -48.01 77.24 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.17 -178.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.84 -53.03 54.61 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.022 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.98 -57.95 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 125.474 1.51 . . . . 0.0 110.597 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.24 -40.05 88.89 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.9 -1.048 . . . . 0.0 111.551 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.5 tmt? -64.1 -48.9 74.33 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 120.418 1.463 . . . . 0.0 109.726 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 14.3 ttmm -53.47 -51.89 61.28 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.492 0.717 . . . . 0.0 109.205 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 40.0 mt -62.7 -42.06 99.44 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.407 1.083 . . . . 0.0 111.57 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1116 ' ' LYS . . . . . 0.576 ' HE3' HG11 ' B' ' 103' ' ' VAL . 39.0 tptt -59.77 -53.3 59.55 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.748 1.219 . . . . 0.0 110.798 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -59.54 -51.38 70.07 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.385 1.474 . . . . 0.0 109.491 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.5 m -54.76 -44.61 73.78 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.09 0.956 . . . . 0.0 112.179 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -36.74 77.94 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.265 0.484 . . . . 0.0 110.988 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.65 -41.29 92.75 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.399 1.0 . . . . 0.0 109.127 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.72 -52.25 58.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.805 1.242 . . . . 0.0 110.376 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.5 -19.87 65.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.235 0.471 . . . . 0.0 111.75 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -79.64 -39.16 32.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.857 1.208 . . . . 0.0 109.065 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -75.62 -28.9 59.01 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 118.245 -0.883 . . . . 0.0 112.61 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.91 147.39 33.87 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.781 0.832 . . . . 0.0 110.057 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.45 -176.53 2.54 Favored 'Trans proline' 0 CA--C 1.547 1.14 0 C-N-CA 123.314 2.676 . . . . 0.0 110.496 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -104.22 40.94 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.256 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.84 -56.76 0.23 Allowed 'Trans proline' 0 C--N 1.355 0.875 0 CA-C-N 124.34 2.586 . . . . 0.0 113.096 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.57 -44.63 90.09 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.193 0.906 . . . . 0.0 108.824 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 t -53.07 -53.46 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 125.544 1.538 . . . . 0.0 110.504 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 7.4 t70 -63.53 -38.51 91.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.154 0.888 . . . . 0.0 111.44 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 21.5 t -62.89 -50.09 72.25 Favored 'General case' 0 N--CA 1.457 -0.119 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -62.14 -42.57 99.37 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -48.02 73.66 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.62 0.768 . . . . 0.0 110.011 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -69.66 -47.79 62.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.175 0.898 . . . . 0.0 110.672 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -55.7 -40.44 72.4 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.814 1.246 . . . . 0.0 111.231 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -80.64 -33.77 35.47 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.058 1.743 . . . . 0.0 110.611 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -60.5 -30.89 70.0 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.483 1.038 . . . . 0.0 108.671 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.3 -20.48 59.34 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.441 0.564 . . . . 0.0 111.956 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.539 0.543 0 C-N-CA 124.956 1.302 . . . . 0.0 112.014 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 CA--C 1.548 0.879 0 CA-C-O 120.878 0.371 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -81.53 101.54 10.01 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.18 -1.575 . . . . 0.0 107.002 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.64 168.79 11.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.711 1.205 . . . . 0.0 108.602 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -133.26 138.28 46.39 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.919 1.288 . . . . 0.0 108.653 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.8 90.43 48.37 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 124.823 1.249 . . . . 0.0 111.966 -178.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.74 112.39 2.66 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 124.5 3.467 . . . . 0.0 111.806 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.7 t -144.71 152.96 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.554 1.141 . . . . 0.0 108.501 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -135.18 100.88 4.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.67 1.123 . . . . 0.0 108.858 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.99 124.21 1.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-O 116.343 -2.365 . . . . 0.0 107.356 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -66.16 -51.09 61.11 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 121.399 2.6 . . . . 0.0 110.055 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.02 -41.65 92.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.202 1.001 . . . . 0.0 111.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -64.81 -50.0 68.47 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.125 1.37 . . . . 0.0 108.692 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -56.92 -51.82 67.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.643 -0.694 . . . . 0.0 111.028 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -55.3 -54.87 38.05 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 124.159 0.912 . . . . 0.0 111.942 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.434 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 37.6 ttm -59.55 -50.45 73.85 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.488 0.315 . . . . 0.0 111.391 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.82 -41.69 91.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.854 0.862 . . . . 0.0 110.813 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 tt -68.05 -45.72 73.1 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.46 -40.16 81.91 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.949 0.795 . . . . 0.0 111.512 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mt -72.77 -43.64 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -59.26 -46.23 89.06 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.545 -0.722 . . . . 0.0 109.316 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -56.03 -55.21 35.57 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.935 1.694 . . . . 0.0 109.65 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 p -64.18 -44.32 92.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.04 -47.88 84.34 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 118.669 0.668 . . . . 0.0 109.88 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -62.13 -43.57 98.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.502 HD21 HG22 ' B' ' 130' ' ' VAL . 0.6 OUTLIER -55.02 -49.92 70.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 118.733 0.697 . . . . 0.0 111.324 -179.769 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.0 ttm -57.4 -37.17 72.29 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.72 -34.55 64.85 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.022 -1.049 . . . . 0.0 111.628 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.43 ' C ' HD22 ' A' ' 32' ' ' LEU . 32.0 m-85 -77.07 -30.85 55.71 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.606 1.094 . . . . 0.0 110.894 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.43 HD22 ' C ' ' A' ' 31' ' ' TYR . 2.6 mm? . . . . . 0 CA--C 1.539 0.532 0 C-N-CA 126.68 1.992 . . . . 0.0 107.896 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 m -61.73 -45.54 93.5 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.086 -1.008 . . . . 0.0 109.359 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 9.1 mm -63.47 -41.07 91.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 123.837 0.855 . . . . 0.0 110.578 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.9 -36.92 78.01 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.609 1.564 . . . . 0.0 109.726 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.5 m -68.52 -52.39 32.66 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -60.36 -36.07 77.16 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.309 1.044 . . . . 0.0 111.55 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -48.96 76.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.684 1.194 . . . . 0.0 108.712 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -67.22 -55.88 12.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 118.499 -0.762 . . . . 0.0 111.205 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.92 -54.76 34.28 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.425 1.09 . . . . 0.0 111.576 -178.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.39 -39.55 93.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.516 -0.754 . . . . 0.0 111.373 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -64.02 -49.81 70.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.833 0.742 . . . . 0.0 109.347 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 . . . . . 0 CA--C 1.531 0.233 0 CA-C-N 118.798 0.726 . . . . 0.0 110.03 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 96.8 m . . . . . 0 N--CA 1.449 -0.51 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -102.1 150.93 22.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -123.56 137.14 54.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.52 1.128 . . . . 0.0 109.777 -177.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 19.7 tp -139.68 149.83 44.16 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 123.387 0.675 . . . . 0.0 110.805 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -145.68 108.29 4.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.367 -2.457 . . . . 0.0 104.367 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 m -149.66 150.67 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.804 1.184 . . . . 0.0 112.153 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.42 102.14 10.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.67 114.42 0.82 Allowed Glycine 0 C--O 1.227 -0.316 0 CA-C-O 116.006 -2.552 . . . . 0.0 109.873 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -68.05 -57.44 6.12 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 122.489 3.144 . . . . 0.0 108.404 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -70.3 -49.88 45.06 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.14 -51.32 58.65 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.059 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -67.12 -36.52 82.08 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.958 1.254 . . . . 0.0 111.682 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -60.71 -54.14 48.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 120.003 1.274 . . . . 0.0 110.768 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.77 -51.08 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 125.745 1.618 . . . . 0.0 110.611 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.3 mt -60.41 -33.88 73.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.718 -179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -45.92 70.21 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.771 1.623 . . . . 0.0 108.212 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 114' ' ' LYS . . . . . 0.45 ' HE3' ' HE2' ' C' 1018 ' ' MET . 29.1 ttpt -55.83 -49.49 73.13 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 30.7 mt -60.43 -36.34 77.96 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-O 119.009 -0.52 . . . . 0.0 110.97 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -59.99 4.46 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 119.477 1.035 . . . . 0.0 109.149 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -62.05 -43.81 98.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.619 -0.705 . . . . 0.0 111.423 -178.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 4.1 t -58.05 -45.29 87.27 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.405 1.002 . . . . 0.0 111.501 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -69.56 -46.34 66.63 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 117.846 -1.073 . . . . 0.0 109.679 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -57.01 -49.34 76.09 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.051 0.841 . . . . 0.0 109.939 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.51 -50.72 72.75 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 123.808 0.843 . . . . 0.0 110.726 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -69.6 -18.87 63.65 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -83.57 -47.38 11.36 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.034 1.334 . . . . 0.0 108.976 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.79 -32.67 72.56 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.699 -179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 77.6 t -92.76 144.51 28.71 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -67.61 -176.76 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.08 2.52 . . . . 0.0 111.274 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -111.5 48.37 0.29 Allowed Pre-proline 0 CA--C 1.551 1.0 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.93 -57.46 0.13 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.251 1.967 . . . . 0.0 113.782 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.7 tt -63.38 -31.96 73.26 Favored 'General case' 0 C--N 1.349 0.546 0 O-C-N 120.627 -1.296 . . . . 0.0 110.952 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.502 HG22 HD21 ' A' ' 28' ' ' LEU . 3.0 t -51.8 -56.78 4.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 C-N-CA 124.226 1.01 . . . . 0.0 111.943 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -73.9 -31.49 63.12 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.406 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.2 m -61.06 -47.88 84.32 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 122.398 1.094 . . . . 0.0 108.088 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -66.98 -38.36 85.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.466 1.506 . . . . 0.0 108.409 178.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -46.99 84.37 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.96 0.904 . . . . 0.0 109.188 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -59.03 -46.41 88.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -44.66 89.04 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.41 0.684 . . . . 0.0 110.906 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -35.36 73.71 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.169 0.987 . . . . 0.0 110.076 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -56.21 -40.31 73.85 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.2 -18.29 63.34 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.562 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp . . . . . 0 C--N 1.342 0.252 0 CA-C-N 119.904 1.229 . . . . 0.0 110.154 179.763 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 120.831 0.348 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 33.7 tp -76.54 95.49 3.91 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 103.968 -2.605 . . . . 0.0 103.968 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 58.4 mt -89.54 124.64 34.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 124.35 1.06 . . . . 0.0 108.222 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -104.57 125.93 51.18 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 128.917 2.887 . . . . 0.0 108.1 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.95 92.01 19.75 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.244 1.417 . . . . 0.0 109.641 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.24 118.17 4.86 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.648 2.232 . . . . 0.0 107.501 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 22.0 t -145.15 155.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 119.706 1.139 . . . . 0.0 109.978 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -134.98 102.58 5.27 Favored 'General case' 0 C--N 1.343 0.312 0 O-C-N 121.214 -0.929 . . . . 0.0 109.134 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.37 116.83 0.7 Allowed Glycine 0 CA--C 1.519 0.31 0 CA-C-O 115.496 -2.836 . . . . 0.0 107.001 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.4 tpp85 -61.98 -51.82 66.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.697 2.749 . . . . 0.0 111.976 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -69.2 -41.07 77.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.868 0.758 . . . . 0.0 109.502 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -55.47 -46.49 76.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.3 t80 -65.57 -47.93 74.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.54 0.736 . . . . 0.0 109.998 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -53.18 -50.71 64.07 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.774 1.23 . . . . 0.0 110.69 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1018 ' ' MET . . . . . 0.45 ' HE2' ' HE3' ' B' ' 114' ' ' LYS . 3.1 tmm? -69.33 -43.16 74.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.314 0.646 . . . . 0.0 111.41 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.12 -46.55 89.26 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.735 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.25 -46.33 81.01 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 119.268 0.94 . . . . 0.0 111.612 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -54.98 -44.46 74.47 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.111 0.868 . . . . 0.0 110.335 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.5 mt -72.63 -44.11 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.839 1.256 . . . . 0.0 111.166 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -57.77 -49.08 77.78 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.847 0.859 . . . . 0.0 109.34 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.25 -45.45 80.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.305 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.7 p -61.08 -40.6 94.3 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 120.328 1.422 . . . . 0.0 111.536 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 64.4 mt -67.87 -46.32 72.02 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.124 0.97 . . . . 0.0 109.471 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.18 -44.18 97.18 Favored 'General case' 0 C--O 1.224 -0.264 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1028 ' ' LEU . . . . . 0.525 HD13 HD23 ' C' 1032 ' ' LEU . 1.4 mm? -57.95 -44.3 86.88 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 119.12 0.873 . . . . 0.0 110.515 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 4.6 ttm -57.19 -36.07 70.37 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -76.96 -37.17 55.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.365 -1.302 . . . . 0.0 111.669 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1031 ' ' TYR . . . . . 0.468 ' C ' HD22 ' C' 1032 ' ' LEU . 52.5 m-85 -83.1 -19.59 36.47 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 120.942 1.701 . . . . 0.0 113.667 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C 1032 ' ' LEU . . . . . 0.525 HD23 HD13 ' C' 1028 ' ' LEU . 1.9 mm? . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.18 -43.18 96.08 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.126 -0.984 . . . . 0.0 110.373 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 13.0 mm -63.93 -34.33 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.369 1.068 . . . . 0.0 109.808 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -69.56 -44.34 71.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.246 1.018 . . . . 0.0 108.892 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.3 m -62.94 -46.74 86.32 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.1 t80 -59.24 -50.36 74.29 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.247 1.419 . . . . 0.0 111.226 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 tpp85 -56.43 -48.48 76.91 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.923 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -57.26 -55.73 31.03 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.313 0.96 . . . . 0.0 109.585 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.96 -54.36 39.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.846 1.259 . . . . 0.0 112.968 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -65.23 -47.01 78.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.118 1.367 . . . . 0.0 111.592 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -56.62 -47.17 80.26 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.589 1.156 . . . . 0.0 108.231 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 . . . . . 0 N--CA 1.453 -0.319 0 C-N-CA 124.576 1.15 . . . . 0.0 110.471 178.869 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -131.4 158.33 41.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.846 1.258 . . . . 0.0 109.069 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -124.44 160.58 27.9 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.152 1.381 . . . . 0.0 110.352 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 13.4 tp -159.88 139.01 10.93 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.585 1.154 . . . . 0.0 108.496 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -138.97 98.07 3.45 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 30.4 m -145.45 151.72 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 O-C-N 120.683 -1.26 . . . . 0.0 114.254 -176.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.14 103.48 12.69 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.45 100.56 0.24 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 103.661 -3.776 . . . . 0.0 103.661 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -61.82 -57.49 11.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 122.474 3.137 . . . . 0.0 112.803 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 6.5 mttp -66.34 -38.73 88.33 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.376 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -59.39 -51.76 68.51 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.67 -1.157 . . . . 0.0 111.36 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1109 ' ' PHE . . . . . 0.413 ' CZ ' ' HG3' ' D' 1113 ' ' MET . 84.2 t80 -60.84 -42.1 97.13 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 120.247 1.385 . . . . 0.0 110.333 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.45 -53.71 52.9 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.469 0.652 . . . . 0.0 110.068 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.96 -54.04 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 125.562 1.545 . . . . 0.0 110.607 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.11 -38.86 74.02 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.488 1.515 . . . . 0.0 111.186 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1113 ' ' MET . . . . . 0.413 ' HG3' ' CZ ' ' D' 1109 ' ' PHE . 0.0 OUTLIER -71.74 -43.99 64.86 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.213 1.369 . . . . 0.0 109.577 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D 1114 ' ' LYS . . . . . 0.434 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 8.8 ttpt -56.9 -44.74 82.66 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 68.9 mt -63.46 -36.09 82.6 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.869 0.868 . . . . 0.0 111.248 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -60.03 4.47 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.215 -0.928 . . . . 0.0 108.68 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -64.4 -29.37 70.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.368 0.267 . . . . 0.0 111.081 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 17.8 t -64.45 -47.68 78.17 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.842 0.747 . . . . 0.0 110.088 178.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.51 -44.3 58.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 116.959 -1.496 . . . . 0.0 111.979 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -59.28 -41.24 88.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.952 1.705 . . . . 0.0 110.827 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.1 mm? -66.33 -50.6 63.04 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 3.5 ttt -61.76 -27.4 68.7 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.31 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -78.6 -37.07 43.33 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.345 1.458 . . . . 0.0 111.773 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -79.43 -27.9 41.71 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 118.362 -0.828 . . . . 0.0 112.257 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.25 147.14 33.98 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 118.735 0.698 . . . . 0.0 109.988 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.92 -175.16 0.55 Allowed 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.243 2.629 . . . . 0.0 109.378 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.272 7.2 pt20 -111.63 51.18 0.34 Allowed Pre-proline 0 CA--C 1.557 1.232 0 O-C-N 120.039 -1.663 . . . . 0.0 114.425 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.42 -65.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.462 2.775 . . . . 0.0 113.127 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.15 -30.43 71.49 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.708 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -58.92 -55.79 21.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.814 1.246 . . . . 0.0 110.367 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 45.2 t0 -63.63 -40.71 97.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.649 0.659 . . . . 0.0 110.483 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 19.9 m -60.13 -50.4 73.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.327 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.7 t80 -62.96 -42.92 99.97 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.89 1.276 . . . . 0.0 110.39 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -45.61 70.44 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -69.03 -52.88 24.02 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.577 0.751 . . . . 0.0 110.512 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -50.47 -47.51 57.04 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.027 1.731 . . . . 0.0 111.183 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.72 -38.99 62.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.547 1.139 . . . . 0.0 109.281 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.5 -32.39 39.92 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.495 1.043 . . . . 0.0 110.882 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -56.98 -23.55 46.72 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 118.684 0.675 . . . . 0.0 112.171 177.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 32.2 tp . . . . . 0 N--CA 1.467 0.397 0 CA-C-N 120.485 1.493 . . . . 0.0 112.898 -179.767 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 110.582 -0.155 . . . . 0.0 110.582 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.3 tp -79.38 95.24 5.69 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.1 mt -95.52 140.73 29.94 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -112.21 144.11 42.15 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.774 1.63 . . . . 0.0 107.902 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.4 tp -130.39 94.04 30.99 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 124.596 1.158 . . . . 0.0 109.546 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -78.58 121.26 5.07 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 109.356 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.4 t -144.78 156.08 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.03 1.286 . . . . 0.0 108.719 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -133.03 102.17 5.5 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.99 110.58 0.41 Allowed Glycine 0 C--O 1.219 -0.84 0 CA-C-O 115.839 -2.645 . . . . 0.0 107.526 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.32 65.29 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 122.94 3.37 . . . . 0.0 109.1 178.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -67.05 -46.84 73.14 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -36.85 84.8 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.925 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -71.11 -43.9 66.73 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 120.189 1.359 . . . . 0.0 108.672 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.14 -49.8 76.21 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.511 1.051 . . . . 0.0 109.308 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.4 ttp -57.22 -46.77 82.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.882 0.473 . . . . 0.0 109.82 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.54 -38.97 93.17 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 123.921 0.888 . . . . 0.0 110.027 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.37 -47.13 71.29 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 119.297 0.953 . . . . 0.0 109.718 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -48.95 74.01 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.582 0.753 . . . . 0.0 110.501 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.3 mt -73.01 -33.45 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.185 0.994 . . . . 0.0 110.957 -178.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -67.58 -56.9 7.62 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.57 -38.94 72.64 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.058 2.143 . . . . 0.0 110.426 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -61.19 -52.52 64.48 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.405 -0.807 . . . . 0.0 110.838 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -39.27 61.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.012 0.824 . . . . 0.0 111.851 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.79 -54.47 46.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.827 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.21 -41.45 77.05 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 117.97 -1.015 . . . . 0.0 110.264 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -57.86 -38.99 76.68 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.247 0.931 . . . . 0.0 110.668 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -79.53 -20.63 46.66 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.328 0.513 . . . . 0.0 110.119 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -82.59 -39.56 22.06 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.984 -1.072 . . . . 0.0 112.103 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.3 tp . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.876 1.67 . . . . 0.0 109.933 -179.285 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 80.4 m80 . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.5 m -54.8 -51.16 66.65 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.165 2.186 . . . . 0.0 109.031 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.48 -45.87 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 125.607 1.563 . . . . 0.0 109.733 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.97 -55.6 32.06 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.817 0.447 . . . . 0.0 111.845 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -62.0 -43.01 99.74 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.42 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -58.02 -49.55 76.48 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 119.494 1.043 . . . . 0.0 108.9 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.97 -48.2 82.69 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.193 1.397 . . . . 0.0 111.725 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -59.85 -56.55 20.36 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.477 1.111 . . . . 0.0 110.091 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -58.48 -43.95 89.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.155 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -52.86 -46.75 68.01 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.163 0.985 . . . . 0.0 111.95 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.12 -53.9 38.11 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.009 0.524 . . . . 0.0 111.016 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 121.011 0.434 . . . . 0.0 110.84 -179.472 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.7 m . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -106.03 150.68 25.51 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -128.58 140.15 51.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.511 1.125 . . . . 0.0 110.718 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.5 mt -133.21 110.12 9.9 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -110.29 98.59 7.8 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 128.503 2.721 . . . . 0.0 105.808 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -154.41 151.17 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.226 1.41 . . . . 0.0 109.012 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.33 101.27 7.27 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.685 0.675 . . . . 0.0 110.813 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.19 105.42 0.39 Allowed Glycine 0 C--O 1.228 -0.28 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -53.79 -54.15 42.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 121.586 2.693 . . . . 0.0 112.918 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.89 -40.65 89.45 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.868 0.758 . . . . 0.0 109.854 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -60.18 -50.58 73.13 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.154 -0.926 . . . . 0.0 110.539 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 109' ' ' PHE . . . . . 0.415 ' CD2' ' HB3' ' D' 1099 ' ' TYR . 31.8 t80 -54.33 -46.04 72.8 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 119.256 0.935 . . . . 0.0 111.194 -178.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -61.74 -53.74 51.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.34 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 45.2 mt -58.05 -52.54 57.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.985 1.714 . . . . 0.0 110.543 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 73.6 mt -65.76 -32.28 73.73 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.154 1.381 . . . . 0.0 111.885 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 24.3 mtp -68.24 -54.56 16.85 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.85 1.205 . . . . 0.0 109.433 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -60.71 -35.95 77.62 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.674 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.95 -54.77 11.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 117.836 -1.078 . . . . 0.0 110.697 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 5.3 tptp -58.16 -40.83 82.42 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 121.059 1.754 . . . . 0.0 110.018 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.5 -58.53 7.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 126.322 1.849 . . . . 0.0 106.39 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 90.2 p -57.68 -36.16 71.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.3 -42.77 65.11 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.17 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -64.84 -40.03 94.52 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.012 1.278 . . . . 0.0 107.583 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 44.6 mt -64.24 -46.16 85.0 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.026 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -71.2 -19.08 62.43 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.312 0.96 . . . . 0.0 110.7 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -89.08 -42.79 11.51 Favored 'General case' 0 C--N 1.343 0.323 0 O-C-N 121.01 -1.056 . . . . 0.0 113.225 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -76.3 -33.01 59.07 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.0 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -95.5 147.56 33.2 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 178.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -71.68 177.89 6.36 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.508 1.472 . . . . 0.0 110.382 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -112.17 50.85 0.37 Allowed Pre-proline 0 CA--C 1.554 1.099 0 O-C-N 121.08 -1.013 . . . . 0.0 112.389 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.37 -57.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.732 2.288 . . . . 0.0 113.292 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.2 tt -65.33 -33.52 76.16 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 119.992 1.269 . . . . 0.0 109.206 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 40.2 t -54.36 -56.33 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.851 1.661 . . . . 0.0 109.228 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.59 -47.35 85.88 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.81 0.844 . . . . 0.0 111.233 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 30.1 t -54.75 -50.78 67.58 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 0.0 110.442 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -68.55 -44.08 75.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.87 1.268 . . . . 0.0 111.019 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -54.96 -46.0 74.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 118.822 0.737 . . . . 0.0 109.729 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -65.81 -49.63 67.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.448 0.567 . . . . 0.0 110.917 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -57.28 -44.77 84.29 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.229 0.612 . . . . 0.0 111.673 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.69 -29.82 61.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.882 0.873 . . . . 0.0 109.547 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -61.75 -32.83 73.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -6.0 3.62 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.07 1.348 . . . . 0.0 113.021 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.468 0.448 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.902 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.5 tp10 . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 110.894 -0.039 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 67.2 tp -78.47 95.21 5.08 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 42.8 mt -90.52 153.75 20.13 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -123.29 142.31 51.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.584 1.154 . . . . 0.0 108.921 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 41.7 tp -134.11 94.89 17.43 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.11 0.964 . . . . 0.0 111.182 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.18 130.03 9.05 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.432 2.755 . . . . 0.0 109.964 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 2.4 t -145.78 152.04 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.602 1.161 . . . . 0.0 108.478 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -134.91 101.83 5.03 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 177.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.57 117.01 0.7 Allowed Glycine 0 CA--C 1.519 0.328 0 N-CA-C 105.402 -3.079 . . . . 0.0 105.402 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -52.41 58.85 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 122.067 2.934 . . . . 0.0 110.968 -179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.95 -41.14 78.43 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 54.0 m -58.27 -48.03 81.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 118.316 -0.849 . . . . 0.0 109.964 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.4 t80 -58.54 -50.59 73.21 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 119.147 0.885 . . . . 0.0 110.145 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.0 -48.8 78.72 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 ttt -58.69 -49.34 77.93 Favored 'General case' 0 N--CA 1.46 0.066 0 C-N-CA 124.754 1.222 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.86 -50.28 73.85 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.385 1.074 . . . . 0.0 109.132 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -55.86 28.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.011 0.924 . . . . 0.0 111.15 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -55.6 -48.52 74.75 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.676 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 76.7 mt -67.0 -43.93 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.669 -0.644 . . . . 0.0 111.176 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.16 -52.28 59.77 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 123.786 0.835 . . . . 0.0 111.539 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -66.92 -35.11 79.25 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.258 1.023 . . . . 0.0 110.044 -179.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 4.8 t -56.05 -51.77 66.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -48.27 80.17 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 123.193 0.308 . . . . 0.0 110.663 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -57.06 -54.62 44.68 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.51 0.724 . . . . 0.0 111.989 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.43 -41.4 84.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 119.342 0.974 . . . . 0.0 112.344 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -44.6 92.8 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 -22.99 46.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.733 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 t80 -79.14 -33.45 44.16 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.117 1.326 . . . . 0.0 111.311 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 49.8 tp . . . . . 0 CA--C 1.536 0.405 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 179.427 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 38.3 m80 . . . . . 0 CA--C 1.533 0.293 0 CA-C-O 118.554 -0.736 . . . . 0.0 112.934 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.6 m -61.27 -49.39 77.27 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 120.117 1.326 . . . . 0.0 109.451 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1037 ' ' ILE . . . . . 0.608 ' H ' HD12 ' C' 1037 ' ' ILE . 2.2 mp -59.21 -42.95 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 126.342 1.857 . . . . 0.0 109.526 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.73 -59.41 4.93 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.676 1.19 . . . . 0.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.3 m -60.1 -52.74 64.05 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.153 1.381 . . . . 0.0 111.897 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.27 -50.33 69.8 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.466 0.706 . . . . 0.0 112.37 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -61.13 -44.7 96.94 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 118.887 0.767 . . . . 0.0 111.641 -179.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -61.93 -48.91 78.32 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -64.55 -36.24 83.56 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-O 116.984 -1.484 . . . . 0.0 111.127 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -60.46 -42.33 95.95 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 120.92 1.691 . . . . 0.0 108.239 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -47.6 84.89 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 118.997 0.817 . . . . 0.0 110.598 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 3.4 tp60 . . . . . 0 CA--C 1.542 0.661 0 O-C-N 123.41 0.444 . . . . 0.0 110.647 -179.836 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 80.6 m . . . . . 0 C--O 1.235 0.311 0 CA-C-O 121.265 0.555 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D 1099 ' ' TYR . . . . . 0.415 ' HB3' ' CD2' ' B' ' 109' ' ' PHE . 67.8 m-85 -120.38 143.12 48.59 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -126.83 142.94 51.41 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.777 1.231 . . . . 0.0 110.677 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 90.4 mt -129.86 140.97 50.89 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -136.87 98.44 3.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.423 1.077 . . . . 0.0 108.117 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.6 m -153.19 151.51 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.944 1.298 . . . . 0.0 111.671 -177.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.33 102.79 10.18 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.374 0.988 . . . . 0.0 111.604 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.25 116.81 0.99 Allowed Glycine 0 C--O 1.229 -0.168 0 CA-C-O 115.636 -2.758 . . . . 0.0 107.886 177.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.78 -56.93 11.81 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 122.521 3.16 . . . . 0.0 111.592 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.84 -43.8 97.83 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 14.7 m120 -54.13 -47.88 71.39 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 117.671 -1.156 . . . . 0.0 112.038 -178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.1 t80 -64.5 -46.25 83.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.524 1.056 . . . . 0.0 109.856 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.98 -52.39 65.7 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.537 1.062 . . . . 0.0 111.408 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.16 -48.61 84.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 126.971 2.108 . . . . 0.0 111.825 -178.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 53.8 mt -67.72 -36.14 80.06 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.901 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 68.8 mtp -65.45 -53.2 46.32 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 119.999 1.272 . . . . 0.0 109.729 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -56.37 -40.72 75.01 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.359 0.981 . . . . 0.0 111.276 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 38.6 mt -74.24 -41.0 62.03 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1116 ' ' LYS . . . . . 0.568 ' HZ1' ' HG2' ' D' 1120 ' ' GLU . 3.1 tptp -65.7 -43.44 89.17 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.476 -1.39 . . . . 0.0 107.941 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -59.47 -52.86 63.76 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.482 1.513 . . . . 0.0 108.021 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 84.2 p -60.6 -34.64 74.53 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.008 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1119 ' ' LEU . . . . . 0.42 HD13 ' HA ' ' D' 1119 ' ' LEU . 0.8 OUTLIER -69.07 -36.98 78.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.233 0.924 . . . . 0.0 109.489 179.035 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D 1120 ' ' GLU . . . . . 0.568 ' HG2' ' HZ1' ' D' 1116 ' ' LYS . 0.6 OUTLIER -64.71 -52.48 56.9 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.238 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 43.3 mt -57.8 -47.12 83.49 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.135 1.774 . . . . 0.0 112.122 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.0 ppp? -76.49 -24.61 53.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 120.074 1.306 . . . . 0.0 112.749 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -80.44 -42.9 21.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.115 0.87 . . . . 0.0 110.049 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.3 -32.24 38.07 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -178.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.77 149.07 35.86 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.766 1.226 . . . . 0.0 107.916 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -65.36 167.95 15.52 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 121.339 1.359 . . . . 0.0 110.954 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -118.79 57.05 3.1 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 124.507 1.123 . . . . 0.0 113.113 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -70.51 -64.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.25 2.633 . . . . 0.0 112.826 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.7 tt -58.81 -33.78 70.76 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.868 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.8 t -52.2 -53.52 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 C-N-CA 124.154 0.982 . . . . 0.0 110.054 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 35.5 t0 -70.52 -41.17 72.91 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.202 0.91 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 14.5 t -54.82 -49.82 70.07 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.16 -49.72 63.73 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.423 1.489 . . . . 0.0 109.8 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -53.53 -45.91 69.96 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.216 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.67 -49.18 69.55 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 120.525 1.511 . . . . 0.0 110.236 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -52.03 -49.26 63.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.125 1.37 . . . . 0.0 109.242 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -39.68 75.24 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 127.138 2.175 . . . . 0.0 111.173 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -59.94 -28.09 67.33 Favored 'General case' 0 N--CA 1.462 0.156 0 O-C-N 120.988 -1.07 . . . . 0.0 109.651 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -19.71 47.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.506 0.722 . . . . 0.0 111.076 177.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.1 tt . . . . . 0 CA--C 1.53 0.194 0 C-N-CA 125.17 1.388 . . . . 0.0 110.332 179.359 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 CA--C 1.521 -0.149 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -66.19 96.43 0.34 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.785 1.634 . . . . 0.0 109.121 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.88 143.73 26.69 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -103.79 100.69 10.5 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 30.7 tp -92.11 107.36 22.48 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 128.468 2.707 . . . . 0.0 108.217 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -85.16 129.68 3.88 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.218 2.612 . . . . 0.0 110.767 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 t -145.43 150.62 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.92 1.236 . . . . 0.0 110.867 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -136.43 102.24 4.9 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.95 128.1 1.63 Allowed Glycine 0 N--CA 1.459 0.208 0 CA-C-O 114.845 -3.197 . . . . 0.0 107.765 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -52.97 17.64 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 122.791 3.295 . . . . 0.0 109.898 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.35 -33.79 76.51 Favored 'General case' 0 C--N 1.343 0.29 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 m -60.48 -50.26 74.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.287 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.95 -46.42 87.81 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.217 -178.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -59.24 -52.37 65.95 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.413 0.551 . . . . 0.0 111.067 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 34.6 ttm -59.12 -52.0 67.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.245 1.018 . . . . 0.0 109.215 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.7 mp -60.8 -30.72 70.23 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.78 0.718 . . . . 0.0 111.015 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -55.77 7.74 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 119.197 0.908 . . . . 0.0 108.849 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.14 -39.04 92.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -178.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.478 HG23 HD22 ' B' ' 115' ' ' LEU . 29.4 mt -62.13 -47.6 92.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 178.695 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.41 -58.04 9.82 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -51.97 -39.29 59.1 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.358 1.863 . . . . 0.0 113.386 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 p -69.02 -51.16 42.12 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.675 0.671 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 tt -62.83 -50.65 70.14 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 124.614 1.166 . . . . 0.0 111.553 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.91 -53.99 48.34 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.33 1.052 . . . . 0.0 110.79 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.34 -35.81 76.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.562 0.619 . . . . 0.0 111.365 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -27.03 68.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.509 1.05 . . . . 0.0 110.529 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -92.77 -28.26 16.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.791 -0.568 . . . . 0.0 109.848 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -75.46 -29.92 59.78 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.145 0.884 . . . . 0.0 110.65 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 tm? . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.677 1.591 . . . . 0.0 107.771 179.921 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.2 m80 . . . . . 0 CA--C 1.53 0.192 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.0 m -59.3 -45.15 92.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.614 1.097 . . . . 0.0 110.106 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.47 -49.66 82.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 C-N-CA 125.384 1.474 . . . . 0.0 108.148 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.34 -41.57 96.71 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.2 m -60.88 -50.22 74.29 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.11 -43.16 77.87 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.627 0.771 . . . . 0.0 110.287 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -49.38 78.01 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.86 -0.525 . . . . 0.0 110.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -65.52 -50.39 65.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.948 0.899 . . . . 0.0 110.899 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -54.93 36.82 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.543 1.137 . . . . 0.0 110.596 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.91 -32.9 74.84 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.886 1.221 . . . . 0.0 112.734 -178.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.47 -47.77 74.93 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 118.762 0.71 . . . . 0.0 109.159 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 . . . . . 0 N--CA 1.451 -0.424 0 C-N-CA 124.434 1.094 . . . . 0.0 109.502 -179.853 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.467 0.384 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -109.8 140.03 44.18 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.42 145.94 49.84 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 127.466 2.306 . . . . 0.0 107.867 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.633 HD22 ' HE2' ' D' 1116 ' ' LYS . 50.0 mt -147.94 150.16 33.54 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.772 0.829 . . . . 0.0 109.052 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.02 107.63 4.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.524 -1.227 . . . . 0.0 110.43 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.9 t -155.13 144.82 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 119.879 1.218 . . . . 0.0 109.374 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.06 103.85 15.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -141.38 112.75 0.79 Allowed Glycine 0 C--O 1.227 -0.307 0 N-CA-C 106.985 -2.446 . . . . 0.0 106.985 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 46.3 tpt85 -65.22 -59.21 4.32 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.991 2.396 . . . . 0.0 112.068 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -71.67 -42.02 68.0 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.16 -50.81 61.07 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 125.639 1.576 . . . . 0.0 110.468 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.31 -41.04 85.99 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.822 1.192 . . . . 0.0 110.322 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.85 -52.44 62.78 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.491 1.042 . . . . 0.0 109.134 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 56.2 mt -57.08 -57.88 8.14 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 C-N-CA 127.205 2.202 . . . . 0.0 110.118 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 mp -55.26 -54.01 48.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.571 1.148 . . . . 0.0 110.869 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 7.3 ttp -59.84 -45.12 93.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.356 0.98 . . . . 0.0 111.417 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -56.31 -52.43 64.55 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.897 0.879 . . . . 0.0 109.934 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.478 HD22 HG23 ' A' ' 22' ' ' ILE . 78.4 mt -70.49 -30.0 66.68 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 116' ' ' LYS . . . . . 0.463 ' HD2' HG21 ' D' 1103 ' ' VAL . 29.3 ttpp -58.81 -60.04 4.48 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.43 -45.27 80.84 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 124.201 0.938 . . . . 0.0 110.688 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 66.7 m -60.48 -44.06 96.32 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 118.034 -0.984 . . . . 0.0 113.389 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -38.21 63.01 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.894 1.224 . . . . 0.0 109.458 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -55.35 -52.81 62.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.798 0.808 . . . . 0.0 109.396 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.08 -42.41 94.13 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.452 -1.261 . . . . 0.0 109.288 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.52 -31.08 70.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.338 0.972 . . . . 0.0 111.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -77.09 -40.02 47.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.828 0.74 . . . . 0.0 110.013 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 26.7 tp -76.61 -22.46 54.15 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 33.3 m -94.5 147.61 33.54 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 119.848 1.203 . . . . 0.0 109.334 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.54 177.4 7.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 121.883 1.722 . . . . 0.0 108.639 178.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -112.09 56.58 0.47 Allowed Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 121.056 -1.028 . . . . 0.0 113.013 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.5 -72.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.584 2.19 . . . . 0.0 110.544 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.17 -36.91 85.18 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.8 t -54.29 -56.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 125.029 1.331 . . . . 0.0 111.597 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.18 -44.94 90.46 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.161 1.346 . . . . 0.0 111.497 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 17.4 t -57.83 -47.0 83.89 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -68.25 -35.63 78.21 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.235 1.414 . . . . 0.0 109.684 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 23.0 ttm-85 -55.46 -48.95 73.71 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.229 1.377 . . . . 0.0 108.834 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -69.72 -51.64 32.51 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.905 0.882 . . . . 0.0 111.631 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -51.11 -49.07 61.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.861 0.864 . . . . 0.0 110.068 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.26 -37.54 71.94 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.527 1.131 . . . . 0.0 110.579 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -57.13 -27.62 61.99 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.172 0.989 . . . . 0.0 110.6 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.25 -12.97 57.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.778 0.717 . . . . 0.0 112.186 177.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.539 0.541 0 O-C-N 120.943 -1.098 . . . . 0.0 111.045 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 7.6 tt -79.37 98.88 6.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.147 1.379 . . . . 0.0 108.528 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.2 mt -87.64 152.74 21.93 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 126.125 1.77 . . . . 0.0 107.138 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -115.15 100.07 7.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 23.6 tp -82.04 108.57 11.84 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.455 1.502 . . . . 0.0 108.932 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -93.74 103.43 0.14 Allowed 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 124.772 3.648 . . . . 0.0 110.923 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 68.0 t -136.39 159.18 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 120.759 -1.213 . . . . 0.0 110.641 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -135.52 102.2 5.05 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.51 130.97 2.22 Favored Glycine 0 CA--C 1.517 0.176 0 CA-C-O 115.538 -2.812 . . . . 0.0 109.23 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -70.12 -52.68 21.77 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 121.351 2.576 . . . . 0.0 108.636 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.33 -34.93 78.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.199 0.599 . . . . 0.0 109.825 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.7 m -65.95 -47.98 72.85 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 89.9 t80 -64.33 -49.48 71.54 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.843 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -55.46 -53.23 58.94 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.527 1.131 . . . . 0.0 110.506 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 10.4 ttm -58.17 -53.59 56.6 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 123.285 0.634 . . . . 0.0 110.25 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.1 mp -62.75 -28.62 70.09 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.725 -1.131 . . . . 0.0 111.489 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.81 -56.6 5.96 Favored 'General case' 0 CA--C 1.522 -0.102 0 CA-C-N 120.696 1.589 . . . . 0.0 108.259 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -61.11 -46.9 88.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.479 0.712 . . . . 0.0 112.785 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 48.0 mt -67.9 -44.12 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.604 0.638 . . . . 0.0 110.632 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.2 tmpt? -66.73 -44.22 82.14 Favored 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 120.974 -1.079 . . . . 0.0 110.01 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -62.93 -50.85 69.21 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.582 0.753 . . . . 0.0 110.518 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 19.0 p -56.14 -46.41 79.25 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.184 0.902 . . . . 0.0 111.475 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 4.2 tt -62.94 -49.1 76.07 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.927 1.291 . . . . 0.0 110.056 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -60.27 -54.91 40.13 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.788 0.835 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.76 -40.93 94.31 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 124.416 1.086 . . . . 0.0 112.132 -178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmm? -63.27 -44.29 95.55 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -65.0 -37.11 86.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -33.54 76.15 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.801 1.24 . . . . 0.0 112.714 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.3 tm? . . . . . 0 CA--C 1.544 0.746 0 CA-C-N 119.28 0.946 . . . . 0.0 109.713 -179.419 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 26.5 m80 . . . . . 0 N--CA 1.456 -0.167 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 60.8 m -57.95 -47.67 82.24 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.473 1.033 . . . . 0.0 108.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 4.0 mp -59.29 -42.09 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.915 0.886 . . . . 0.0 109.062 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.06 -57.73 10.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.652 0.381 . . . . 0.0 111.213 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 91.2 m -57.82 -43.46 85.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.3 1.04 . . . . 0.0 109.745 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -58.43 -46.54 86.29 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.539 1.063 . . . . 0.0 110.302 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -49.16 76.54 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.69 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -68.32 -47.74 66.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 118.802 -0.618 . . . . 0.0 110.99 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -48.28 -51.19 26.88 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.081 1.353 . . . . 0.0 110.102 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . 0.296 3.7 pp0? -72.98 -31.72 64.71 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.74 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -66.25 -40.25 90.07 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.184 1.356 . . . . 0.0 108.456 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 20.1 tp60 . . . . . 0 CA--C 1.532 0.262 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.941 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 121.019 0.438 . . . . 0.0 110.687 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -106.99 145.4 32.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -130.03 143.29 50.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 125.571 1.548 . . . . 0.0 107.306 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 59.7 mt -144.42 154.81 43.35 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.095 0.558 . . . . 0.0 110.446 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -145.02 107.42 4.38 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.453 1.901 . . . . 0.0 108.116 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1103 ' ' VAL . . . . . 0.463 HG21 ' HD2' ' B' ' 116' ' ' LYS . 99.6 t -155.55 152.32 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 128.547 2.739 . . . . 0.0 106.497 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 103.49 7.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 121.128 1.785 . . . . 0.0 112.854 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.39 120.33 1.75 Allowed Glycine 0 C--O 1.228 -0.279 0 N-CA-C 105.957 -2.857 . . . . 0.0 105.957 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 9.3 tpt85 -57.85 -56.61 19.69 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.439 1.62 . . . . 0.0 111.688 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 58.7 mttp -67.51 -48.91 65.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -51.7 -52.03 51.47 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.051 0.94 . . . . 0.0 110.51 -177.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 93.1 t80 -61.06 -51.03 70.91 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 117.89 -1.052 . . . . 0.0 111.816 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -57.63 -47.56 81.88 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.875 1.216 . . . . 0.0 111.415 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 87.7 mt -61.21 -58.2 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.832 1.253 . . . . 0.0 108.896 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 4.6 mp -55.2 -47.47 75.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.264 0.626 . . . . 0.0 109.802 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -44.38 87.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.695 1.198 . . . . 0.0 110.279 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -62.72 -53.03 60.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.751 1.16 . . . . 0.0 108.558 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 59.4 mt -59.2 -30.06 67.94 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.084 0.553 . . . . 0.0 112.475 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1116 ' ' LYS . . . . . 0.633 ' HE2' HD22 ' B' ' 101' ' ' LEU . 28.5 ttpp -64.34 -60.52 3.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.703 1.201 . . . . 0.0 108.522 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.23 -41.21 99.07 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 123.704 0.628 . . . . 0.0 110.722 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 58.6 m -58.91 -48.18 82.36 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.35 0.977 . . . . 0.0 112.019 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -41.63 70.21 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -57.27 -46.55 82.97 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.645 1.111 . . . . 0.0 110.341 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.52 -39.67 88.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 117.804 -1.093 . . . . 0.0 108.783 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -66.97 -30.75 70.95 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.151 0.98 . . . . 0.0 110.605 178.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -75.7 -28.74 58.75 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.935 1.694 . . . . 0.0 109.661 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 40.9 tp -85.48 -33.1 21.92 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.597 1.159 . . . . 0.0 112.476 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 21.2 m -93.46 148.0 34.72 Favored Pre-proline 0 C--N 1.332 -0.181 0 O-C-N 120.934 -1.104 . . . . 0.0 110.233 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -70.82 -179.9 3.75 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 N-CA-C 108.105 -1.536 . . . . 0.0 108.105 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -112.0 61.52 0.57 Allowed Pre-proline 0 CA--C 1.544 0.718 0 O-C-N 120.814 -1.179 . . . . 0.0 111.936 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.96 -75.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 123.598 2.865 . . . . 0.0 109.974 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.4 tt -65.05 -30.35 71.31 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.9 t -55.9 -52.41 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.328 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.15 -45.96 75.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.182 1.355 . . . . 0.0 110.693 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -50.25 67.53 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.643 0.777 . . . . 0.0 109.839 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 24.8 t80 -67.02 -42.46 84.9 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 125.335 1.454 . . . . 0.0 110.064 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -57.06 -47.8 80.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.954 1.252 . . . . 0.0 110.866 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -67.45 -37.77 83.48 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.898 0.772 . . . . 0.0 110.453 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -64.67 -34.0 77.26 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.767 1.627 . . . . 0.0 111.238 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.97 -43.69 19.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.53 1.532 . . . . 0.0 108.501 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -57.76 -31.53 66.59 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.018 0.927 . . . . 0.0 110.498 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 19.3 mt -58.6 -21.35 53.16 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.708 0.803 . . . . 0.0 111.429 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 C-N-CA 123.368 0.667 . . . . 0.0 111.884 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.236 0.357 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.0 tp -89.8 121.75 32.24 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -106.57 163.75 12.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.597 1.159 . . . . 0.0 108.011 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -132.44 145.17 51.0 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.588 HD21 ' HE2' ' C' 1023 ' ' LYS . 3.1 tt -132.99 96.91 17.26 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-O 118.272 -0.871 . . . . 0.0 109.255 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.05 126.4 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.582 2.855 . . . . 0.0 112.737 -179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 t -145.77 148.63 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 119.655 1.116 . . . . 0.0 109.917 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -136.28 100.94 4.53 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.55 117.45 0.74 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 105.389 -3.084 . . . . 0.0 105.389 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -65.09 -50.94 64.18 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 122.174 2.987 . . . . 0.0 111.592 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.267 0.939 . . . . 0.0 110.228 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.2 m -63.84 -49.57 72.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -59.0 -34.88 72.36 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.932 1.242 . . . . 0.0 112.123 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.05 -57.38 13.34 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.422 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 1.2 ptp -63.82 -37.8 88.74 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 119.74 -0.784 . . . . 0.0 112.336 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.55 -53.62 48.88 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 117.896 -1.05 . . . . 0.0 111.817 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.01 -52.6 64.3 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 119.661 1.119 . . . . 0.0 110.439 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -56.29 -47.57 78.39 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.67 -47.62 69.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 118.709 0.686 . . . . 0.0 109.979 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.49 -53.78 41.17 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.937 0.895 . . . . 0.0 109.817 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -61.52 -34.39 75.43 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.978 0.911 . . . . 0.0 112.69 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 p -67.77 -43.74 79.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.489 0.586 . . . . 0.0 110.291 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.07 -42.45 89.38 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.399 1.079 . . . . 0.0 109.333 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -54.74 -53.87 49.4 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 56.5 tp -60.07 -56.28 23.57 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.402 1.081 . . . . 0.0 112.765 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.497 ' HE1' HH21 ' A' ' 41' ' ' ARG . 0.2 OUTLIER -54.36 -32.35 56.68 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.347 1.459 . . . . 0.0 112.467 -178.545 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -89.92 -41.64 11.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.633 0.651 . . . . 0.0 111.129 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -70.58 -21.71 62.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 112.912 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp . . . . . 0 C--O 1.236 0.364 0 C-N-CA 123.992 0.917 . . . . 0.0 110.652 -178.987 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 . . . . . 0 CA--C 1.53 0.201 0 CA-C-O 119.18 -0.438 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 m -62.14 -51.25 68.64 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.5 mp -57.21 -48.1 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.531 1.132 . . . . 0.0 108.682 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -60.57 -58.68 7.45 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.8 p -59.93 -50.02 75.39 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 123.726 0.81 . . . . 0.0 111.9 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.84 -35.25 76.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 118.043 0.383 . . . . 0.0 111.069 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.497 HH21 ' HE1' ' A' ' 29' ' ' MET . 37.9 ttm180 -67.24 -48.57 67.4 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -58.61 -45.62 88.78 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.657 0.383 . . . . 0.0 110.672 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -63.59 -49.66 72.49 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.422 -0.799 . . . . 0.0 110.337 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -58.01 -40.14 80.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.142 0.883 . . . . 0.0 110.239 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -67.19 -49.79 63.34 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 CA--C 1.534 0.356 0 O-C-N 121.599 -0.688 . . . . 0.0 110.42 179.606 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 98.3 m . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -119.69 130.11 54.87 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 104.15 -2.537 . . . . 0.0 104.15 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -108.33 151.03 26.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.507 1.523 . . . . 0.0 110.43 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 45.1 mt -148.67 150.73 33.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.698 0.799 . . . . 0.0 109.362 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.26 106.02 4.13 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.327 1.451 . . . . 0.0 109.867 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 57.5 t -154.68 151.48 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.968 1.307 . . . . 0.0 109.156 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -113.08 102.33 10.29 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.51 1.504 . . . . 0.0 111.603 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.15 111.32 0.64 Allowed Glycine 0 CA--C 1.52 0.366 0 CA-C-O 116.046 -2.53 . . . . 0.0 108.08 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 11.2 tpt180 -60.32 -58.02 10.3 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.954 2.877 . . . . 0.0 112.566 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -67.28 -41.83 84.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 118.544 0.611 . . . . 0.0 110.613 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -58.78 -48.05 82.6 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.54 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -63.7 -44.13 94.56 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 119.007 0.821 . . . . 0.0 110.438 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -57.66 -53.92 52.71 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.737 0.699 . . . . 0.0 111.277 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.8 mt -59.7 -54.17 38.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 124.31 1.044 . . . . 0.0 109.757 -178.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 58.1 mt -58.63 -51.32 70.42 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 117.259 -1.353 . . . . 0.0 112.247 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 26.2 ttt -64.16 -44.59 91.63 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.96 1.255 . . . . 0.0 111.133 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.1 ttpt -54.05 -52.37 61.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 119.028 0.831 . . . . 0.0 109.115 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 81.6 mt -72.57 -23.88 61.03 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.384 0.674 . . . . 0.0 112.187 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' LYS . . . . . 0.472 ' HD3' HD11 ' D' 1112 ' ' LEU . 25.2 tptt -63.26 -60.11 3.83 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 120.196 1.362 . . . . 0.0 107.978 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -39.13 77.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.434 1.709 . . . . 0.0 108.649 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 7.0 t -57.03 -45.31 83.21 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 123.43 0.692 . . . . 0.0 111.322 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.27 -42.77 71.67 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.382 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.91 -37.03 85.9 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 120.728 1.604 . . . . 0.0 110.248 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 mt -66.57 -48.28 70.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -61.61 -31.9 72.0 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.935 0.894 . . . . 0.0 111.113 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -73.9 -33.35 63.97 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.178 0.899 . . . . 0.0 109.671 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 52.7 tp -83.54 -33.69 25.41 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.5 m -94.16 148.6 35.42 Favored Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -71.42 172.26 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.082 0 CA-C-N 119.904 1.002 . . . . 0.0 110.5 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -112.84 41.6 0.23 Allowed Pre-proline 0 CA--C 1.556 1.18 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.51 -48.81 2.88 Favored 'Trans proline' 0 C--N 1.354 0.836 0 CA-C-N 122.417 1.899 . . . . 0.0 111.502 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.2 -36.13 80.98 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.016 0.826 . . . . 0.0 109.567 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.25 -46.65 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.068 0 C-N-CA 123.809 0.844 . . . . 0.0 110.23 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 100.0 m-20 -62.12 -50.07 73.36 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.015 0.526 . . . . 0.0 110.31 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.3 t -62.37 -46.38 88.89 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.008 0.523 . . . . 0.0 111.176 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -61.32 -49.61 76.29 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.535 1.134 . . . . 0.0 109.006 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -56.55 -47.72 78.83 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 118.503 -0.76 . . . . 0.0 108.968 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -58.7 -54.48 46.6 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.039 0.836 . . . . 0.0 111.207 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -34.4 75.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.7 0.682 . . . . 0.0 112.4 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -74.56 -33.9 62.8 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.148 0.579 . . . . 0.0 110.069 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -61.76 -38.62 88.66 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.151 -1.593 . . . . 0.0 107.55 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.16 -13.4 60.15 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.112 0.565 . . . . 0.0 112.059 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--N 1.341 0.207 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 178.44 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 68.8 tp -86.57 124.23 32.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.87 169.1 10.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -137.97 152.24 48.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -119.43 99.84 49.91 Favored Pre-proline 0 C--O 1.235 0.311 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -80.04 108.15 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.821 3.014 . . . . 0.0 109.582 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.3 t -142.17 147.42 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 O-C-N 121.027 -1.046 . . . . 0.0 110.365 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -126.25 101.97 6.98 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.56 120.82 0.91 Allowed Glycine 0 N--CA 1.459 0.218 0 CA-C-O 116.035 -2.536 . . . . 0.0 108.578 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -66.73 -51.77 52.07 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 122.411 3.106 . . . . 0.0 110.395 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -67.9 -38.12 82.59 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.31 99.11 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.274 0.63 . . . . 0.0 110.691 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 20.9 t80 -68.9 -38.93 79.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 119.742 1.155 . . . . 0.0 108.921 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -60.51 -54.4 45.9 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.353 -0.832 . . . . 0.0 111.497 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 3.8 ptp -61.59 -33.04 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.619 0.645 . . . . 0.0 111.132 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.21 -46.83 66.47 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -43.2 98.31 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 119.467 1.03 . . . . 0.0 109.741 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.74 -48.88 74.47 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.194 0.998 . . . . 0.0 110.624 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 8.6 mt -79.76 -31.53 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.508 0.723 . . . . 0.0 111.837 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1023 ' ' LYS . . . . . 0.588 ' HE2' HD21 ' A' ' 8' ' ' LEU . 1.4 tmmt? -65.86 -56.69 10.55 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.14 -49.27 76.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.896 1.678 . . . . 0.0 113.055 -178.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 13.7 p -61.88 -50.19 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.688 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -65.77 -40.33 91.9 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.035 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.02 -54.53 41.88 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -47.56 78.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 117.916 0.326 . . . . 0.0 111.21 -179.228 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -54.76 -33.35 61.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.705 1.202 . . . . 0.0 111.297 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 -22.92 18.72 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.073 1.349 . . . . 0.0 111.354 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.48 -34.63 31.24 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.339 1.427 . . . . 0.0 109.752 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 22.6 tp . . . . . 0 C--O 1.237 0.423 0 C-N-CA 126.433 1.893 . . . . 0.0 107.592 179.593 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 84.2 m-70 . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 7.3 m -61.75 -51.55 67.88 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.976 0.91 . . . . 0.0 109.002 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.98 -40.45 85.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 125.787 1.635 . . . . 0.0 109.116 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -65.21 -58.04 7.0 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.434 1.494 . . . . 0.0 112.625 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 26.3 p -59.2 -43.55 92.23 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.73 0.812 . . . . 0.0 110.744 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 6.5 t80 -59.72 -39.62 85.28 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.934 0.494 . . . . 0.0 109.789 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -62.86 -48.81 77.43 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 118.99 0.814 . . . . 0.0 109.653 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -57.83 -56.37 22.86 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.268 0.627 . . . . 0.0 111.009 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -60.47 -45.1 94.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.895 -1.05 . . . . 0.0 111.428 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.89 -33.77 76.44 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.258 0.935 . . . . 0.0 113.297 -178.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -69.33 -50.36 47.26 Favored 'General case' 0 N--CA 1.461 0.084 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 . . . . . 0 CA--C 1.538 0.489 0 C-N-CA 124.054 0.942 . . . . 0.0 110.752 179.104 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 84.2 m . . . . . 0 N--CA 1.465 0.287 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -113.24 130.16 56.31 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -105.69 140.03 39.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.942 2.897 . . . . 0.0 110.141 -177.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 77.5 mt -137.66 144.93 42.09 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.326 -0.859 . . . . 0.0 111.006 -178.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.84 101.39 3.94 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.03 1.732 . . . . 0.0 110.377 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D 1103 ' ' VAL . . . . . 0.452 HG11 ' HE3' ' B' ' 116' ' ' LYS . 63.9 t -151.25 152.01 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 120.585 -1.322 . . . . 0.0 109.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -115.79 101.47 8.84 Favored 'General case' 0 C--N 1.347 0.497 0 CA-C-N 120.486 1.494 . . . . 0.0 113.547 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.84 118.38 1.24 Allowed Glycine 0 CA--C 1.522 0.494 0 N-CA-C 107.717 -2.153 . . . . 0.0 107.717 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -66.73 -56.65 9.56 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 121.307 2.554 . . . . 0.0 111.014 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -63.38 -45.92 88.87 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.048 0.928 . . . . 0.0 109.328 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -57.99 -51.27 70.34 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 117.205 -1.378 . . . . 0.0 111.763 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.55 -44.97 95.54 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.498 1.499 . . . . 0.0 111.149 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -50.73 -54.1 26.03 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.807 0.843 . . . . 0.0 110.509 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.6 mt -65.88 -52.34 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.822 1.249 . . . . 0.0 110.383 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1112 ' ' LEU . . . . . 0.472 HD11 ' HD3' ' B' ' 116' ' ' LYS . 18.2 mt -51.73 -52.26 49.92 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.566 1.147 . . . . 0.0 111.974 -178.662 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 24.0 ttt -64.7 -44.26 90.84 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.25 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1114 ' ' LYS . . . . . 0.422 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 24.7 ttpt -54.99 -52.18 63.93 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.93 -45.8 76.76 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.576 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.6 tptt -53.76 -59.75 4.21 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 118.949 0.795 . . . . 0.0 111.755 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -30.31 71.18 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 18.4 t -60.86 -39.04 87.66 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 120.324 1.42 . . . . 0.0 109.7 178.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.07 -38.6 63.88 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.275 0.489 . . . . 0.0 110.093 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.73 -43.29 96.94 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.93 -48.85 70.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.6 tmt? -59.56 -22.49 61.79 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.752 0.821 . . . . 0.0 110.861 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.71 -46.8 35.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 65.1 tp -71.99 -33.11 67.84 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.864 0.866 . . . . 0.0 113.334 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 23.1 m -92.25 147.5 34.71 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 120.101 1.319 . . . . 0.0 110.4 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -71.45 174.86 10.25 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 N-CA-C 108.398 -1.424 . . . . 0.0 108.398 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -122.74 44.3 0.87 Allowed Pre-proline 0 CA--C 1.555 1.136 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -61.91 -48.72 8.03 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.158 2.572 . . . . 0.0 113.273 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 49.7 tp -65.64 -26.41 67.79 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.453 -0.779 . . . . 0.0 109.689 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 39.7 t -67.27 -46.56 83.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.237 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -56.84 -43.81 81.5 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -64.6 -48.47 74.82 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.137 0.575 . . . . 0.0 109.975 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.36 -41.85 94.54 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.205 1.002 . . . . 0.0 110.166 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.07 -48.44 80.12 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.66 -49.82 69.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 117.893 -1.051 . . . . 0.0 111.89 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -42.46 95.67 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.118 1.326 . . . . 0.0 111.384 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -71.01 -37.55 72.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.157 0.435 . . . . 0.0 111.12 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -65.82 -39.75 91.17 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 119.028 0.831 . . . . 0.0 109.659 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 43.4 mt -66.81 -26.13 66.79 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.887 0.767 . . . . 0.0 110.003 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 124.295 1.038 . . . . 0.0 108.677 178.839 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.87 104.71 1.14 Allowed 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -92.2 169.25 10.75 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -123.93 127.92 48.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 13.5 tp -115.67 93.98 38.98 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 126.022 1.729 . . . . 0.0 107.353 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -77.8 119.92 4.94 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.062 2.508 . . . . 0.0 112.988 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -145.62 155.59 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.04 1.336 . . . . 0.0 108.775 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.0 101.4 4.71 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.2 0.6 . . . . 0.0 111.102 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.48 115.93 0.65 Allowed Glycine 0 CA--C 1.526 0.732 0 C-N-CA 126.805 2.145 . . . . 0.0 107.758 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.07 -51.98 65.92 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.6 2.7 . . . . 0.0 112.286 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -73.42 -32.38 64.38 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 123.27 0.628 . . . . 0.0 110.737 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -61.05 -43.4 98.94 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.123 1.369 . . . . 0.0 108.627 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -67.51 -54.43 20.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -54.64 -54.93 35.12 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.471 0.708 . . . . 0.0 112.909 -178.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 40.0 ttm -53.42 -54.02 42.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.983 0.913 . . . . 0.0 110.349 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.94 -28.73 67.73 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-O 118.014 -0.993 . . . . 0.0 112.911 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.22 -55.8 10.98 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.61 -40.49 72.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.031 0.932 . . . . 0.0 110.349 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.447 HG23 HD22 ' B' ' 115' ' ' LEU . 93.2 mt -67.9 -51.07 53.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.63 -0.7 . . . . 0.0 110.337 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -32.82 74.49 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.108 1.322 . . . . 0.0 110.721 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -66.16 -55.17 17.71 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.031 1.332 . . . . 0.0 110.395 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 p -54.38 -40.63 68.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 117.9 0.318 . . . . 0.0 110.326 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 tt -68.5 -55.43 11.77 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.734 1.214 . . . . 0.0 110.513 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -53.36 -52.78 58.16 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.244 1.817 . . . . 0.0 111.869 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.8 -46.22 90.46 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.993 -1.003 . . . . 0.0 109.641 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.54 -43.03 97.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 119.079 0.854 . . . . 0.0 109.281 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -71.69 -13.17 61.66 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -102.77 -28.96 11.78 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.299 0.954 . . . . 0.0 113.526 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.6 tp . . . . . 0 CA--C 1.531 0.232 0 C-N-CA 125.206 1.402 . . . . 0.0 109.848 -178.43 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.5 m170 . . . . . 0 CA--C 1.536 0.404 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.8 m -67.83 -46.09 72.82 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.777 0.831 . . . . 0.0 108.942 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -65.28 -34.39 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -58.27 8.13 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.0 m -68.29 -49.43 60.5 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -52.2 -51.93 55.19 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 123.924 0.89 . . . . 0.0 111.256 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -69.05 -46.1 68.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.937 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -58.45 -52.99 63.29 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.986 0.514 . . . . 0.0 110.629 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -62.75 -41.18 99.08 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.676 -0.678 . . . . 0.0 109.372 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.78 -39.38 84.69 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.383 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.73 -52.15 61.76 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.187 1.358 . . . . 0.0 108.348 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.2 tm0? . . . . . 0 CA--C 1.538 0.518 0 C-N-CA 124.687 1.195 . . . . 0.0 111.712 -179.52 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 98' ' ' THR . . . . . 0.488 ' HA ' ' HB3' ' D' 1104 ' ' ARG . 53.1 m . . . . . 0 C--O 1.237 0.44 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 99' ' ' TYR . . . . . 0.513 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 86.9 m-85 -101.7 128.23 48.1 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.108 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -105.98 161.98 14.0 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 126.026 1.73 . . . . 0.0 109.317 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 93.7 mt -151.0 142.98 23.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 127.441 2.296 . . . . 0.0 106.285 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -144.39 98.87 3.28 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.251 1.42 . . . . 0.0 108.37 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 m -153.63 150.32 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 123.485 0.714 . . . . 0.0 111.682 -177.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -117.54 102.48 9.22 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.043 1.292 . . . . 0.0 114.201 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.31 129.28 3.82 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 106.781 -2.528 . . . . 0.0 106.781 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -66.73 -57.51 6.97 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.202 2.001 . . . . 0.0 110.88 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -70.35 -37.87 74.7 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -54.6 -41.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.233 0.613 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -75.12 -42.68 55.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.257 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -54.15 -54.93 32.88 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.853 1.66 . . . . 0.0 110.273 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.02 -54.92 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.466 1.506 . . . . 0.0 110.423 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -32.18 73.74 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-O 116.711 -1.614 . . . . 0.0 112.89 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 21.3 mtp -68.78 -53.24 22.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 121.019 1.736 . . . . 0.0 107.547 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -52.07 -48.55 64.6 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.297 1.039 . . . . 0.0 109.836 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.447 HD22 HG23 ' A' ' 22' ' ' ILE . 50.9 mt -67.46 -54.99 15.47 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.6 -0.715 . . . . 0.0 112.138 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -54.45 -37.85 65.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 120.095 1.316 . . . . 0.0 110.797 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.04 -57.59 8.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.731 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 73.0 m -55.54 -34.12 64.41 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.11 -0.947 . . . . 0.0 111.432 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.45 -40.24 67.17 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.713 1.205 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.77 -47.09 85.01 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.44 1.018 . . . . 0.0 108.478 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 75.5 mt -60.64 -47.3 86.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -26.77 68.02 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.263 1.025 . . . . 0.0 111.807 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -79.64 -54.79 5.54 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.808 0.843 . . . . 0.0 111.868 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -69.6 -32.72 71.61 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.86 148.27 34.49 Favored Pre-proline 0 CA--C 1.534 0.327 0 C-N-CA 125.105 1.362 . . . . 0.0 108.756 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -70.98 169.42 20.52 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 121.077 1.185 . . . . 0.0 109.576 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -115.7 58.88 1.46 Allowed Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.436 1.094 . . . . 0.0 113.207 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.07 -63.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 123.558 2.838 . . . . 0.0 115.645 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.31 -33.33 75.57 Favored 'General case' 0 CA--C 1.513 -0.477 0 O-C-N 121.162 -0.961 . . . . 0.0 108.934 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.424 HG23 ' H ' ' B' ' 130' ' ' VAL . 15.1 t -50.27 -53.33 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 C-N-CA 125.173 1.389 . . . . 0.0 108.401 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -66.39 -51.4 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.8 m -59.16 -41.13 87.66 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.97 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -67.98 -52.77 32.07 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.019 1.328 . . . . 0.0 110.365 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -59.69 -39.78 85.67 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.401 -1.285 . . . . 0.0 110.129 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -64.28 -55.6 20.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.911 1.232 . . . . 0.0 110.058 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -56.42 -42.48 78.12 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.356 -0.84 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -67.83 -40.72 83.74 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.993 0.917 . . . . 0.0 110.828 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -61.23 -34.32 74.93 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 125.26 1.424 . . . . 0.0 110.567 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -57.73 -14.36 5.6 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.388 0.994 . . . . 0.0 113.128 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 CA--C 1.543 0.683 0 CA-C-N 119.814 1.188 . . . . 0.0 109.693 178.451 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 . . . . . 0 N--CA 1.456 -0.141 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 1.9 tt -69.19 95.9 0.79 Allowed 'General case' 0 C--O 1.236 0.378 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.7 mt -90.28 168.77 11.66 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.784 1.633 . . . . 0.0 107.506 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -126.44 135.23 51.12 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 28.4 tp -111.72 91.97 16.11 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.8 106.65 2.24 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.261 2.641 . . . . 0.0 109.471 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 58.9 t -144.91 153.69 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 119.977 1.262 . . . . 0.0 110.769 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -128.52 102.97 6.85 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.3 110.59 0.39 Allowed Glycine 0 CA--C 1.522 0.469 0 CA-C-O 115.646 -2.752 . . . . 0.0 108.878 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -62.06 -53.15 59.53 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 123.099 3.449 . . . . 0.0 111.962 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 16.7 m -67.92 -45.48 74.26 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.28 -0.887 . . . . 0.0 109.469 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.54 -52.39 61.33 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 124.051 0.94 . . . . 0.0 108.614 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -54.47 -51.39 65.17 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.141 0.976 . . . . 0.0 110.69 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 52.1 ttm -61.49 -53.84 51.1 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.654 0.781 . . . . 0.0 111.377 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.3 -36.54 84.38 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.94 -55.8 15.0 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -57.69 -39.31 76.88 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.513 0.725 . . . . 0.0 111.687 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1022 ' ' ILE . . . . . 0.405 HG23 HD22 ' D' 1115 ' ' LEU . 22.6 mt -65.15 -52.25 55.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 118.483 -0.77 . . . . 0.0 109.865 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -34.61 75.66 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 118.375 -1.33 . . . . 0.0 110.794 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -61.66 -55.35 31.48 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 110.049 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.2 p -55.32 -49.09 73.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 118.094 0.407 . . . . 0.0 110.911 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.3 tt -62.24 -54.3 42.8 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.843 0.857 . . . . 0.0 111.164 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -53.95 -50.97 65.3 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.613 1.165 . . . . 0.0 110.152 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.35 -48.83 76.33 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 123.774 0.829 . . . . 0.0 110.005 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 2.2 tmt? -58.87 -22.65 59.66 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.45 1.1 . . . . 0.0 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -100.98 -12.77 18.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.058 1.743 . . . . 0.0 112.012 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.3 t80 -101.72 -13.41 17.76 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.003 1.321 . . . . 0.0 110.581 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 41.7 tp . . . . . 0 CA--C 1.536 0.411 0 C-N-CA 126.838 2.055 . . . . 0.0 108.633 -179.36 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 7.2 m170 . . . . . 0 N--CA 1.462 0.15 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 13.3 m -58.78 -51.24 70.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.716 0.807 . . . . 0.0 109.829 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.5 mt -57.03 -46.04 84.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.981 1.712 . . . . 0.0 110.206 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.4 -52.11 66.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 122.872 0.469 . . . . 0.0 111.619 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 27.7 m -63.26 -39.53 94.85 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.706 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 24.7 t80 -57.7 -52.97 63.25 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 178.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 48.0 ttt-85 -63.77 -31.81 73.11 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.665 0.666 . . . . 0.0 111.859 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -60.1 -57.85 11.07 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -67.98 -37.87 82.01 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.668 1.187 . . . . 0.0 111.633 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -60.24 -47.39 86.17 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.586 -1.197 . . . . 0.0 109.834 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -64.64 -40.43 95.44 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.196 1.362 . . . . 0.0 110.012 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.4 tm0? . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.451 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.2 m . . . . . 0 C--O 1.237 0.435 0 N-CA-C 105.087 -2.19 . . . . 0.0 105.087 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -101.9 130.18 48.32 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.194 -0.942 . . . . 0.0 110.173 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -115.61 150.0 37.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.55 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 70.9 mt -142.53 142.27 32.19 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.82 98.56 3.07 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.281 1.033 . . . . 0.0 108.354 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.39 146.52 18.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 124.958 1.303 . . . . 0.0 110.81 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1104 ' ' ARG . . . . . 0.488 ' HB3' ' HA ' ' B' ' 98' ' ' THR . 0.0 OUTLIER -107.88 100.62 9.97 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.662 1.119 . . . . 0.0 113.284 -179.374 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.09 108.15 0.5 Allowed Glycine 0 C--O 1.226 -0.371 0 N-CA-C 106.385 -2.686 . . . . 0.0 106.385 177.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -51.08 -57.11 9.52 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 122.005 2.903 . . . . 0.0 113.728 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -67.84 -44.25 77.6 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.344 -0.848 . . . . 0.0 110.467 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 3.3 m120 -58.6 -30.05 66.92 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.296 1.439 . . . . 0.0 110.645 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1109 ' ' PHE . . . . . 0.513 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 45.7 t80 -74.82 -55.33 5.93 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 177.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.36 -53.93 38.27 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.497 1.044 . . . . 0.0 113.399 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -60.03 -54.47 34.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 C-N-CA 125.035 1.334 . . . . 0.0 109.119 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -35.8 81.68 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 117.442 -1.266 . . . . 0.0 110.877 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.96 -52.45 62.98 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 119.843 1.202 . . . . 0.0 108.282 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 58.0 tttp -54.96 -46.96 75.1 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.69 0.796 . . . . 0.0 109.81 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1115 ' ' LEU . . . . . 0.405 HD22 HG23 ' C' 1022 ' ' ILE . 33.0 mt -66.86 -52.0 48.85 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 117.907 0.321 . . . . 0.0 110.649 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -55.03 -44.65 74.82 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.399 1.079 . . . . 0.0 111.438 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.62 -57.5 11.78 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.152 1.781 . . . . 0.0 106.983 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.6 m -53.2 -43.72 67.39 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.506 0.722 . . . . 0.0 112.008 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.82 -31.08 64.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.348 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -65.16 -44.86 87.19 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.504 1.502 . . . . 0.0 107.468 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.74 -43.14 89.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.053 1.341 . . . . 0.0 107.783 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.21 -36.46 79.96 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.019 0.827 . . . . 0.0 110.752 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -45.37 52.79 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.807 0.843 . . . . 0.0 112.288 -179.242 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -78.42 -32.83 48.85 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -94.31 146.12 30.97 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -67.0 173.97 7.54 Favored 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 122.912 2.408 . . . . 0.0 112.799 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -115.23 50.85 0.67 Allowed Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 125.059 1.344 . . . . 0.0 113.858 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.09 -69.73 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.213 1.942 . . . . 0.0 112.245 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.87 -32.64 73.01 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.253 0.933 . . . . 0.0 110.007 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.0 t -53.99 -50.47 53.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 124.537 1.135 . . . . 0.0 110.074 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.89 -51.25 50.22 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.482 0.583 . . . . 0.0 111.253 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 49.5 m -54.59 -42.36 70.98 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.032 0.378 . . . . 0.0 110.841 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.03 -52.57 40.72 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 117.29 -1.338 . . . . 0.0 110.282 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.86 -43.4 94.7 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 120.121 1.328 . . . . 0.0 111.331 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -62.39 -54.96 32.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 118.875 0.761 . . . . 0.0 109.841 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -61.52 -27.89 68.93 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.8 tm0? -80.51 -49.71 11.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -55.37 -33.2 63.23 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.801 1.64 . . . . 0.0 109.971 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 9.6 mt -57.12 -13.97 3.49 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.038 0.935 . . . . 0.0 113.442 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.3 tt . . . . . 0 CA--C 1.54 0.59 0 CA-C-N 119.468 1.031 . . . . 0.0 110.731 178.087 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tp -62.85 94.57 0.07 Allowed 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.674 1.19 . . . . 0.0 113.123 -177.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.01 156.2 18.12 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -130.14 142.69 50.56 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.766 1.626 . . . . 0.0 106.738 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 tp -132.12 110.47 14.14 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 119.596 1.089 . . . . 0.0 111.885 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -88.18 113.31 0.78 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.766 3.644 . . . . 0.0 111.07 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.41 HG22 ' HE3' ' C' 1023 ' ' LYS . 24.2 t -140.83 148.45 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 119.788 -1.82 . . . . 0.0 107.965 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.58 102.8 5.23 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.466 -0.771 . . . . 0.0 109.924 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.26 118.12 0.79 Allowed Glycine 0 CA--C 1.521 0.424 0 N-CA-C 104.325 -3.51 . . . . 0.0 104.325 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.98 -51.46 64.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.965 1.883 . . . . 0.0 109.878 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.51 -45.74 82.38 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.842 0.857 . . . . 0.0 109.449 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.7 m -55.31 -51.81 65.51 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.794 1.638 . . . . 0.0 110.488 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -62.0 -42.56 99.28 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.424 -0.798 . . . . 0.0 110.278 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -60.46 -42.96 97.26 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.118 1.326 . . . . 0.0 111.697 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.5 ttm -69.98 -53.83 15.96 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.038 0.535 . . . . 0.0 110.911 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.18 -47.02 82.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.654 1.581 . . . . 0.0 111.422 -178.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.69 -49.09 78.93 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -57.81 -47.65 81.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.948 0.794 . . . . 0.0 111.814 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.531 HG23 HD22 ' B' ' 115' ' ' LEU . 96.6 mt -62.12 -42.12 93.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 123.419 0.688 . . . . 0.0 109.249 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.467 ' HE3' HG22 ' C' 1010 ' ' VAL . 14.0 tmtt? -63.38 -52.41 61.76 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 123.854 0.862 . . . . 0.0 108.756 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.35 -54.69 40.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.929 2.092 . . . . 0.0 110.949 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -53.82 -51.1 64.6 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.908 0.776 . . . . 0.0 109.721 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.14 -48.71 78.88 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -178.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -59.69 -51.83 68.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.145 1.378 . . . . 0.0 111.564 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.42 ' HG ' HG22 ' B' ' 130' ' ' VAL . 4.0 mm? -65.05 -42.48 94.23 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.072 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -37.18 67.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -89.66 -17.13 28.97 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.222 1.374 . . . . 0.0 112.91 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -87.56 -57.9 2.78 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 121.149 -0.969 . . . . 0.0 113.234 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.54 0.579 0 O-C-N 121.919 -0.488 . . . . 0.0 110.826 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.2 m -66.72 -51.26 57.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.373 -0.83 . . . . 0.0 109.753 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.0 mt -58.3 -43.89 87.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 125.442 1.497 . . . . 0.0 110.939 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -55.95 -58.96 5.69 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.379 1.872 . . . . 0.0 109.677 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.9 m -62.73 -42.19 99.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.153 0.908 . . . . 0.0 110.071 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -55.3 -54.44 43.56 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.408 1.004 . . . . 0.0 111.223 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 43.3 ttt-85 -75.3 -29.87 60.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.308 -0.87 . . . . 0.0 112.209 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.73 -49.98 47.98 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.096 -1.002 . . . . 0.0 109.008 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -62.28 -44.14 97.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.658 1.183 . . . . 0.0 109.17 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -56.41 -51.9 66.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.369 0.986 . . . . 0.0 110.233 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -62.09 -34.97 77.32 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.984 -0.447 . . . . 0.0 111.241 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 . . . . . 0 CA--C 1.536 0.434 0 C-N-CA 123.859 0.864 . . . . 0.0 110.4 179.42 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 92.3 m . . . . . 0 C--O 1.238 0.495 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 99' ' ' TYR . . . . . 0.487 ' HB3' ' CE2' ' D' 1109 ' ' PHE . 97.1 m-85 -118.59 131.32 56.2 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -113.1 158.19 20.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.383 1.473 . . . . 0.0 110.396 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 81.3 mt -144.06 135.82 26.12 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.42 98.87 4.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.515 1.526 . . . . 0.0 107.072 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 43.4 t -149.53 141.59 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.338 0.972 . . . . 0.0 109.627 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -92.83 103.98 16.27 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.22 108.44 0.49 Allowed Glycine 0 N--CA 1.465 0.627 0 CA-C-O 114.937 -3.146 . . . . 0.0 112.729 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -67.61 -58.21 5.08 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 123.55 3.675 . . . . 0.0 112.455 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -66.82 -43.08 84.71 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.294 -0.879 . . . . 0.0 110.012 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -57.63 -47.29 82.62 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.346 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -63.39 -41.73 98.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 120.302 1.41 . . . . 0.0 111.706 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -56.67 -52.39 65.11 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.718 1.144 . . . . 0.0 110.437 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.32 -52.6 53.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 C-N-CA 124.772 1.229 . . . . 0.0 110.788 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.94 -29.44 70.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 117.564 -1.208 . . . . 0.0 111.77 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 mtp -69.68 -52.33 26.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.69 1.586 . . . . 0.0 107.524 178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -51.7 -51.82 53.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.223 0.952 . . . . 0.0 108.706 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.531 HD22 HG23 ' A' ' 22' ' ' ILE . 65.0 mt -68.99 -35.87 77.19 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -61.51 -52.13 65.74 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 120.371 1.442 . . . . 0.0 107.488 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.13 -38.05 89.38 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 124.235 0.959 . . . . 0.0 109.891 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 5.4 t -52.8 -55.05 25.75 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.144 0.978 . . . . 0.0 110.52 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.47 -33.32 71.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.076 -0.964 . . . . 0.0 112.493 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -44.53 92.0 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.852 1.205 . . . . 0.0 108.409 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 54.9 mt -67.07 -48.23 68.86 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 9.6 tpt -58.67 -26.92 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.173 0.897 . . . . 0.0 110.83 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -79.63 -44.69 20.49 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.261 1.024 . . . . 0.0 111.052 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -79.41 -26.1 41.95 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.047 1.294 . . . . 0.0 114.279 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 125' ' ' VAL . . . . . 0.468 HG22 ' HD2' ' B' ' 126' ' ' PRO . 0.3 OUTLIER -94.95 148.52 34.85 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.953 1.701 . . . . 0.0 108.916 -179.344 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.468 ' HD2' HG22 ' B' ' 125' ' ' VAL . 42.0 Cg_endo -73.36 179.86 5.1 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.735 2.29 . . . . 0.0 110.746 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 16.6 mp0 -121.2 44.27 0.73 Allowed Pre-proline 0 CA--C 1.563 1.47 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -63.4 -48.67 5.59 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.217 2.611 . . . . 0.0 115.284 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 69.4 tp -62.93 -41.86 99.61 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.551 1.068 . . . . 0.0 108.973 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.42 HG22 ' HG ' ' A' ' 28' ' ' LEU . 1.8 t -51.76 -48.68 37.86 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 C-N-CA 125.452 1.501 . . . . 0.0 109.706 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -61.49 -51.11 70.03 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.684 1.193 . . . . 0.0 111.767 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.5 t -62.79 -50.17 72.07 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.946 -0.471 . . . . 0.0 110.595 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -61.91 -36.12 80.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.597 1.559 . . . . 0.0 110.182 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -59.98 -48.63 80.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.31 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -69.13 -49.8 53.76 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.822 0.737 . . . . 0.0 111.706 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -54.15 -46.05 72.16 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.692 1.197 . . . . 0.0 111.185 -178.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -80.25 -27.67 38.62 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.928 0.891 . . . . 0.0 110.843 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -57.64 -39.66 77.48 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.184 1.357 . . . . 0.0 108.625 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.3 mt -58.66 -17.28 21.1 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.123 0.969 . . . . 0.0 112.459 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.541 0.62 0 CA-C-N 119.579 1.081 . . . . 0.0 111.985 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.6 tp10 . . . . . 0 C--O 1.233 0.226 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.01 95.06 0.11 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.56 1.544 . . . . 0.0 110.352 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.6 mt -94.44 135.73 35.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -104.98 152.65 22.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.28 1.032 . . . . 0.0 109.276 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 55.6 tp -146.68 102.75 3.94 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.999 1.32 . . . . 0.0 109.808 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -84.25 129.64 4.51 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.291 2.661 . . . . 0.0 110.979 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1010 ' ' VAL . . . . . 0.467 HG22 ' HE3' ' A' ' 23' ' ' LYS . 3.6 t -144.44 150.91 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.816 1.247 . . . . 0.0 107.65 178.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.66 99.04 3.95 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.771 1.623 . . . . 0.0 109.586 177.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -170.29 137.01 4.23 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 116.773 -2.126 . . . . 0.0 107.875 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -70.62 -52.03 24.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 121.429 2.614 . . . . 0.0 112.076 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.65 -41.41 88.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.893 0.77 . . . . 0.0 110.79 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -51.73 66.95 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 126.006 1.722 . . . . 0.0 108.742 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 36.4 t80 -68.38 -49.6 58.96 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.009 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.41 -56.8 13.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.809 1.244 . . . . 0.0 112.78 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.73 -48.44 81.68 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.236 1.015 . . . . 0.0 110.656 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.88 -39.41 91.83 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 119.09 -0.481 . . . . 0.0 111.058 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.28 -47.4 79.66 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.405 -0.807 . . . . 0.0 109.293 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.51 -49.21 73.19 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.416 0.553 . . . . 0.0 110.88 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 82.4 mt -65.41 -51.24 66.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 123.698 0.799 . . . . 0.0 110.027 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1023 ' ' LYS . . . . . 0.41 ' HE3' HG22 ' A' ' 10' ' ' VAL . 11.3 tmtt? -54.22 -55.55 26.97 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.609 1.164 . . . . 0.0 110.182 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.26 -42.71 95.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.329 -178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 8.3 t -58.09 -51.16 70.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.519 0.6 . . . . 0.0 109.532 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.28 -49.04 71.07 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.13 -53.12 60.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.977 0.911 . . . . 0.0 111.296 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.25 -42.47 93.27 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.015 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 16.0 tmm? -58.12 -47.25 83.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.383 0.673 . . . . 0.0 110.324 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -78.69 -18.97 53.52 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.114 0.87 . . . . 0.0 112.7 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 15.0 t80 -83.63 -53.41 5.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 119.422 1.01 . . . . 0.0 113.178 -177.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.536 0.424 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -177.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 8.4 m-70 . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 14.1 m -67.1 -51.64 51.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.813 1.245 . . . . 0.0 109.767 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 69.9 mt -60.2 -41.93 88.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.599 0.76 . . . . 0.0 109.833 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.2 -58.33 8.41 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 87.4 m -66.15 -37.08 84.8 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.354 1.061 . . . . 0.0 112.225 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.89 -54.3 46.71 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.25 1.02 . . . . 0.0 109.162 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 54.7 ttt-85 -73.43 -31.95 64.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.118 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -63.57 -57.22 10.83 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 109.037 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -65.62 -34.37 78.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.15 -0.929 . . . . 0.0 111.335 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -61.26 -54.95 37.54 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.12 1.327 . . . . 0.0 108.73 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -63.72 -33.18 75.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.853 0.461 . . . . 0.0 111.347 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 . . . . . 0 CA--C 1.528 0.11 0 C-N-CA 124.204 1.002 . . . . 0.0 109.74 179.313 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 3.9 m . . . . . 0 C--O 1.24 0.6 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -109.96 142.28 41.56 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -128.31 152.89 47.61 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.144 0.978 . . . . 0.0 111.033 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.3 mt -146.03 138.7 25.59 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.031 1.333 . . . . 0.0 107.538 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.24 105.59 5.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.816 1.247 . . . . 0.0 108.996 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 94.7 t -152.11 150.65 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 125.221 1.408 . . . . 0.0 108.925 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.15 101.78 10.79 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.743 1.156 . . . . 0.0 109.836 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.33 106.64 0.41 Allowed Glycine 0 N--CA 1.461 0.364 0 CA-C-O 114.922 -3.155 . . . . 0.0 107.034 177.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -59.0 -57.6 12.34 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 122.454 3.127 . . . . 0.0 114.92 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -65.02 -47.02 78.95 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.395 0.678 . . . . 0.0 109.897 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -62.11 -41.57 98.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.221 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1109 ' ' PHE . . . . . 0.487 ' CE2' ' HB3' ' B' ' 99' ' ' TYR . 80.2 t80 -66.41 -41.48 89.24 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 119.996 1.271 . . . . 0.0 111.188 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.18 -52.79 63.12 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.7 mt -58.07 -53.64 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 C-N-CA 124.417 1.087 . . . . 0.0 109.162 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 39.1 mt -56.36 -34.82 67.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 117.625 -1.179 . . . . 0.0 111.447 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.3 mtp -70.52 -43.85 68.75 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.815 1.643 . . . . 0.0 108.585 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -55.34 -51.37 66.97 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 54.0 mt -70.07 -33.28 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.335 1.054 . . . . 0.0 112.964 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -60.45 -60.15 4.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.246 1.385 . . . . 0.0 108.826 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.58 -38.07 89.72 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 117.402 -1.285 . . . . 0.0 109.116 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.4 t -52.41 -50.16 63.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 121.266 1.848 . . . . 0.0 111.757 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.88 -42.12 73.86 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.41 0.55 . . . . 0.0 111.322 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.47 87.7 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.344 0.658 . . . . 0.0 110.271 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.28 -48.42 34.77 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.826 1.65 . . . . 0.0 109.676 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.6 tpt -59.77 -30.54 68.94 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.938 1.245 . . . . 0.0 110.199 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -75.93 -41.63 51.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.325 1.05 . . . . 0.0 110.454 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.48 -32.45 54.31 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.391 0.996 . . . . 0.0 112.199 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -81.87 147.9 59.62 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.63 1.172 . . . . 0.0 108.723 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.24 172.13 13.68 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 N-CA-C 107.582 -1.738 . . . . 0.0 107.582 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -120.85 58.38 6.75 Favored Pre-proline 0 CA--C 1.546 0.812 0 O-C-N 120.676 -1.265 . . . . 0.0 111.43 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -73.29 -59.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.682 2.921 . . . . 0.0 113.749 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.8 -40.9 85.41 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -51.07 -48.03 30.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 0.0 109.53 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 10.8 t70 -65.32 -46.73 79.16 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -49.51 77.57 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.0 t80 -59.38 -44.18 92.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.346 1.458 . . . . 0.0 109.582 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -54.85 -48.82 72.42 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.269 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -68.84 -48.37 63.67 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 119.609 1.095 . . . . 0.0 111.958 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -57.26 -38.42 73.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.811 0.845 . . . . 0.0 110.283 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -81.34 -28.26 34.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.726 1.611 . . . . 0.0 110.963 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -60.36 -37.24 80.09 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.26 -9.92 5.92 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.543 0.697 0 C-N-CA 125.647 1.579 . . . . 0.0 109.926 178.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 . . . . . 0 CA--C 1.537 0.474 0 CA-C-O 119.423 -0.322 . . . . 0.0 111.556 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 14.4 tp -134.29 108.44 8.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -115.07 168.62 9.76 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 120.226 1.375 . . . . 0.0 110.25 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -145.25 138.18 26.28 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.192 1.397 . . . . 0.0 107.417 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -112.0 97.97 40.38 Favored Pre-proline 0 C--O 1.232 0.165 0 CA-C-O 118.126 -0.94 . . . . 0.0 110.58 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.2 119.76 6.36 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.118 1.878 . . . . 0.0 107.316 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.6 t -143.59 148.57 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.282 1.033 . . . . 0.0 108.77 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.3 100.27 4.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.07 111.27 0.44 Allowed Glycine 0 C--O 1.226 -0.389 0 CA-C-O 116.463 -2.299 . . . . 0.0 108.036 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -59.8 -48.95 79.64 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 122.017 2.908 . . . . 0.0 112.564 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.7 -32.04 67.39 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.056 0.455 . . . . 0.0 109.907 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.6 m -65.26 -45.14 85.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.082 1.353 . . . . 0.0 109.272 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -61.35 -48.59 80.58 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.294 1.837 . . . . 0.0 109.437 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -53.7 -48.2 69.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.437 0.637 . . . . 0.0 110.416 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -67.8 -45.26 75.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.915 -0.491 . . . . 0.0 111.221 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.2 tp -62.65 -47.47 83.59 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 123.566 0.746 . . . . 0.0 112.876 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.44 -47.11 80.29 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.085 0.554 . . . . 0.0 109.987 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.69 -45.92 85.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.625 0.648 . . . . 0.0 111.287 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 65.2 mt -62.36 -52.61 57.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -57.15 -45.74 83.34 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 123.938 0.895 . . . . 0.0 111.47 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -58.9 -51.98 67.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.903 -0.57 . . . . 0.0 110.061 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.0 p -61.15 -40.39 93.67 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -67.25 -55.54 13.57 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.692 0.797 . . . . 0.0 109.481 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -56.94 -40.89 77.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.959 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.27 -47.49 85.77 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 119.903 1.229 . . . . 0.0 111.161 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.7 tmm? -57.69 -27.83 63.26 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.569 0.622 . . . . 0.0 110.164 178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -89.55 -27.11 20.48 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.255 -0.903 . . . . 0.0 110.921 178.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.59 -35.08 46.27 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 120.372 1.442 . . . . 0.0 110.35 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 72.9 mt . . . . . 0 CA--C 1.535 0.381 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 179.16 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.2 t60 . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.555 HG23 HG11 ' B' ' 125' ' ' VAL . 2.7 m -65.21 -46.83 79.08 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.116 1.325 . . . . 0.0 109.867 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.34 -34.75 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.932 1.293 . . . . 0.0 110.733 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -63.24 -51.49 66.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.32 1.048 . . . . 0.0 108.444 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.05 -37.98 84.55 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.35 0.523 . . . . 0.0 111.999 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -53.18 61.26 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -34.98 77.05 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.586 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -57.87 -57.1 14.26 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -54.64 -41.1 69.67 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.455 1.025 . . . . 0.0 110.102 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -57.99 -54.5 46.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.174 0.59 . . . . 0.0 111.519 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -71.94 -35.83 69.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.507 0.594 . . . . 0.0 111.497 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 . . . . . 0 C--O 1.225 -0.218 0 C-N-CA 124.98 1.312 . . . . 0.0 111.031 -179.661 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.538 0.496 0 N-CA-C 105.239 -2.134 . . . . 0.0 105.239 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -100.96 130.11 46.9 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -105.92 129.84 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.938 1.695 . . . . 0.0 107.128 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.561 HD23 ' H ' ' B' ' 102' ' ' GLN . 0.6 OUTLIER -126.08 150.18 48.36 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 179.6 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 102' ' ' GLN . . . . . 0.561 ' H ' HD23 ' B' ' 101' ' ' LEU . 48.9 tt0 -146.33 105.65 3.92 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.951 1.3 . . . . 0.0 113.508 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.4 t -150.48 149.76 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.272 1.396 . . . . 0.0 109.401 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.57 99.27 6.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 121.353 1.888 . . . . 0.0 109.241 178.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.16 133.43 5.29 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 108.125 -1.99 . . . . 0.0 108.125 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -67.93 -58.36 4.67 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 119.563 1.681 . . . . 0.0 112.55 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -67.86 -42.48 81.27 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -51.86 -50.37 61.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.973 1.709 . . . . 0.0 111.442 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -69.67 -51.39 35.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 117.774 -1.108 . . . . 0.0 112.0 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.09 -54.45 24.86 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.125 0.97 . . . . 0.0 112.651 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.21 -55.35 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 123.413 0.685 . . . . 0.0 110.804 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 89.6 mt -64.9 -28.49 69.57 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -52.02 20.62 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.86 1.209 . . . . 0.0 108.114 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -52.59 -50.53 62.85 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 19.3 mt -63.19 -36.12 82.58 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.032 -0.985 . . . . 0.0 112.14 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 116' ' ' LYS . . . . . 0.545 ' HE3' HD22 ' D' 1101 ' ' LEU . 11.1 tppt? -58.18 -56.59 20.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 120.404 1.456 . . . . 0.0 109.324 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.15 -33.74 76.48 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 119.232 -0.413 . . . . 0.0 110.618 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.3 t -63.69 -47.23 82.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.286 0.948 . . . . 0.0 109.501 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.44 -48.7 71.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.842 -1.075 . . . . 0.0 109.745 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -56.33 -39.37 72.69 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.364 0.984 . . . . 0.0 110.144 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 121' ' ' LEU . . . . . 0.525 HD12 HG22 ' A' ' 36' ' ' THR . 2.2 mm? -67.35 -47.66 69.78 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.816 -0.552 . . . . 0.0 110.093 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -68.49 -19.42 64.54 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.308 0.504 . . . . 0.0 111.757 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.68 -43.64 20.05 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.088 -1.007 . . . . 0.0 108.692 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -76.38 -32.41 58.57 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 125' ' ' VAL . . . . . 0.555 HG11 HG23 ' A' ' 36' ' ' THR . 0.9 OUTLIER -94.87 147.57 33.33 Favored Pre-proline 0 N--CA 1.467 0.375 0 CA-C-N 119.45 1.023 . . . . 0.0 109.16 179.61 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.19 -178.41 3.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.197 1.931 . . . . 0.0 110.905 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.59 48.32 0.35 Allowed Pre-proline 0 CA--C 1.553 1.063 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 -178.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.31 -52.07 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.55 2.167 . . . . 0.0 112.593 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.53 -33.82 73.22 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.502 0.592 . . . . 0.0 109.624 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.14 -43.17 98.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -50.96 71.26 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.721 0.809 . . . . 0.0 111.202 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 74.0 m -66.85 -46.77 74.0 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -58.64 -43.9 89.88 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.733 0.813 . . . . 0.0 109.923 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -48.09 81.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 118.291 -0.861 . . . . 0.0 109.999 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.5 -54.85 40.48 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 118.766 0.712 . . . . 0.0 109.826 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -50.14 66.07 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.435 1.094 . . . . 0.0 111.632 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -65.13 -39.61 93.27 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.337 1.055 . . . . 0.0 110.62 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -56.67 -40.23 75.16 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.183 0.901 . . . . 0.0 109.936 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.4 mt -60.07 -24.39 64.54 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.528 0.731 . . . . 0.0 112.463 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.19 0 C-N-CA 123.854 0.862 . . . . 0.0 112.94 -179.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 CA--C 1.538 0.512 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -90.2 101.72 14.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -105.02 167.26 9.82 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.71 137.66 38.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 94.25 23.41 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.16 122.38 9.22 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.735 2.29 . . . . 0.0 108.508 178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 84.4 t -144.67 148.04 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 125.0 1.32 . . . . 0.0 108.496 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.56 101.86 5.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -169.7 128.28 1.63 Allowed Glycine 0 CA--C 1.524 0.612 0 CA-C-O 115.404 -2.887 . . . . 0.0 109.714 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 36.0 mmm-85 -69.91 -50.3 43.51 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 123.25 3.525 . . . . 0.0 111.45 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -69.25 -36.96 77.7 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -58.19 -52.08 67.05 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 125.455 1.502 . . . . 0.0 110.112 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.2 t80 -63.39 -47.37 82.3 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.276 1.03 . . . . 0.0 110.244 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -53.19 -57.48 10.33 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -40.3 90.42 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.239 0.615 . . . . 0.0 111.566 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.55 -44.01 93.38 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.812 -0.613 . . . . 0.0 110.02 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.02 -48.0 72.57 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.89 0.876 . . . . 0.0 109.813 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.32 -48.63 73.87 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.951 0.5 . . . . 0.0 110.362 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 97.8 mt -65.08 -50.36 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -50.46 -46.55 56.81 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.37 1.068 . . . . 0.0 110.315 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.87 -49.65 67.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.322 -0.847 . . . . 0.0 111.402 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 87.2 p -56.0 -38.87 71.05 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.593 1.088 . . . . 0.0 113.073 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -73.02 -45.83 55.48 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -57.54 -39.15 75.97 Favored 'General case' 0 C--N 1.342 0.265 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -64.04 -45.1 90.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 116.741 -1.6 . . . . 0.0 110.938 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 26.5 ttm -58.49 -43.58 89.07 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.822 1.192 . . . . 0.0 108.381 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -65.67 -34.5 78.35 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.419 0.688 . . . . 0.0 112.251 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -81.09 -36.82 29.9 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.726 1.148 . . . . 0.0 111.806 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 50.1 mt . . . . . 0 CA--C 1.545 0.751 0 C-N-CA 126.016 1.726 . . . . 0.0 111.115 -178.636 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 1.9 t60 . . . . . 0 CA--C 1.537 0.46 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C 1036 ' ' THR . . . . . 0.576 HG23 HG21 ' D' 1125 ' ' VAL . 17.3 m -62.3 -40.53 96.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.391 1.077 . . . . 0.0 110.89 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.92 -43.8 93.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.11 -47.54 84.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.751 -1.118 . . . . 0.0 108.764 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -35.95 64.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.358 1.435 . . . . 0.0 111.929 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -53.91 32.13 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -36.63 84.64 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.727 -0.608 . . . . 0.0 111.06 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -59.31 -48.13 82.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.907 1.283 . . . . 0.0 108.75 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -63.09 -44.31 96.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.514 1.052 . . . . 0.0 109.173 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -55.03 -43.03 73.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.996 0.919 . . . . 0.0 110.623 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.56 -42.75 58.23 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.104 0.962 . . . . 0.0 110.326 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 . . . . . 0 C--O 1.224 -0.262 0 C-N-CA 123.938 0.895 . . . . 0.0 110.777 -179.853 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 17.3 m . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -101.89 128.99 48.04 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -106.58 155.28 19.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1101 ' ' LEU . . . . . 0.545 HD22 ' HE3' ' B' ' 116' ' ' LYS . 0.8 OUTLIER -152.48 127.97 10.01 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 179.389 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -119.93 106.2 11.81 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.026 2.13 . . . . 0.0 112.058 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 21.2 t -155.35 150.1 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.962 1.305 . . . . 0.0 110.37 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.44 103.37 11.46 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.7 116.98 1.2 Allowed Glycine 0 CA--C 1.51 -0.23 0 N-CA-C 104.615 -3.394 . . . . 0.0 104.615 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -65.76 -57.7 7.38 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.092 1.946 . . . . 0.0 113.644 -177.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -71.99 -38.85 69.58 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 119.424 1.011 . . . . 0.0 108.414 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -54.73 -50.49 68.24 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.282 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 13.9 t80 -64.69 -42.63 95.2 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 119.562 1.073 . . . . 0.0 110.432 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.12 -54.28 38.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.055 0.843 . . . . 0.0 110.942 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.73 -57.5 10.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 126.668 1.987 . . . . 0.0 111.057 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 57.1 mt -58.89 -36.34 74.51 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.651 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.9 tmt? -70.25 -52.13 25.37 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.755 1.161 . . . . 0.0 108.778 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.1 ttmm -51.97 -51.88 54.19 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 65.7 mt -65.7 -32.34 73.84 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.152 -0.928 . . . . 0.0 112.146 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -63.33 -48.29 78.62 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.586 1.539 . . . . 0.0 108.719 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -66.67 -41.53 88.0 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.77 -42.2 75.15 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.513 0.725 . . . . 0.0 110.267 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.88 -52.45 50.07 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.093 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.01 -43.01 86.44 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.588 1.086 . . . . 0.0 110.355 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.5 mm? -61.42 -48.97 78.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.44 0.696 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.45 -28.0 67.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.063 -0.398 . . . . 0.0 111.585 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -80.31 -23.29 40.76 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 126.693 1.997 . . . . 0.0 113.129 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -94.64 -27.51 15.84 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.287 0.635 . . . . 0.0 110.41 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1125 ' ' VAL . . . . . 0.576 HG21 HG23 ' C' 1036 ' ' THR . 81.2 t -95.2 147.46 33.07 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 124.936 1.294 . . . . 0.0 109.111 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D 1126 ' ' PRO . . . . . 0.425 ' HD2' HG13 ' D' 1125 ' ' VAL . 67.3 Cg_endo -71.3 -173.11 0.86 Allowed 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.926 2.417 . . . . 0.0 110.432 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.27 35.71 0.11 Allowed Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 117.749 2.5 . . . . 0.0 117.749 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.73 -51.41 4.97 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 123.446 2.267 . . . . 0.0 114.281 -178.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.26 -40.14 92.97 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.0 t -57.56 -47.77 84.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.434 0 C-N-CA 123.668 0.787 . . . . 0.0 109.406 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 44.5 t0 -60.58 -52.01 66.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.509 1.124 . . . . 0.0 110.465 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 41.3 m -60.9 -42.36 97.88 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.905 -0.497 . . . . 0.0 111.743 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.69 -52.33 39.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.914 0.886 . . . . 0.0 109.517 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.5 69.15 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.262 1.425 . . . . 0.0 111.193 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -67.32 -47.98 68.95 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.492 1.042 . . . . 0.0 110.86 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -58.86 -42.53 89.64 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.224 0.92 . . . . 0.0 109.692 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -65.18 -32.68 74.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.312 1.445 . . . . 0.0 109.2 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -59.54 -44.3 93.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.7 mt -64.39 -11.22 30.58 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.482 1.113 . . . . 0.0 113.577 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 13.2 tp . . . . . 0 CA--C 1.535 0.393 0 CA-C-N 119.726 1.148 . . . . 0.0 110.167 178.853 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 121.151 0.5 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tp -73.12 106.18 4.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.48 161.08 15.38 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -136.32 116.41 13.37 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.425 2.29 . . . . 0.0 105.797 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.82 105.16 15.4 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -75.23 117.13 4.75 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.325 2.683 . . . . 0.0 110.272 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.7 t -145.11 150.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 123.563 0.745 . . . . 0.0 109.532 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -135.11 102.21 5.12 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.862 -1.149 . . . . 0.0 109.837 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.0 135.2 3.53 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 107.529 -2.229 . . . . 0.0 107.529 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -70.78 -52.25 21.85 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.561 2.181 . . . . 0.0 110.419 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -30.81 64.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.68 1.192 . . . . 0.0 108.888 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.4 m -60.89 -49.92 75.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.74 1.216 . . . . 0.0 107.739 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -62.86 -39.9 95.84 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.264 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.46 -57.41 11.31 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.013 0.824 . . . . 0.0 111.704 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 35.6 ttm -57.71 -44.7 86.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.597 0.635 . . . . 0.0 110.359 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.6 mt -59.54 -48.57 81.15 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.382 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.76 -40.95 88.46 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.576 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.18 -49.45 76.99 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.247 1.385 . . . . 0.0 109.56 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.47 HD11 ' CG2' ' D' 1111 ' ' ILE . 93.5 mt -67.15 -51.57 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.701 -0.625 . . . . 0.0 109.769 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HE3' HG22 ' C' 1010 ' ' VAL . 12.3 tmtt? -56.69 -48.56 77.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 117.814 -1.089 . . . . 0.0 112.146 -178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.19 -55.79 30.37 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.4 m -56.74 -36.36 69.66 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.49 -37.89 50.29 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.981 0.81 . . . . 0.0 111.925 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -63.8 -50.36 69.27 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.269 -0.895 . . . . 0.0 108.692 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.413 HD13 ' HB ' ' B' ' 130' ' ' VAL . 77.3 mt -61.08 -52.08 66.44 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.861 1.265 . . . . 0.0 111.376 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.3 ppp? -56.93 -45.9 82.42 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.267 0.939 . . . . 0.0 111.854 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -74.34 -29.37 61.56 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.254 0.934 . . . . 0.0 112.879 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -71.03 -47.15 60.25 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.955 0.798 . . . . 0.0 110.425 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.1 tp . . . . . 0 CA--C 1.54 0.574 0 C-N-CA 124.855 1.262 . . . . 0.0 108.741 -179.337 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 . . . . . 0 C--O 1.224 -0.284 0 CA-C-O 118.52 -0.752 . . . . 0.0 112.267 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -58.2 -51.26 70.5 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.485 1.039 . . . . 0.0 110.766 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.32 -42.26 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.904 1.682 . . . . 0.0 109.704 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.56 -42.82 67.35 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.417 0.687 . . . . 0.0 111.535 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.281 1.433 . . . . 0.0 109.912 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.67 -51.11 70.76 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -55.23 -48.51 73.81 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.412 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -56.91 -42.07 79.26 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.75 0.82 . . . . 0.0 110.818 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -55.04 -54.76 38.95 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.777 1.231 . . . . 0.0 111.497 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -78.23 -40.76 36.37 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.339 0.518 . . . . 0.0 111.709 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -55.61 -41.09 72.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.51 1.124 . . . . 0.0 111.713 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 . . . . . 0 CA--C 1.534 0.33 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.159 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -102.4 130.28 49.11 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.59 116.94 27.06 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.567 1.147 . . . . 0.0 108.4 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.52 141.34 35.51 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -140.47 104.35 4.75 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.0 m -155.49 150.57 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 112.011 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -110.75 101.92 10.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.214 1.37 . . . . 0.0 108.187 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.66 116.13 0.91 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-O 116.763 -2.132 . . . . 0.0 108.916 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -66.88 -57.14 7.57 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 121.717 2.759 . . . . 0.0 113.425 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -66.29 -44.63 82.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -52.12 -50.51 61.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 125.756 1.622 . . . . 0.0 110.908 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -63.97 -47.07 81.85 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.942 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -51.21 -53.87 30.97 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 124.063 0.852 . . . . 0.0 110.427 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.7 mt -60.17 -58.22 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 125.251 1.42 . . . . 0.0 110.494 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mp -55.62 -44.24 76.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 117.824 -1.084 . . . . 0.0 113.232 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 22.4 ttp -62.73 -48.07 80.84 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 119.907 1.231 . . . . 0.0 109.961 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -55.76 -50.94 69.06 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 118.428 0.558 . . . . 0.0 110.274 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 mt -65.51 -30.73 71.53 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 24.8 tptt -64.51 -60.0 3.66 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.65 -44.6 81.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.194 0.998 . . . . 0.0 110.896 -179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 31.0 t -52.55 -46.45 66.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.041 0.937 . . . . 0.0 110.33 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.67 -45.88 56.66 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.984 0.514 . . . . 0.0 111.204 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -56.34 -39.88 73.56 Favored 'General case' 0 C--O 1.238 0.473 0 O-C-N 121.672 -0.642 . . . . 0.0 110.343 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.75 -53.88 23.75 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.137 0.975 . . . . 0.0 108.523 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.31 -39.69 67.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.833 0.742 . . . . 0.0 112.401 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -73.3 -29.27 62.6 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.372 1.069 . . . . 0.0 110.4 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 20.8 tp -86.31 -33.23 20.67 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.853 -1.154 . . . . 0.0 113.643 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 12.4 m -94.97 148.27 34.43 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 120.019 1.281 . . . . 0.0 110.883 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.62 -174.93 1.19 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.187 1.925 . . . . 0.0 109.066 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -113.58 82.13 6.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 O-C-N 121.614 -0.678 . . . . 0.0 112.244 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -80.86 -102.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.494 0 C-N-CA 124.181 3.254 . . . . 0.0 111.873 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.27 -35.7 65.31 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.541 -1.35 . . . . 0.0 109.99 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.413 ' HB ' HD13 ' A' ' 28' ' ' LEU . 3.7 m -56.39 -37.03 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 C-N-CA 124.351 1.06 . . . . 0.0 112.581 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.29 -46.67 22.27 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 6.1 m -56.23 -42.46 77.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 123.385 0.428 . . . . 0.0 110.329 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -67.78 -50.53 56.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 126.168 1.787 . . . . 0.0 108.315 178.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -52.85 -47.74 67.55 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.601 1.091 . . . . 0.0 111.134 -178.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.85 -42.2 86.12 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.172 0.897 . . . . 0.0 112.559 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.84 -38.28 82.97 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.525 -0.734 . . . . 0.0 110.517 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -46.81 78.0 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.53 -35.11 65.31 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.55 1.54 . . . . 0.0 110.975 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.32 -24.47 29.07 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.356 1.434 . . . . 0.0 111.832 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.4 tt . . . . . 0 CA--C 1.532 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 110.265 179.222 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.1 tp -69.19 95.53 0.76 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.85 0.86 . . . . 0.0 109.247 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.21 170.97 9.02 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.739 1.216 . . . . 0.0 109.519 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -146.12 154.62 42.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.973 1.309 . . . . 0.0 108.532 179.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -125.36 91.97 47.91 Favored Pre-proline 0 N--CA 1.45 -0.439 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.94 112.4 3.28 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.592 2.194 . . . . 0.0 107.033 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1010 ' ' VAL . . . . . 0.5 HG22 ' HE3' ' A' ' 23' ' ' LYS . 46.7 t -144.83 155.7 14.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -135.44 103.76 5.59 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.67 112.69 0.51 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 105.62 -2.992 . . . . 0.0 105.62 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -59.49 -51.91 67.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 122.172 2.986 . . . . 0.0 108.615 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -71.04 -39.95 72.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.221 1.009 . . . . 0.0 111.145 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -63.51 -42.16 98.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.45 0.7 . . . . 0.0 110.261 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 71.2 t80 -61.68 -45.14 95.29 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.769 1.228 . . . . 0.0 108.89 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -56.64 -50.43 72.08 Favored 'General case' 0 N--CA 1.462 0.161 0 O-C-N 123.28 0.363 . . . . 0.0 110.857 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.3 ttm -64.79 -46.08 83.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.117 0.567 . . . . 0.0 111.293 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 46.9 mt -60.46 -46.48 89.91 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.403 -178.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.69 -49.04 70.0 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.265 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.91 -49.7 70.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.388 0.675 . . . . 0.0 111.468 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 79.2 mt -70.17 -39.27 76.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.647 -0.658 . . . . 0.0 110.372 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -61.26 -45.47 94.37 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.56 0.744 . . . . 0.0 110.752 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -52.26 65.89 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.0 0.92 . . . . 0.0 108.654 -179.112 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 26.7 m -58.1 -45.87 86.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 123.479 0.712 . . . . 0.0 112.33 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.43 -36.39 81.14 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.869 0.758 . . . . 0.0 111.099 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.59 -48.49 66.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 121.638 -0.664 . . . . 0.0 111.421 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.47 -40.66 70.13 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.071 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 5.2 ppp? -62.49 -40.22 95.99 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.316 0.962 . . . . 0.0 109.928 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -76.21 -34.89 59.27 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 118.961 0.8 . . . . 0.0 111.438 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 59.9 t80 -69.56 -40.06 77.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.088 0.858 . . . . 0.0 112.626 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 28.4 tp . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.735 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 5.9 m-70 . . . . . 0 N--CA 1.466 0.352 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.0 m -56.31 -52.23 65.28 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.697 1.135 . . . . 0.0 110.22 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.96 -46.21 92.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 128.243 2.617 . . . . 0.0 111.424 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -69.87 -47.5 62.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.809 -0.615 . . . . 0.0 111.642 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.7 m -55.12 -39.28 69.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.81 0.844 . . . . 0.0 109.062 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -53.58 49.23 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.272 0.629 . . . . 0.0 110.695 178.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -57.49 -44.27 84.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 118.795 -0.621 . . . . 0.0 110.046 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -54.61 -44.09 72.77 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.147 0.579 . . . . 0.0 110.208 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -61.83 -55.29 31.41 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.0 -44.06 73.55 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.86 0.755 . . . . 0.0 112.602 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -55.99 -36.36 67.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.521 1.529 . . . . 0.0 112.308 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 . . . . . 0 CA--C 1.536 0.429 0 CA-C-N 118.635 0.652 . . . . 0.0 110.862 -179.744 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.236 0.349 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -102.38 157.23 17.06 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -137.27 158.02 45.35 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.96 0.504 . . . . 0.0 109.728 -179.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 1.3 mt -152.51 108.68 3.39 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -102.08 98.74 8.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.13 2.572 . . . . 0.0 105.874 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.3 m -151.86 151.43 12.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 C-N-CA 124.783 1.233 . . . . 0.0 110.046 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -122.26 102.35 8.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 118.994 0.815 . . . . 0.0 112.056 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.42 113.37 0.79 Allowed Glycine 0 CA--C 1.504 -0.621 0 N-CA-C 105.179 -3.168 . . . . 0.0 105.179 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.39 -56.85 16.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 119.667 1.734 . . . . 0.0 110.623 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 37.9 mttp -62.62 -49.31 75.69 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.289 1.036 . . . . 0.0 108.624 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -52.46 -49.54 64.44 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.89 1.276 . . . . 0.0 111.251 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.5 t80 -65.12 -39.92 93.76 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 119.412 1.005 . . . . 0.0 111.77 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -54.57 -53.56 52.91 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.209 0.913 . . . . 0.0 108.805 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1111 ' ' ILE . . . . . 0.47 ' CG2' HD11 ' A' ' 22' ' ' ILE . 37.8 mt -62.38 -57.79 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.998 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.66 -45.38 81.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 116.953 -1.499 . . . . 0.0 113.81 -178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 2.0 ttt -61.79 -49.0 78.09 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 120.851 1.66 . . . . 0.0 109.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -57.31 -52.06 66.87 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.47 -25.89 66.93 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.778 -0.576 . . . . 0.0 112.122 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.4 tptt -63.06 -60.54 3.3 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 118.901 0.773 . . . . 0.0 109.303 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.98 -31.95 73.44 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 124.679 1.237 . . . . 0.0 111.459 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 33.4 t -55.16 -51.99 64.72 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.016 0.826 . . . . 0.0 109.173 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.22 -42.89 79.12 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 122.197 0.199 . . . . 0.0 110.878 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -59.19 -45.0 92.22 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.531 -0.73 . . . . 0.0 110.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 30.6 mt -65.78 -53.82 35.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.189 0.995 . . . . 0.0 109.773 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.66 -34.24 69.17 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.885 0.766 . . . . 0.0 110.834 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -79.04 -22.21 45.74 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.712 1.142 . . . . 0.0 110.369 178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 48.9 tp -90.48 -34.3 15.63 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 120.688 -1.257 . . . . 0.0 113.124 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 13.8 m -95.28 147.45 33.04 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 119.763 1.165 . . . . 0.0 110.832 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.0 178.04 5.78 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.075 1.85 . . . . 0.0 108.721 178.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -108.89 87.85 4.93 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -84.98 -100.45 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.327 0 C-N-CA 124.048 3.165 . . . . 0.0 108.884 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.8 -32.99 64.0 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 126.545 1.938 . . . . 0.0 111.269 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.1 m -56.9 -41.33 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 118.869 0.758 . . . . 0.0 110.755 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -74.68 -45.45 44.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.416 1.086 . . . . 0.0 109.425 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 43.5 m -61.31 -38.47 86.98 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 20.2 t80 -67.28 -52.58 38.97 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.911 1.285 . . . . 0.0 107.699 178.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -48.24 69.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.394 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -61.71 -53.9 49.79 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.819 0.736 . . . . 0.0 111.42 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -58.14 -40.51 81.52 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.806 -0.558 . . . . 0.0 111.425 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 12.8 tm0? -70.69 -33.61 71.1 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.852 0.861 . . . . 0.0 110.144 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.64 -32.86 73.97 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.912 1.285 . . . . 0.0 108.912 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 77.3 mt -54.75 -25.31 26.95 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.112 0.869 . . . . 0.0 112.387 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.535 0.375 0 C-N-CA 125.219 1.408 . . . . 0.0 111.054 -179.94 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 . . . . . 0 CA--C 1.534 0.344 0 CA-C-O 120.04 -0.028 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 47.6 tp -72.0 118.01 14.34 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.832 0.853 . . . . 0.0 108.777 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.2 mp -113.92 162.45 16.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.369 1.867 . . . . 0.0 107.388 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -135.23 124.25 24.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.13 96.05 1.13 Allowed Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.49 1.516 . . . . 0.0 108.782 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.31 103.51 1.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.489 2.793 . . . . 0.0 112.021 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -138.61 156.16 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.514 -1.366 . . . . 0.0 109.14 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -135.31 103.11 5.39 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 104.743 -2.317 . . . . 0.0 104.743 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 114.53 0.59 Allowed Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 106.716 -2.554 . . . . 0.0 106.716 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.0 tpt85 -64.52 -51.04 64.95 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 120.519 2.16 . . . . 0.0 110.535 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.46 -32.47 71.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.805 0.73 . . . . 0.0 110.684 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -66.64 -50.93 61.35 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 110.28 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -56.87 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.877 0.871 . . . . 0.0 109.015 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -55.65 -49.5 72.74 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.418 0.287 . . . . 0.0 110.587 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.6 ttm -61.17 -47.25 87.04 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.67 0.668 . . . . 0.0 111.281 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.64 -32.07 73.44 Favored 'General case' 0 C--O 1.227 -0.099 0 CA-C-O 118.53 -0.748 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -71.23 -53.97 12.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.468 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.05 -48.83 77.59 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.121 0.968 . . . . 0.0 111.181 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.0 mt -71.98 -36.96 59.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 O-C-N 121.527 -0.733 . . . . 0.0 111.574 -178.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -66.31 -52.44 47.21 Favored 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 121.063 -1.023 . . . . 0.0 109.228 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.64 -37.31 87.14 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.938 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -56.13 -52.11 65.5 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.289 0.95 . . . . 0.0 109.459 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -65.98 -48.43 71.27 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.11 0.564 . . . . 0.0 111.666 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -50.59 73.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-N 118.416 0.553 . . . . 0.0 111.149 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.11 -38.86 92.6 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 117.692 -1.147 . . . . 0.0 109.786 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.43 -28.94 67.41 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.22 1.008 . . . . 0.0 110.208 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -90.98 -30.79 16.62 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.468 -0.77 . . . . 0.0 111.018 178.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -78.67 -25.32 44.87 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 118.149 -0.929 . . . . 0.0 113.206 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 179.309 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.0 m170 . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.2 m -66.6 -32.58 74.01 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.55 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.0 mm -62.27 -47.42 93.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.99 -53.94 51.86 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.661 0.785 . . . . 0.0 110.909 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.6 m -58.08 -50.17 74.38 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.384 1.874 . . . . 0.0 110.51 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.97 -49.41 77.96 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.507 0.723 . . . . 0.0 110.014 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.0 mtp85 -58.92 -43.19 91.05 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -61.32 -55.06 36.02 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.317 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -53.19 -54.31 37.76 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.924 0.89 . . . . 0.0 110.381 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -53.6 -47.92 69.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.037 1.335 . . . . 0.0 111.153 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -67.42 -46.09 74.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.71 0.804 . . . . 0.0 111.484 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 . . . . . 0 CA--C 1.528 0.1 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.023 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 N--CA 1.465 0.321 0 N-CA-C 107.977 -1.119 . . . . 0.0 107.977 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -111.0 139.57 46.24 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -124.75 144.1 50.42 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.874 1.67 . . . . 0.0 110.691 -177.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.6 mp -131.17 145.77 52.08 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.487 1.515 . . . . 0.0 108.872 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -145.64 107.4 4.28 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.133 1.773 . . . . 0.0 108.357 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 70.7 t -155.63 151.16 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 127.306 2.242 . . . . 0.0 108.498 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -107.51 101.71 11.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 177.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.73 114.54 0.87 Allowed Glycine 0 CA--C 1.523 0.563 0 CA-C-O 116.851 -2.083 . . . . 0.0 108.092 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -68.17 -58.48 4.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.854 2.827 . . . . 0.0 113.963 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -62.74 -46.44 88.07 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -54.97 -44.53 74.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 124.302 1.001 . . . . 0.0 112.031 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -65.21 -48.58 72.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 120.078 1.308 . . . . 0.0 110.789 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -58.7 -49.44 77.58 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.645 1.111 . . . . 0.0 110.816 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 68.8 mt -61.51 -53.68 45.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.312 1.445 . . . . 0.0 111.311 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 8.8 mt -63.58 -35.83 81.79 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 117.476 -1.25 . . . . 0.0 110.573 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 30.5 mtp -62.13 -46.66 88.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 120.491 1.496 . . . . 0.0 110.87 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -64.21 -51.83 61.78 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.924 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 85.3 mt -60.68 -34.82 74.91 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.5 tppt? -63.73 -53.83 44.91 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -62.51 -45.75 91.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.7 0.625 . . . . 0.0 111.95 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 22.5 m -57.09 -38.53 73.5 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.524 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -45.28 72.59 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.851 0.751 . . . . 0.0 109.77 179.473 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -58.84 -44.54 90.97 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.85 -32.82 69.96 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.535 -0.728 . . . . 0.0 110.086 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 27.0 ttt -66.97 -40.99 87.6 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.73 -31.37 72.33 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 118.46 0.573 . . . . 0.0 110.638 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 tp -71.53 -34.28 69.91 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.341 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.2 m -94.51 148.95 35.82 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 119.424 1.011 . . . . 0.0 112.636 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.5 -91.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.918 0 N-CA-C 107.395 -1.809 . . . . 0.0 107.395 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -160.96 57.82 0.91 Allowed Pre-proline 0 CA--C 1.546 0.793 0 CA-C-N 120.99 1.723 . . . . 0.0 111.341 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.37 -88.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.868 2.379 . . . . 0.0 112.365 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.91 -25.77 67.3 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.365 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.6 t -56.83 -55.0 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.521 1.129 . . . . 0.0 108.712 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.16 -42.1 84.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.405 1.002 . . . . 0.0 110.53 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.6 -49.76 69.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.889 0.476 . . . . 0.0 111.256 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -70.36 -48.62 55.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.681 1.592 . . . . 0.0 110.344 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -56.54 -41.44 76.83 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.289 0.95 . . . . 0.0 110.47 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -63.58 -51.74 64.03 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.275 0.943 . . . . 0.0 108.823 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -55.3 -41.92 72.98 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.492 0.717 . . . . 0.0 109.602 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.54 -28.12 63.65 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.386 -0.821 . . . . 0.0 110.475 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -63.05 -36.36 83.32 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 34.1 mt -66.48 -2.74 4.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.798 0.839 . . . . 0.0 111.861 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 126.726 2.01 . . . . 0.0 110.11 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.8 tp10 . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 103.083 -2.932 . . . . 0.0 103.083 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.59 106.9 0.72 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.64 165.58 12.64 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 125.145 1.378 . . . . 0.0 108.973 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -135.06 149.66 50.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.251 1.421 . . . . 0.0 107.481 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.6 89.73 45.0 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.05 111.28 3.24 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.6 2.867 . . . . 0.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 50.2 t -145.61 162.28 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 124.123 0.969 . . . . 0.0 109.03 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1011 ' ' ARG . . . . . 0.413 ' HG2' HH11 ' C' 1011 ' ' ARG . 8.7 ptt-85 -134.91 104.76 6.1 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 103.438 -2.801 . . . . 0.0 103.438 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.04 108.94 0.33 Allowed Glycine 0 C--O 1.227 -0.292 0 CA-C-O 117.206 -1.886 . . . . 0.0 109.15 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 26.8 tpt85 -61.03 -52.76 63.61 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.818 2.309 . . . . 0.0 112.565 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.52 -30.83 53.06 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.348 -0.845 . . . . 0.0 112.192 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -40.29 76.82 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 41.3 t80 -62.33 -51.33 68.05 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -49.84 -57.36 7.56 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.011 0.924 . . . . 0.0 110.952 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 7.9 tmm? -60.39 -49.06 79.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.7 -34.42 78.26 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 119.15 0.886 . . . . 0.0 111.267 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.0 mm? -68.14 -48.28 65.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.542 1.065 . . . . 0.0 109.613 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -58.8 -48.78 80.08 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.317 0.647 . . . . 0.0 110.447 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.4 mt -67.79 -44.33 85.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 118.191 0.45 . . . . 0.0 111.292 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -63.08 -46.07 89.13 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 119.003 0.82 . . . . 0.0 109.028 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -60.37 -48.74 80.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.893 0.877 . . . . 0.0 108.773 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 20.4 t -53.45 -52.07 60.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.718 0.807 . . . . 0.0 111.247 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.44 -58.06 6.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.289 1.435 . . . . 0.0 112.831 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -46.67 88.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -177.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.29 -39.59 92.74 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 117.69 -1.148 . . . . 0.0 109.684 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -59.12 -31.75 69.22 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.034 0.833 . . . . 0.0 109.322 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -80.68 -30.56 36.48 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.846 0.748 . . . . 0.0 110.842 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -75.88 -45.63 34.49 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.318 1.047 . . . . 0.0 113.135 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 4.6 pp . . . . . 0 C--O 1.24 0.558 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -177.369 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 11.5 m170 . . . . . 0 CA--C 1.536 0.424 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 1.9 m -65.41 -36.2 83.21 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.52 -1.362 . . . . 0.0 110.948 -179.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.4 mm -59.47 -44.26 92.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 119.613 1.097 . . . . 0.0 108.209 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.29 -58.32 9.14 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.455 1.102 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 53.1 m -61.33 -31.34 71.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.609 0.764 . . . . 0.0 111.924 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.11 -53.72 18.75 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.73 -41.25 81.44 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 122.993 0.517 . . . . 0.0 110.46 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -55.67 -57.54 11.54 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.253 1.021 . . . . 0.0 110.557 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -68.2 -35.78 78.52 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.887 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -57.79 -48.6 79.23 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.391 0.996 . . . . 0.0 109.545 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -68.27 -29.81 68.69 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.492 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 . . . . . 0 CA--C 1.538 0.514 0 CA-C-N 120.248 1.386 . . . . 0.0 109.494 177.976 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 79.6 m . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.09 144.46 49.3 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.56 161.12 32.22 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.822 1.249 . . . . 0.0 112.248 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.0 mp -145.36 133.07 21.01 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.34 106.75 9.73 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 104.351 -2.463 . . . . 0.0 104.351 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 40.1 t -152.49 142.25 14.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 118.52 0.6 . . . . 0.0 109.601 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.8 100.62 9.82 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.39 115.06 0.84 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.365 -2.694 . . . . 0.0 106.365 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -57.77 10.68 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.682 2.741 . . . . 0.0 111.823 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 22.0 mmtt -63.31 -48.55 77.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -52.16 -44.17 64.48 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 123.929 0.892 . . . . 0.0 111.71 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 27.8 t80 -67.08 -50.08 62.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.061 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.33 -49.28 74.8 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.169 0.895 . . . . 0.0 110.945 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.79 -53.43 48.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 124.79 1.236 . . . . 0.0 109.61 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.75 -28.03 68.74 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.162 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 7.7 mtp -64.89 -51.8 60.0 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 120.401 1.455 . . . . 0.0 109.834 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -48.22 82.58 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 123.412 0.445 . . . . 0.0 110.245 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.211 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -55.78 -54.93 38.41 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.733 0.813 . . . . 0.0 108.896 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -58.74 -53.83 53.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.764 1.226 . . . . 0.0 110.425 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 38.2 m -56.78 -42.71 79.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.323 -0.846 . . . . 0.0 112.575 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.81 -34.8 78.98 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.761 1.164 . . . . 0.0 110.367 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -68.2 -40.35 82.21 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1121 ' ' LEU . . . . . 0.401 HD13 ' HA ' ' D' 1121 ' ' LEU . 3.7 mm? -69.85 -35.34 74.64 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.28 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.2 ttt -61.27 -49.98 74.87 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.2 -28.84 68.41 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.011 0.823 . . . . 0.0 111.301 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.8 tm? -68.97 -32.91 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.387 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 32.3 m -91.08 147.04 34.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 119.897 1.226 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -72.32 -79.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.927 2.418 . . . . 0.0 111.058 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -165.44 64.24 0.98 Allowed Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.003 1.321 . . . . 0.0 109.834 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -80.78 -106.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 123.664 2.909 . . . . 0.0 113.264 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.62 -32.12 68.73 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.757 1.223 . . . . 0.0 110.145 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 14.1 t -54.24 -53.79 26.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.124 1.37 . . . . 0.0 109.277 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.32 -40.41 95.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.795 1.638 . . . . 0.0 110.981 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -61.91 -50.6 71.54 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.67 -33.39 74.83 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.197 0.599 . . . . 0.0 109.945 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -59.17 -47.23 86.06 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -60.58 -51.99 67.05 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -53.75 -44.71 70.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.794 1.238 . . . . 0.0 112.509 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.23 -29.16 57.45 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.245 -0.909 . . . . 0.0 111.055 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 30.7 tp60 -63.89 -35.3 80.2 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.258 -0.901 . . . . 0.0 109.312 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.14 -31.94 61.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.446 0.699 . . . . 0.0 111.357 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 C-N-CA 123.405 0.682 . . . . 0.0 112.49 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 . . . . . 0 N--CA 1.453 -0.275 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.6 tp -76.7 101.58 5.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 124.206 1.002 . . . . 0.0 108.771 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.6 mt -94.53 158.67 15.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 106.76 -1.571 . . . . 0.0 106.76 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -129.69 123.04 30.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -98.07 99.34 6.81 Favored Pre-proline 0 N--CA 1.447 -0.586 0 C-N-CA 124.033 0.933 . . . . 0.0 109.346 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.06 126.85 10.19 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.383 2.056 . . . . 0.0 107.259 177.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.3 t -146.05 146.27 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 119.203 0.911 . . . . 0.0 109.825 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.6 ptt85 -135.97 101.17 4.64 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.44 130.96 2.22 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 105.209 -3.156 . . . . 0.0 105.209 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.6 tpp85 -70.18 -52.07 26.23 Favored 'General case' 0 CA--C 1.524 -0.047 0 CA-C-N 120.869 2.334 . . . . 0.0 111.08 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -70.37 -34.72 72.93 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -57.28 -42.66 82.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.825 0.85 . . . . 0.0 108.717 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -67.0 -53.13 34.27 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 118.521 -0.752 . . . . 0.0 109.115 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -52.84 -57.23 10.91 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.162 0.985 . . . . 0.0 111.798 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -57.76 -53.6 56.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.594 0.758 . . . . 0.0 111.683 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -46.81 83.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.946 0.899 . . . . 0.0 112.119 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tt -67.79 -55.5 12.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.809 1.643 . . . . 0.0 111.275 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.26 -48.44 74.0 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 118.505 -0.76 . . . . 0.0 111.548 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.9 mt -61.37 -46.32 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 119.289 0.95 . . . . 0.0 108.913 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.3 tmtt? -55.9 -39.24 71.31 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-O 116.889 -1.529 . . . . 0.0 110.087 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -64.98 -39.5 93.58 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.71 1.141 . . . . 0.0 111.316 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.64 -52.03 66.88 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.787 0.722 . . . . 0.0 110.996 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -70.09 -37.74 75.49 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.183 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -61.77 -54.14 46.47 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-O 117.879 -1.057 . . . . 0.0 109.136 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.43 -38.98 91.52 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.577 1.08 . . . . 0.0 110.566 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.3 ttt -58.05 -32.93 68.48 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.387 0.54 . . . . 0.0 109.8 178.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -88.91 -39.37 13.83 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.296 1.038 . . . . 0.0 111.468 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.438 1.095 . . . . 0.0 111.402 -179.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp . . . . . 0 CA--C 1.535 0.377 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 179.018 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.1 t60 . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.72 -44.18 77.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 119.19 0.904 . . . . 0.0 112.747 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.8 mm -66.37 -43.62 91.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 124.831 1.252 . . . . 0.0 110.337 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.01 -52.81 63.97 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.208 2.203 . . . . 0.0 108.488 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.9 m -65.18 -39.47 92.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.947 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.08 -46.78 87.4 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 119.974 1.261 . . . . 0.0 108.977 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -48.35 69.26 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.165 0.986 . . . . 0.0 109.258 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -64.04 -55.68 20.5 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.201 1.4 . . . . 0.0 111.531 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -58.33 -38.19 76.64 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.919 1.236 . . . . 0.0 112.346 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -63.37 -51.2 66.86 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.01 -41.24 97.85 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.276 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 . . . . . 0 CA--C 1.531 0.236 0 C-N-CA 124.919 1.288 . . . . 0.0 112.491 -179.451 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 5.1 m . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -101.37 144.84 29.7 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -126.16 159.03 34.02 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.52 0.728 . . . . 0.0 109.802 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.0 mp -139.69 152.28 46.57 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -142.89 98.49 3.29 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.167 1.787 . . . . 0.0 107.968 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.53 150.81 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.496 0.719 . . . . 0.0 111.074 -178.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -116.66 102.77 9.73 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.81 124.36 2.35 Favored Glycine 0 C--N 1.331 0.257 0 N-CA-C 107.564 -2.214 . . . . 0.0 107.564 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -67.62 -58.08 5.3 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 120.481 2.14 . . . . 0.0 110.424 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.9 -40.92 91.96 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 121.533 -0.729 . . . . 0.0 109.579 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 28.0 m120 -55.27 -50.55 69.22 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.437 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.62 -47.39 86.41 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.671 -178.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -53.86 49.82 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.764 0.793 . . . . 0.0 111.092 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 89.9 mt -61.01 -56.06 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.104 1.761 . . . . 0.0 111.506 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -61.6 -39.53 91.55 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 118.469 -0.777 . . . . 0.0 111.219 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 15.3 ttt -66.96 -52.33 44.2 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.168 0.895 . . . . 0.0 108.873 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -52.32 -52.05 55.26 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.183 0.593 . . . . 0.0 110.466 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.85 -38.38 79.74 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.207 -0.901 . . . . 0.0 112.859 -178.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.3 tptp -66.36 -41.84 88.91 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 120.525 1.511 . . . . 0.0 110.232 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.43 -44.36 97.26 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.803 1.241 . . . . 0.0 107.831 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 24.7 t -61.12 -44.9 96.63 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.999 1.32 . . . . 0.0 109.799 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -68.42 -31.83 71.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 117.223 -1.37 . . . . 0.0 110.319 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -60.91 -43.13 99.0 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 121.222 1.828 . . . . 0.0 107.723 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.24 -53.95 41.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.823 0.849 . . . . 0.0 110.373 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 17.2 tpt -62.36 -30.25 71.04 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -77.38 -29.19 53.13 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.921 -1.112 . . . . 0.0 110.032 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.94 -33.45 22.68 Favored 'General case' 0 C--N 1.344 0.349 0 O-C-N 121.241 -0.912 . . . . 0.0 113.34 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -95.83 148.83 35.17 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 126.59 1.956 . . . . 0.0 112.184 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -70.49 -179.54 3.32 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.423 2.082 . . . . 0.0 111.037 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -113.21 46.91 0.35 Allowed Pre-proline 0 CA--C 1.557 1.232 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -64.4 -65.99 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.879 2.386 . . . . 0.0 113.036 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.48 -26.69 68.04 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.298 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.25 -56.74 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.595 1.089 . . . . 0.0 109.092 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -65.91 -31.95 73.17 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.805 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -51.15 43.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.589 -0.72 . . . . 0.0 111.479 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.63 -34.09 77.11 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.744 1.156 . . . . 0.0 109.811 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -60.32 -48.65 80.85 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.745 0.818 . . . . 0.0 109.225 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.44 -41.6 65.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 123.048 0.539 . . . . 0.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -58.13 -46.08 86.24 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.928 0.891 . . . . 0.0 109.471 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -76.1 -28.59 57.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.59 0.756 . . . . 0.0 110.084 179.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -61.74 -31.6 71.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.259 0.936 . . . . 0.0 109.12 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -6.52 0.98 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.982 1.313 . . . . 0.0 113.272 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 18.2 tp . . . . . 0 CA--C 1.546 0.824 0 C-N-CA 125.018 1.327 . . . . 0.0 109.963 177.919 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 CA--C 1.534 0.361 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 24.6 tp -72.42 102.53 3.21 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.123 0.969 . . . . 0.0 109.384 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 59.4 mt -109.42 170.85 7.8 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 124.293 1.037 . . . . 0.0 109.436 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -138.05 152.73 49.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.37 100.04 17.0 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -79.6 115.66 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.567 2.845 . . . . 0.0 110.138 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 78.1 t -144.74 152.11 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 119.649 1.113 . . . . 0.0 110.194 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.15 102.51 5.21 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.17 113.66 0.55 Allowed Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 104.107 -3.597 . . . . 0.0 104.107 179.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -51.13 69.08 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 120.057 1.928 . . . . 0.0 113.048 -177.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -75.34 -34.14 61.16 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.299 1.039 . . . . 0.0 109.358 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 5.5 m -59.28 -50.21 74.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.962 1.305 . . . . 0.0 107.963 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.0 t80 -58.7 -51.21 70.91 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.857 1.663 . . . . 0.0 109.404 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.4 -42.33 99.35 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.49 1.041 . . . . 0.0 112.752 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.0 ttm -60.64 -50.59 72.89 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.76 -44.69 93.74 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.215 1.406 . . . . 0.0 111.569 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.42 -55.75 30.73 Favored 'General case' 0 CA--C 1.512 -0.486 0 C-N-CA 124.322 1.049 . . . . 0.0 111.482 -179.05 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -41.38 79.29 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.982 0.356 . . . . 0.0 111.543 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1022 ' ' ILE . . . . . 0.479 HG23 HD22 ' D' 1115 ' ' LEU . 81.2 mt -66.99 -43.18 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 121.655 0.74 . . . . 0.0 110.3 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -66.51 -44.83 81.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 120.794 -1.191 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -62.97 -39.61 95.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 117.997 -1.002 . . . . 0.0 111.169 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 55.4 p -61.18 -50.44 73.13 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.08 0.855 . . . . 0.0 110.409 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -68.82 -42.47 77.2 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.911 -178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.62 -51.0 71.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1028 ' ' LEU . . . . . 0.657 HD22 HG23 ' D' 1130 ' ' VAL . 42.7 tp -62.25 -43.78 98.05 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.786 0.721 . . . . 0.0 109.744 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 22.3 ttt -57.89 -35.26 70.77 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.642 0.777 . . . . 0.0 111.137 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -79.28 -49.14 12.93 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.311 1.444 . . . . 0.0 111.14 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 24.2 t80 -71.63 -23.87 61.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.749 2.02 . . . . 0.0 113.862 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 8.4 tp . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 179.461 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -50.07 74.3 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 120.978 1.717 . . . . 0.0 111.552 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.8 mm -63.82 -34.99 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -61.19 -53.4 57.43 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.861 0.755 . . . . 0.0 109.005 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 13.2 m -67.33 -35.48 79.5 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.864 -0.522 . . . . 0.0 110.793 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.3 t80 -58.77 -52.68 64.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -37.31 81.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 123.979 0.912 . . . . 0.0 109.728 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -53.5 57.15 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.078 0.951 . . . . 0.0 109.472 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -67.02 -46.08 75.57 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.19 0.996 . . . . 0.0 111.032 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -42.23 85.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.317 1.047 . . . . 0.0 109.21 179.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -65.7 -51.47 59.1 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 . . . . . 0 C--N 1.339 0.143 0 C-N-CA 124.338 1.055 . . . . 0.0 113.429 -179.422 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 C--O 1.234 0.242 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -102.23 142.12 33.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -122.94 151.17 42.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 7.3 mp -128.33 150.06 50.24 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 105.62 -1.992 . . . . 0.0 105.62 178.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tm0? -145.33 98.37 3.14 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 125.897 1.679 . . . . 0.0 106.975 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.83 140.66 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 119.074 0.852 . . . . 0.0 111.573 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -103.91 103.95 13.87 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 105.165 -2.161 . . . . 0.0 105.165 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.16 114.08 0.86 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 104.301 -3.52 . . . . 0.0 104.301 178.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -61.95 -57.52 11.4 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.491 2.145 . . . . 0.0 111.901 -178.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mttp -72.22 -35.52 68.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.494 -0.754 . . . . 0.0 109.081 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.16 -51.32 69.79 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.013 -0.994 . . . . 0.0 111.035 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.8 t80 -66.71 -43.24 84.82 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.429 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.76 -54.0 40.09 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.407 1.003 . . . . 0.0 111.817 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.06 -54.07 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 125.614 1.565 . . . . 0.0 111.657 -178.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -37.54 87.68 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 117.719 -1.134 . . . . 0.0 111.873 -178.084 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 15.1 ttt -65.3 -51.26 61.83 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -52.32 -51.74 57.01 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 123.454 0.702 . . . . 0.0 109.664 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1115 ' ' LEU . . . . . 0.479 HD22 HG23 ' C' 1022 ' ' ILE . 68.1 mt -65.23 -36.54 84.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.397 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.6 tptp -64.98 -48.4 74.16 Favored 'General case' 0 C--O 1.228 -0.079 0 CA-C-N 120.123 1.328 . . . . 0.0 109.449 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -59.02 -46.6 87.8 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.96 1.304 . . . . 0.0 108.047 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 40.7 t -57.09 -45.95 82.96 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.53 1.132 . . . . 0.0 109.97 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 2.6 mm? -70.89 -30.52 66.9 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.578 -1.201 . . . . 0.0 111.059 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -62.88 -42.6 99.83 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 121.529 1.968 . . . . 0.0 107.982 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -54.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.105 0.962 . . . . 0.0 109.567 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 13.7 tpt -60.12 -30.09 69.05 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.307 0.643 . . . . 0.0 112.711 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -76.38 -35.45 58.64 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 119.084 0.856 . . . . 0.0 110.207 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.21 -31.71 33.81 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.801 1.038 . . . . 0.0 113.801 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.2 t -94.61 147.93 34.04 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 125.378 1.471 . . . . 0.0 112.934 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -67.31 -173.09 0.4 Allowed 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 123.674 2.916 . . . . 0.0 110.818 178.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -122.92 43.48 0.76 Allowed Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -65.62 -47.16 4.31 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.106 1.871 . . . . 0.0 113.09 -178.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 26.0 tp -68.89 -39.7 79.59 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 119.372 0.987 . . . . 0.0 109.217 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1130 ' ' VAL . . . . . 0.657 HG23 HD22 ' C' 1028 ' ' LEU . 2.8 t -59.26 -50.41 79.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.39 0 CA-C-O 117.377 -1.296 . . . . 0.0 109.722 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -55.09 -51.56 65.99 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.343 1.429 . . . . 0.0 109.758 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 5.3 t -57.26 -49.88 74.66 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.161 1.384 . . . . 0.0 111.549 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.6 t80 -68.95 -41.95 77.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.336 1.455 . . . . 0.0 112.041 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 10.1 tmm_? -53.3 -47.5 69.19 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.087 1.355 . . . . 0.0 109.885 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -70.82 -53.93 13.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.125 0.97 . . . . 0.0 110.125 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -51.48 -47.27 63.26 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.656 0.782 . . . . 0.0 112.658 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -73.57 -31.62 63.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.313 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -61.81 -34.02 75.17 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.674 1.124 . . . . 0.0 109.687 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.13 -14.68 1.74 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 48.7 tp . . . . . 0 CA--C 1.546 0.82 0 C-N-CA 125.8 1.64 . . . . 0.0 111.14 177.826 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.01 108.65 1.26 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.589 0.631 . . . . 0.0 110.272 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.78 168.33 10.56 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.43 1.109 . . . . 0.0 109.643 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -135.99 142.3 44.49 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.384 1.873 . . . . 0.0 106.999 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 39.3 tp -130.5 96.04 25.2 Favored Pre-proline 0 CA--C 1.539 0.527 0 C-N-CA 123.989 0.916 . . . . 0.0 108.747 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.46 116.76 3.62 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.537 2.825 . . . . 0.0 108.799 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.9 t -145.48 160.83 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.885 1.674 . . . . 0.0 109.804 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -134.4 105.02 6.37 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.9 104.88 0.23 Allowed Glycine 0 C--O 1.227 -0.334 0 N-CA-C 106.403 -2.679 . . . . 0.0 106.403 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -64.24 -52.96 56.18 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 121.196 2.498 . . . . 0.0 113.021 -177.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.91 -30.71 69.24 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.47 -0.769 . . . . 0.0 110.864 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -43.34 81.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 126.115 1.766 . . . . 0.0 109.299 -179.001 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -61.85 -49.05 77.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.138 0.975 . . . . 0.0 108.533 178.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -60.61 -43.14 97.78 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.744 0.247 . . . . 0.0 111.423 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 8.8 tmm? -63.73 -49.95 71.05 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.841 0.857 . . . . 0.0 110.359 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 mp -61.65 -52.24 65.15 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.191 -0.909 . . . . 0.0 112.179 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -42.14 94.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.463 1.029 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -59.94 -48.61 81.0 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.205 0.526 . . . . 0.0 110.48 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.3 mt -73.62 -32.15 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.021 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' C' 1010 ' ' VAL . 19.0 ttmm -59.23 -57.54 12.57 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -36.54 73.05 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 117.054 -1.45 . . . . 0.0 109.309 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 p -55.8 -48.0 76.15 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.285 1.402 . . . . 0.0 111.327 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -42.37 62.48 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.306 1.842 . . . . 0.0 113.716 -178.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -68.88 -52.47 29.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.609 -0.682 . . . . 0.0 109.988 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.94 -39.57 92.53 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.607 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.25 66.37 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.083 0.856 . . . . 0.0 109.703 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.02 -23.99 66.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.66 -23.46 29.45 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.446 1.099 . . . . 0.0 111.523 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp . . . . . 0 CA--C 1.535 0.369 0 C-N-CA 127.776 2.431 . . . . 0.0 105.909 179.909 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.5 m170 . . . . . 0 N--CA 1.465 0.282 0 CA-C-O 118.224 -0.893 . . . . 0.0 113.296 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.7 m -56.91 -50.03 73.79 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.555 1.07 . . . . 0.0 108.952 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.8 mt -65.78 -53.64 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 126.108 1.763 . . . . 0.0 108.826 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -52.43 -53.3 47.13 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.202 1.001 . . . . 0.0 111.721 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.1 m -64.83 -47.06 79.36 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.887 0.875 . . . . 0.0 110.494 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -61.35 -41.39 96.98 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 118.965 0.802 . . . . 0.0 111.28 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -60.37 -48.55 81.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.441 1.019 . . . . 0.0 110.171 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.79 -46.04 89.84 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 123.176 0.59 . . . . 0.0 110.083 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -62.02 -47.65 83.81 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 124.451 1.1 . . . . 0.0 110.821 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -54.88 -44.52 74.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.556 1.142 . . . . 0.0 110.512 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -57.4 -50.78 71.91 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.538 0.503 0 CA-C-N 117.86 0.3 . . . . 0.0 111.268 179.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 7.1 m . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.03 129.91 48.46 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -104.31 159.41 15.73 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.841 1.656 . . . . 0.0 109.466 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.9 mt -149.12 142.51 25.23 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.871 1.668 . . . . 0.0 107.831 179.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -146.03 108.21 4.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.5 m -154.51 150.18 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.106 1.362 . . . . 0.0 109.488 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.87 101.57 8.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.225 1.375 . . . . 0.0 108.916 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.0 115.85 0.88 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-O 115.887 -2.618 . . . . 0.0 109.918 178.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -65.24 -56.91 10.09 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 122.364 3.082 . . . . 0.0 111.023 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -63.55 -47.75 80.3 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 -52.64 -48.81 66.17 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.326 -0.845 . . . . 0.0 111.349 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.94 -43.74 94.93 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.954 1.252 . . . . 0.0 112.074 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.48 -48.82 79.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.863 1.21 . . . . 0.0 110.332 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 85.0 mt -61.23 -53.71 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 124.43 1.092 . . . . 0.0 110.757 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.66 -31.69 73.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 117.911 -1.042 . . . . 0.0 111.601 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 16.2 mtp -64.41 -52.38 58.42 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.265 1.393 . . . . 0.0 109.468 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -58.14 -43.23 87.18 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.6 mt -63.2 -50.67 69.38 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.419 0.688 . . . . 0.0 111.941 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 116' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -69.69 -50.84 39.96 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 119.447 1.021 . . . . 0.0 112.669 -178.52 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -56.64 -46.78 80.81 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 118.909 0.777 . . . . 0.0 110.443 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.8 t -64.21 -36.17 83.18 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.721 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.696 HD12 HD21 ' D' 1108 ' ' ASN . 1.6 tm? -69.83 -43.31 72.26 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -60.25 -33.98 73.06 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.898 1.226 . . . . 0.0 109.784 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -73.15 -44.05 60.62 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.2 tpt -63.98 -25.77 68.28 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.465 1.106 . . . . 0.0 109.7 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.5 -46.32 17.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.665 1.986 . . . . 0.0 109.606 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -75.4 -32.33 60.72 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.098 0.863 . . . . 0.0 113.118 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -91.63 147.85 36.06 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.46 -176.8 1.52 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.367 2.045 . . . . 0.0 110.429 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.96 56.58 0.37 Allowed Pre-proline 0 CA--C 1.551 1.006 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.36 -74.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.263 2.642 . . . . 0.0 113.109 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.8 tt -56.12 -44.35 79.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 25.5 t -50.97 -53.79 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 126.959 2.104 . . . . 0.0 112.103 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.52 -42.66 91.75 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.307 0.958 . . . . 0.0 111.421 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 29.5 m -64.39 -44.34 91.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.464 0.575 . . . . 0.0 109.727 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -56.92 -51.93 67.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.829 1.652 . . . . 0.0 108.78 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -54.18 -46.96 72.51 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 117.48 -1.248 . . . . 0.0 111.245 -178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -68.56 -49.83 56.46 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 120.997 1.726 . . . . 0.0 112.086 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -56.98 -37.67 71.95 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.837 0.455 . . . . 0.0 110.975 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -77.57 -41.98 36.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 110.051 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -54.23 -32.52 56.14 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.912 1.233 . . . . 0.0 110.442 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.28 -19.64 55.74 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.854 -0.529 . . . . 0.0 111.828 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 N--CA 1.463 0.2 0 O-C-N 120.727 -1.233 . . . . 0.0 110.308 178.93 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.0 tt -68.05 120.08 13.69 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.34 167.55 10.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 123.373 1.558 . . . . 0.0 109.702 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -136.12 148.01 48.04 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 126.905 2.082 . . . . 0.0 106.287 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 9.0 tp -137.11 94.57 12.43 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.38 111.17 3.22 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.209 3.273 . . . . 0.0 109.035 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1010 ' ' VAL . . . . . 0.419 HG21 ' HE3' ' A' ' 23' ' ' LYS . 54.0 t -145.35 156.01 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -135.65 105.04 6.01 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.132 -0.98 . . . . 0.0 109.869 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.7 114.96 0.6 Allowed Glycine 0 CA--C 1.529 0.919 0 N-CA-C 106.503 -2.639 . . . . 0.0 106.503 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -67.86 -50.68 55.16 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 122.73 3.265 . . . . 0.0 111.086 -179.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -41.49 85.86 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -48.72 79.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 124.518 1.127 . . . . 0.0 110.055 -179.345 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 55.0 t80 -57.26 -54.74 43.38 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.921 0.889 . . . . 0.0 110.864 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -62.57 -37.52 86.5 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 12.0 tmm? -66.14 -49.8 66.19 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.627 -0.671 . . . . 0.0 109.444 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.21 -45.2 93.99 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.494 0.717 . . . . 0.0 110.308 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -61.69 -54.37 43.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.022 0.929 . . . . 0.0 111.327 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -54.97 -48.37 73.33 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.809 0.844 . . . . 0.0 111.238 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 96.7 mt -71.46 -40.59 72.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 119.113 -0.47 . . . . 0.0 111.011 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -47.4 85.83 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 119.532 1.06 . . . . 0.0 108.16 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.03 -46.39 85.41 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.517 1.136 . . . . 0.0 108.754 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 34.1 p -54.39 -50.06 68.41 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 118.398 0.544 . . . . 0.0 111.656 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -46.47 89.14 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 122.114 0.959 . . . . 0.0 111.57 -178.285 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -52.64 64.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.834 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.86 -48.56 71.17 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.154 1.781 . . . . 0.0 112.937 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -41.38 63.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.845 1.658 . . . . 0.0 109.185 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -87.72 -25.09 23.63 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 118.16 -0.924 . . . . 0.0 111.671 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -75.69 -23.04 56.15 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.89 1.677 . . . . 0.0 111.15 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 39.5 tp . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 125.837 1.655 . . . . 0.0 106.907 -179.952 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 50.7 m170 . . . . . 0 N--CA 1.462 0.147 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 3.0 m -56.63 -47.44 79.67 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.2 mt -69.58 -49.94 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 C-N-CA 126.534 1.933 . . . . 0.0 109.783 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -55.02 -54.45 42.87 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.809 0.844 . . . . 0.0 111.252 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.9 m -59.92 -46.09 90.48 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.336 0.655 . . . . 0.0 109.741 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 23.0 t80 -59.1 -45.3 91.21 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.632 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -48.82 80.1 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.654 0.782 . . . . 0.0 110.435 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -44.03 91.54 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 121.876 -0.515 . . . . 0.0 110.541 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -64.44 -42.44 95.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.539 -0.743 . . . . 0.0 110.727 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 43.6 mm-40 -60.74 -35.19 75.74 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.644 1.178 . . . . 0.0 110.744 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -64.95 -54.42 30.92 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.531 0.247 0 O-C-N 122.4 -0.188 . . . . 0.0 110.629 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 65.6 m . . . . . 0 C--O 1.237 0.439 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -111.09 140.69 45.43 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.845 0.831 . . . . 0.0 108.78 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.56 159.71 31.39 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.474 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.9 mt -146.23 146.95 30.97 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 177.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.63 112.84 6.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 17.4 m -155.47 151.33 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 C-N-CA 125.806 1.642 . . . . 0.0 109.258 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 102.19 11.73 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.71 108.97 0.53 Allowed Glycine 0 C--N 1.335 0.499 0 CA-C-O 117.043 -1.976 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -58.02 9.01 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 121.425 2.613 . . . . 0.0 112.573 -179.018 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -71.16 -42.77 68.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.575 -0.703 . . . . 0.0 109.144 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1108 ' ' ASN . . . . . 0.696 HD21 HD12 ' B' ' 119' ' ' LEU . 33.6 m-80 -54.05 -49.29 69.32 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.596 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 78.1 t80 -62.31 -44.65 96.01 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.335 0.97 . . . . 0.0 110.901 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.7 -45.31 94.67 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.836 0.744 . . . . 0.0 112.4 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.9 mt -66.97 -50.9 60.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.768 1.627 . . . . 0.0 109.457 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.59 -36.94 82.11 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 118.257 -0.878 . . . . 0.0 109.985 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 22.7 mtp -60.59 -52.55 64.7 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 119.464 1.029 . . . . 0.0 109.162 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -60.77 -42.01 96.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.486 -0.769 . . . . 0.0 111.229 -179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.1 mt -66.25 -46.61 76.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.601 0.637 . . . . 0.0 111.911 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.8 tptt -69.3 -54.04 16.63 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 117.122 -1.418 . . . . 0.0 111.328 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -53.17 -47.59 68.69 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 108.376 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 30.9 t -55.15 -54.28 45.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.334 0.654 . . . . 0.0 110.43 179.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -30.76 71.79 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 118.86 -0.591 . . . . 0.0 110.741 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.27 -49.07 79.07 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 120.075 1.307 . . . . 0.0 108.093 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.59 -41.18 80.0 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.124 -0.941 . . . . 0.0 108.525 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.8 tpt -64.37 -20.9 66.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.702 1.137 . . . . 0.0 111.402 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -83.12 -37.36 23.87 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.151 0.98 . . . . 0.0 108.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.22 -32.82 17.24 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 67.1 t -89.84 141.16 28.03 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 126.16 1.784 . . . . 0.0 109.35 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.78 177.25 5.07 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 123.332 2.688 . . . . 0.0 112.28 179.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -111.31 53.2 0.36 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.81 -70.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.482 2.121 . . . . 0.0 112.666 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.39 -39.07 82.21 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.5 t -52.16 -56.34 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.033 1.733 . . . . 0.0 110.654 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.43 -44.02 75.87 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.516 1.053 . . . . 0.0 111.84 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 36.8 m -57.13 -42.15 80.37 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 47.7 t80 -69.82 -44.37 70.11 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.651 1.581 . . . . 0.0 109.012 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -54.5 -48.83 71.4 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 117.911 -1.043 . . . . 0.0 110.362 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -66.48 -53.9 29.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.952 0.796 . . . . 0.0 110.992 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -54.86 -38.83 67.96 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.779 0.832 . . . . 0.0 113.203 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.47 -37.39 31.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.422 0.689 . . . . 0.0 109.966 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -57.74 -38.05 74.65 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.667 0.667 . . . . 0.0 110.049 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.4 mt -59.48 -15.23 16.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.895 0.878 . . . . 0.0 113.194 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.542 0.651 0 C-N-CA 124.171 0.988 . . . . 0.0 110.365 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 103.768 -2.678 . . . . 0.0 103.768 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.12 101.08 0.26 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.188 0.995 . . . . 0.0 109.895 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mp -92.74 173.73 7.62 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -133.35 120.31 20.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.11 0.964 . . . . 0.0 108.902 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.6 tp -104.22 101.21 25.2 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 124.178 0.991 . . . . 0.0 109.442 179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -80.8 118.92 3.52 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.312 2.675 . . . . 0.0 110.248 178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -144.64 156.49 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 125.483 1.513 . . . . 0.0 107.03 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.6 103.67 5.53 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.082 -1.011 . . . . 0.0 109.497 178.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.11 125.19 1.29 Allowed Glycine 0 C--O 1.226 -0.349 0 N-CA-C 106.013 -2.835 . . . . 0.0 106.013 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -51.26 59.79 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 121.129 2.465 . . . . 0.0 109.642 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -72.63 -30.77 64.6 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.211 1.004 . . . . 0.0 110.559 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 m -66.83 -51.56 54.14 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.297 1.439 . . . . 0.0 109.277 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -63.69 -50.37 69.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.478 0.711 . . . . 0.0 109.774 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -57.99 -57.54 12.38 Favored 'General case' 0 C--O 1.231 0.1 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -63.16 -39.29 94.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.697 0.681 . . . . 0.0 112.751 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.2 mt -72.85 -35.1 67.16 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 118.134 -0.936 . . . . 0.0 111.125 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -69.71 -41.47 75.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.095 1.316 . . . . 0.0 107.765 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -56.38 -48.75 76.22 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.473 1.109 . . . . 0.0 109.713 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.69 -46.76 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.482 0.713 . . . . 0.0 109.983 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -53.94 -50.18 67.02 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 124.003 0.921 . . . . 0.0 110.103 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -71.57 -42.89 67.25 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.77 -1.11 . . . . 0.0 111.623 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.8 t -53.7 -51.48 63.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.573 1.078 . . . . 0.0 108.79 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.47 -56.91 14.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 124.695 1.247 . . . . 0.0 110.553 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -56.24 -43.24 78.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.972 0.806 . . . . 0.0 112.58 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.62 -43.91 75.34 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.85 1.204 . . . . 0.0 110.454 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.54 -38.5 84.69 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.029 0.932 . . . . 0.0 109.258 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.99 -37.72 84.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.689 1.196 . . . . 0.0 110.214 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -79.72 -24.04 41.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.556 1.142 . . . . 0.0 112.92 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 27.6 tp . . . . . 0 CA--C 1.538 0.489 0 CA-C-N 120.297 1.408 . . . . 0.0 112.439 -178.944 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.0 m -55.83 -43.84 77.35 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.104 1.32 . . . . 0.0 110.808 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.07 -55.03 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.039 1.335 . . . . 0.0 109.594 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.3 -42.85 99.36 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 m -65.72 -31.9 73.16 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -49.98 70.43 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 178.034 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -55.87 -48.5 75.44 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.003 0.921 . . . . 0.0 109.862 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -64.07 -41.81 97.21 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.63 0.772 . . . . 0.0 111.24 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.332 -0.162 0 O-C-N 121.137 -0.977 . . . . 0.0 110.66 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -66.5 -35.53 80.48 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -69.76 -31.22 69.05 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.532 1.133 . . . . 0.0 111.525 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? . . . . . 0 N--CA 1.464 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 111.979 -179.562 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.238 0.481 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -102.02 137.02 40.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.626 1.171 . . . . 0.0 108.901 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -114.15 149.83 35.08 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.931 1.693 . . . . 0.0 108.466 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mt -144.91 145.87 31.76 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.126 1.37 . . . . 0.0 108.041 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -151.73 110.76 3.88 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.413 0.685 . . . . 0.0 111.514 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -154.02 150.87 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.246 1.818 . . . . 0.0 107.704 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 24.2 ptt85 -99.18 101.86 13.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.79 1.177 . . . . 0.0 110.092 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.35 114.55 0.81 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 116.128 -2.484 . . . . 0.0 113.323 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 tpp85 -67.35 -56.77 8.37 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 122.751 3.275 . . . . 0.0 111.052 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -64.99 -50.62 65.61 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.996 1.718 . . . . 0.0 108.503 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -47.35 64.73 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.743 2.817 . . . . 0.0 109.393 -178.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -66.64 -47.39 72.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.157 0.89 . . . . 0.0 111.187 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -57.04 -43.08 81.61 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.342 0.973 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 60.2 mt -61.25 -54.69 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.813 1.245 . . . . 0.0 107.727 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.81 -37.36 76.21 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 117.871 -1.061 . . . . 0.0 112.524 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 60.0 mtp -65.44 -54.23 31.52 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 119.921 1.237 . . . . 0.0 111.298 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 13.9 ptpt -61.85 -43.0 99.72 Favored 'General case' 0 C--N 1.34 0.175 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.74 -51.48 58.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.427 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 116' ' ' LYS . . . . . 0.405 ' HE3' HG11 ' D' 1103 ' ' VAL . 41.4 tptt -54.84 -58.86 5.87 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.466 0.707 . . . . 0.0 110.672 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -52.68 -49.22 65.73 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.659 1.984 . . . . 0.0 111.432 -179.24 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 12.4 t -62.07 -43.58 98.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.086 0.403 . . . . 0.0 110.987 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' B' ' 119' ' ' LEU . 11.7 tp -62.98 -40.15 96.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.587 -0.721 . . . . 0.0 109.149 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -47.06 86.91 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -59.35 -52.3 66.22 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.717 0.807 . . . . 0.0 111.692 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 8.0 tmm? -62.73 -28.22 69.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.678 0.791 . . . . 0.0 111.349 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.78 -22.18 22.27 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.302 1.441 . . . . 0.0 113.214 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.93 -33.73 17.16 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.39 1.45 . . . . 0.0 111.145 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 3.7 t -94.94 147.5 33.17 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -65.79 -170.83 0.19 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.604 2.869 . . . . 0.0 111.182 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -112.19 78.0 2.32 Favored Pre-proline 0 CA--C 1.544 0.738 0 O-C-N 120.214 -1.554 . . . . 0.0 113.226 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -77.97 -97.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.73 2.953 . . . . 0.0 112.483 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.1 tt -55.76 -40.73 72.98 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.744 1.218 . . . . 0.0 109.881 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -53.37 -46.11 57.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.48 1.112 . . . . 0.0 111.238 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.15 -42.05 73.03 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 121.1 -1.0 . . . . 0.0 110.36 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.5 t -57.83 -46.62 84.47 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -67.29 -39.48 85.98 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.623 1.569 . . . . 0.0 111.11 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -47.8 70.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 119.311 0.96 . . . . 0.0 109.024 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.44 -50.96 61.61 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -51.22 -44.15 61.59 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.309 1.043 . . . . 0.0 112.422 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.1 tm0? -76.59 -40.68 48.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.85 0.86 . . . . 0.0 110.666 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -53.64 -34.84 59.96 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.885 0.874 . . . . 0.0 111.435 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.02 -10.21 3.98 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 126.439 1.895 . . . . 0.0 109.94 178.765 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 CA--C 1.523 -0.08 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 5.0 tp -61.49 105.08 0.48 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.0 1.32 . . . . 0.0 111.366 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 14.4 mt -93.36 133.73 36.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -103.45 103.34 13.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.937 1.295 . . . . 0.0 107.824 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.6 tp -97.79 111.8 59.89 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 117.609 -1.186 . . . . 0.0 110.586 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -81.89 115.74 2.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.504 2.803 . . . . 0.0 111.686 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 37.6 t -143.88 148.97 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 120.039 1.291 . . . . 0.0 109.357 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.42 102.74 5.05 Favored 'General case' 0 C--N 1.346 0.428 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 179.464 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.06 136.36 4.06 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-O 115.104 -3.053 . . . . 0.0 105.475 176.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -53.46 14.69 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 122.991 3.396 . . . . 0.0 106.96 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.62 -30.23 66.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 2.4 m -66.58 -52.23 47.73 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.14 0.882 . . . . 0.0 108.947 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.48 -52.65 62.65 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -57.27 -56.54 20.53 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 124.025 0.93 . . . . 0.0 112.829 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ttm -60.53 -34.8 74.64 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.165 1.348 . . . . 0.0 112.045 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.1 mt -68.66 -53.06 24.73 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -50.09 74.85 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 124.131 0.972 . . . . 0.0 111.523 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -55.59 -48.45 74.82 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.885 1.274 . . . . 0.0 110.243 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1022 ' ' ILE . . . . . 0.442 ' CG2' HD22 ' D' 1115 ' ' LEU . 54.7 mt -70.09 -37.25 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 121.695 -0.628 . . . . 0.0 109.963 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -62.64 -51.64 66.47 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.247 1.019 . . . . 0.0 110.791 179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.63 -36.99 76.63 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.368 1.067 . . . . 0.0 108.617 -178.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 42.4 t -56.5 -48.6 76.83 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.829 1.195 . . . . 0.0 107.854 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tm? -67.55 -54.05 23.18 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.479 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.26 -52.26 63.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.692 0.678 . . . . 0.0 112.644 -178.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 85.3 mt -64.9 -47.7 76.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.233 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -57.59 -41.7 81.69 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.38 -33.46 74.3 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.085 -1.01 . . . . 0.0 110.004 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -72.16 -18.61 61.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.072 0.949 . . . . 0.0 109.766 178.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 45.6 tp . . . . . 0 CA--C 1.54 0.59 0 C-N-CA 124.842 1.257 . . . . 0.0 109.11 178.018 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 CA--C 1.531 0.24 0 CA-C-O 116.087 -1.911 . . . . 0.0 114.171 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 85.5 m -57.64 -45.2 85.76 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 122.29 2.314 . . . . 0.0 109.534 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.86 -54.59 32.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 C-N-CA 125.297 1.439 . . . . 0.0 108.623 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.31 -33.88 73.0 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 51.5 m -69.92 -52.56 23.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -47.3 76.9 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.699 0.682 . . . . 0.0 110.397 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -61.42 -49.36 77.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.626 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -68.97 -29.28 67.47 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 118.943 0.792 . . . . 0.0 112.939 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -66.97 -35.69 80.52 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.324 0.965 . . . . 0.0 108.584 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -78.61 -40.93 33.07 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -54.81 -40.93 70.01 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.803 1.241 . . . . 0.0 110.357 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.0 tm0? . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 125.047 1.339 . . . . 0.0 112.193 -179.68 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 30.1 m . . . . . 0 C--O 1.237 0.434 0 N-CA-C 110.805 -0.072 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -107.83 130.28 55.0 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.127 0.971 . . . . 0.0 110.913 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -109.96 144.02 39.08 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 127.584 2.354 . . . . 0.0 107.636 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 12.5 mt -140.98 143.48 34.51 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.267 1.427 . . . . 0.0 109.211 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -145.37 110.32 5.16 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.773 1.229 . . . . 0.0 110.21 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1103 ' ' VAL . . . . . 0.405 HG11 ' HE3' ' B' ' 116' ' ' LYS . 26.2 t -151.11 151.27 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.492 1.517 . . . . 0.0 110.316 -179.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -110.9 101.89 10.43 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 120.346 1.43 . . . . 0.0 107.312 176.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.55 108.93 0.51 Allowed Glycine 0 CA--C 1.521 0.451 0 CA-C-O 116.607 -2.219 . . . . 0.0 109.649 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -59.91 -58.2 9.58 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 121.697 2.749 . . . . 0.0 115.434 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.76 -47.47 66.15 Favored 'General case' 0 CA--C 1.508 -0.649 0 O-C-N 121.124 -0.985 . . . . 0.0 108.927 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -53.96 -43.4 69.87 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.998 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.6 t80 -66.12 -49.22 68.26 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.377 0.99 . . . . 0.0 110.886 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -52.76 -49.64 65.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.877 0.846 . . . . 0.0 110.625 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 64.4 mt -57.8 -53.78 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 126.058 1.743 . . . . 0.0 107.994 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.1 mp -59.0 -40.5 85.08 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.659 -1.162 . . . . 0.0 112.279 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 58.2 mtp -58.68 -53.22 60.79 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 120.442 1.474 . . . . 0.0 110.577 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -64.15 -40.57 96.43 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 119.981 -0.688 . . . . 0.0 112.313 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1115 ' ' LEU . . . . . 0.442 HD22 ' CG2' ' C' 1022 ' ' ILE . 55.3 mt -70.95 -33.39 70.43 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.705 -0.622 . . . . 0.0 112.518 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 23.9 tptt -64.88 -58.6 5.74 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -49.74 -48.76 49.97 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 127.693 2.397 . . . . 0.0 110.93 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 20.7 t -56.3 -54.05 50.02 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.474 1.11 . . . . 0.0 111.695 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1119 ' ' LEU . . . . . 0.4 HD12 ' HA ' ' D' 1119 ' ' LEU . 5.7 tp -59.19 -42.61 91.27 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.862 0.465 . . . . 0.0 110.842 -178.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.05 -41.24 91.89 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.223 1.009 . . . . 0.0 110.988 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 1.1 mm? -65.24 -53.63 41.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.854 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 55.8 mmm -57.8 -27.62 63.29 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -85.12 -36.71 20.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.67 -32.14 28.29 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.275 0.943 . . . . 0.0 113.19 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.37 149.22 40.69 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 126.446 1.898 . . . . 0.0 108.134 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -65.44 174.09 5.65 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.993 2.462 . . . . 0.0 111.036 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1127 ' ' GLN . . . . . 0.413 ' HA ' HG22 ' D' 1130 ' ' VAL . 16.4 mp0 -112.51 61.89 0.65 Allowed Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.359 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.68 -86.87 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.1 3.2 . . . . 0.0 111.408 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.1 -43.53 82.32 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.131 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1130 ' ' VAL . . . . . 0.413 HG22 ' HA ' ' D' 1127 ' ' GLN . 3.0 m -51.24 -40.86 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-O 118.213 -0.898 . . . . 0.0 112.124 -177.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.45 -41.84 45.99 Favored 'General case' 0 C--N 1.338 0.102 0 CA-C-N 118.748 0.704 . . . . 0.0 110.165 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -49.91 73.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.464 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 77.3 t80 -64.91 -40.01 94.4 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 127.028 2.131 . . . . 0.0 108.813 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -43.51 67.84 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.599 1.091 . . . . 0.0 108.238 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -77.62 -44.92 26.69 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.86 0.864 . . . . 0.0 111.867 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -56.79 -49.85 74.09 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.53 1.132 . . . . 0.0 110.441 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -64.02 -46.58 83.82 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.425 2.29 . . . . 0.0 108.787 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -55.32 -32.02 62.15 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.22 1.008 . . . . 0.0 111.57 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -2.42 1.37 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.546 0.804 0 C-N-CA 126.044 1.738 . . . . 0.0 108.854 177.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.567 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.2 tp -65.68 94.88 0.21 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.935 1.694 . . . . 0.0 108.847 -179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.76 137.25 36.91 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.754 1.221 . . . . 0.0 112.182 -178.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -104.19 159.23 15.87 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -142.08 101.04 5.82 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.36 125.88 10.55 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.256 1.971 . . . . 0.0 110.105 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.2 t -144.99 134.95 18.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 123.237 0.615 . . . . 0.0 110.179 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 ptt85 -136.91 102.85 4.99 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.92 117.63 0.75 Allowed Glycine 0 N--CA 1.45 -0.427 1 N-CA-C 102.786 -4.126 . . . . 0.0 102.786 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmm-85 -57.89 -51.37 69.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 121.359 2.58 . . . . 0.0 111.457 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -66.48 -40.82 89.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.906 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.86 -45.64 92.92 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.46 -0.775 . . . . 0.0 111.361 -179.034 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -58.93 -47.49 84.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.71 1.204 . . . . 0.0 109.814 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.67 -57.16 12.58 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.933 0.77 . . . . 0.0 110.736 179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.0 ptm -65.16 -42.84 93.36 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.26 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.01 -45.29 87.09 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.21 0.913 . . . . 0.0 111.175 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.5 -53.39 58.12 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 123.611 0.764 . . . . 0.0 109.496 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -40.91 97.17 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -178.39 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.439 HD11 ' CG2' ' D' 1111 ' ' ILE . 91.5 mt -67.91 -45.33 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.395 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -63.96 -44.35 93.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.281 -0.636 . . . . 0.0 109.281 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -61.03 -50.87 71.56 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.146 -0.93 . . . . 0.0 109.428 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.3 p -53.19 -40.0 64.09 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.84 1.2 . . . . 0.0 111.177 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.09 -49.96 25.56 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.475 0.58 . . . . 0.0 111.664 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.44 -53.76 53.62 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.889 1.676 . . . . 0.0 110.61 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.96 -43.33 95.11 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.499 1.519 . . . . 0.0 109.718 -179.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.8 ttt -63.47 -35.82 81.73 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.413 0.685 . . . . 0.0 110.55 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -78.29 -31.14 48.77 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.347 -0.845 . . . . 0.0 111.57 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -76.46 -35.04 58.66 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.424 0.69 . . . . 0.0 111.252 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 tp . . . . . 0 C--O 1.234 0.244 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.534 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 119.082 -0.485 . . . . 0.0 109.927 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.2 m -63.91 -52.4 60.06 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 117.988 -1.006 . . . . 0.0 111.065 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 35.7 mm -71.68 -42.04 71.1 Favored 'Isoleucine or valine' 0 C--N 1.346 0.413 0 CA-C-N 120.134 1.334 . . . . 0.0 108.934 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -57.1 -42.26 80.44 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.347 0.522 . . . . 0.0 111.071 -178.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.3 m -64.28 -52.44 58.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 109.667 178.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -50.75 71.25 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 123.628 0.771 . . . . 0.0 111.738 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 18.4 ttp85 -62.6 -38.6 90.81 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 118.2 -0.905 . . . . 0.0 109.777 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -56.62 -52.81 63.45 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 119.63 1.104 . . . . 0.0 110.564 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -65.28 -41.73 93.87 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 123.339 0.399 . . . . 0.0 110.635 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -61.77 -41.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.989 0.813 . . . . 0.0 110.254 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -66.0 -29.96 70.42 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.099 0.96 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.475 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -129.56 129.64 44.71 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -114.38 167.81 10.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.339 1.055 . . . . 0.0 109.567 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 20.1 tp -149.22 154.71 39.51 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.882 178.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -150.41 98.81 2.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.957 1.703 . . . . 0.0 110.342 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.9 t -146.74 150.05 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 119.899 -1.751 . . . . 0.0 108.62 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -116.34 100.24 7.75 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 122.284 1.04 . . . . 0.0 108.701 177.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.38 107.79 0.46 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 106.819 -2.513 . . . . 0.0 106.819 177.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -56.78 15.16 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 121.512 2.656 . . . . 0.0 111.932 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -67.01 -47.0 72.79 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -52.06 -45.51 64.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.017 1.327 . . . . 0.0 112.269 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -69.96 -43.44 71.52 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.238 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -56.74 -48.18 78.37 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.948 0.88 . . . . 0.0 110.42 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 63.9 mt -65.12 -52.35 54.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 125.29 1.436 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -36.02 82.29 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.392 -1.766 . . . . 0.0 112.269 -178.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 9.5 mtm -64.12 -52.29 59.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.86 1.664 . . . . 0.0 108.55 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -48.24 -52.13 22.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.039 0.936 . . . . 0.0 109.423 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.401 HD22 HG23 ' A' ' 22' ' ' ILE . 80.6 mt -68.33 -32.8 73.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 116' ' ' LYS . . . . . 0.451 ' HE3' HG11 ' D' 1103 ' ' VAL . 30.3 tptt -70.35 -52.08 25.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.32 -1.487 . . . . 0.0 109.451 -178.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -54.45 -52.34 62.15 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 127.783 2.433 . . . . 0.0 106.165 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 29.3 t -52.76 -48.11 66.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.733 1.213 . . . . 0.0 112.595 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -52.47 57.73 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.66 -37.96 83.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.332 0.969 . . . . 0.0 111.263 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.49 -40.82 93.53 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 117.983 -1.008 . . . . 0.0 109.486 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 54.3 ttp -66.46 -28.94 68.98 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.868 0.758 . . . . 0.0 109.546 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.18 -32.75 65.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.462 1.028 . . . . 0.0 112.075 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 -32.76 26.08 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 125' ' ' VAL . . . . . 0.458 HG22 ' HD2' ' B' ' 126' ' ' PRO . 4.0 p -85.26 148.1 49.1 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.08 0.952 . . . . 0.0 109.664 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.458 ' HD2' HG22 ' B' ' 125' ' ' VAL . 60.5 Cg_endo -63.31 173.6 4.07 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.939 1.371 . . . . 0.0 110.133 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.43 55.16 1.71 Allowed Pre-proline 0 CA--C 1.548 0.877 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.73 -49.61 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 123.116 2.544 . . . . 0.0 114.35 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -28.51 69.55 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.118 -0.989 . . . . 0.0 108.46 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 11.4 t -61.4 -49.84 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -55.2 -51.36 66.78 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.602 1.561 . . . . 0.0 111.152 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 m -67.91 -46.31 71.91 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -57.98 -49.22 77.57 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.244 0.617 . . . . 0.0 109.409 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -43.26 67.87 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.903 1.681 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.09 -57.08 5.37 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.122 0.487 . . . . 0.0 111.844 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -61.09 -29.72 69.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.309 0.643 . . . . 0.0 112.094 -178.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.22 -37.73 52.73 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 178.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -58.55 -33.07 69.5 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.741 1.155 . . . . 0.0 109.395 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.43 -21.02 49.48 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 119.11 -0.471 . . . . 0.0 111.243 178.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.54 0.584 0 C-N-CA 125.144 1.378 . . . . 0.0 112.075 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.9 tp10 . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 18.9 tp -67.37 108.99 2.97 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.838 0.855 . . . . 0.0 109.283 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.4 mt -104.42 153.3 21.27 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -126.08 101.4 6.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.43 1.092 . . . . 0.0 109.175 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.03 113.0 40.05 Favored Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -91.49 122.44 0.71 Allowed 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 123.21 2.607 . . . . 0.0 109.751 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.1 t -142.27 154.59 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 125.834 1.653 . . . . 0.0 109.398 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 26.0 ptt180 -136.73 101.81 4.72 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 121.399 1.909 . . . . 0.0 111.034 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.18 138.28 5.05 Favored Glycine 0 N--CA 1.46 0.235 0 CA-C-O 116.326 -2.374 . . . . 0.0 107.645 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -52.1 27.62 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 121.008 2.404 . . . . 0.0 111.294 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.46 -41.9 92.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.364 0.529 . . . . 0.0 109.796 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -47.63 84.87 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.415 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 52.8 t80 -65.11 -40.81 95.04 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.439 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -55.11 -57.68 10.73 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.986 0.812 . . . . 0.0 108.994 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 24.6 ptm -67.65 -35.42 78.86 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.8 -41.63 91.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.533 1.061 . . . . 0.0 110.844 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.33 -47.93 58.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 178.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -56.6 -48.61 77.05 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.128 0.971 . . . . 0.0 112.888 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 93.3 mt -70.33 -35.89 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 119.304 0.956 . . . . 0.0 110.242 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -36.34 83.46 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.6 -54.84 10.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 117.871 -1.062 . . . . 0.0 110.607 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.5 p -53.51 -43.59 68.43 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.363 1.438 . . . . 0.0 113.856 -178.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.98 -47.52 51.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.812 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -64.35 -46.09 84.94 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 67.5 mt -62.16 -44.9 95.6 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.963 0.905 . . . . 0.0 109.909 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -59.25 -41.68 89.34 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.755 0.822 . . . . 0.0 109.079 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -75.08 -25.28 58.47 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.784 0.434 . . . . 0.0 111.169 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.56 -39.17 58.57 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.373 0.988 . . . . 0.0 110.849 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 C--O 1.236 0.347 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.069 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.25 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.828 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.41 58.25 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.448 1.022 . . . . 0.0 111.883 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 47.6 mm -73.25 -40.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-O 118.548 -0.739 . . . . 0.0 110.51 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -58.98 -49.2 78.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.874 0.761 . . . . 0.0 110.474 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.0 m -61.45 -40.16 93.46 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.972 0.509 . . . . 0.0 110.965 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -53.83 26.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.825 0.45 . . . . 0.0 111.196 -179.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 16.7 ttp85 -62.26 -40.71 97.09 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.212 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -59.05 -47.87 83.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.646 0.657 . . . . 0.0 109.334 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -65.09 -45.54 84.79 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.612 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -56.37 -48.32 77.07 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.71 0.804 . . . . 0.0 110.0 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -58.49 -40.36 82.55 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.978 0.911 . . . . 0.0 110.22 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 CA--C 1.534 0.343 0 C-N-CA 123.976 0.91 . . . . 0.0 110.771 179.605 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.242 0.658 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -131.74 129.74 41.02 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -112.43 174.11 6.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.258 0.623 . . . . 0.0 112.317 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 17.4 tp -150.32 153.35 35.95 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.713 178.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.15 98.82 2.74 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.88 2.072 . . . . 0.0 109.065 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1103 ' ' VAL . . . . . 0.451 HG11 ' HE3' ' B' ' 116' ' ' LYS . 60.9 t -153.18 147.03 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.384 -0.823 . . . . 0.0 108.861 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -103.98 102.84 12.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.659 -1.276 . . . . 0.0 108.406 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.13 110.53 0.63 Allowed Glycine 0 C--O 1.223 -0.586 0 CA-C-O 117.289 -1.839 . . . . 0.0 111.695 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -67.42 -57.17 7.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 121.225 2.512 . . . . 0.0 110.189 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -69.79 -42.57 73.59 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 122.143 0.973 . . . . 0.0 109.538 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.05 -43.06 99.45 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.764 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 10.2 t80 -69.99 -37.96 75.88 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 120.086 1.312 . . . . 0.0 110.829 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -56.17 -47.49 78.16 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.425 1.011 . . . . 0.0 109.493 178.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1111 ' ' ILE . . . . . 0.439 ' CG2' HD11 ' A' ' 22' ' ' ILE . 22.5 mt -62.42 -50.16 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.826 1.25 . . . . 0.0 109.15 178.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -49.04 77.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 125.457 1.503 . . . . 0.0 112.082 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.31 -52.16 63.09 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 120.957 1.708 . . . . 0.0 109.114 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -48.79 -51.82 27.23 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.157 0.583 . . . . 0.0 111.12 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 41.8 mt -71.25 -39.67 71.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 33.6 tptt -65.27 -46.1 81.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 120.121 1.328 . . . . 0.0 110.161 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -57.18 -54.92 41.36 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.856 1.662 . . . . 0.0 106.691 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 5.5 t -52.74 -43.93 66.07 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.081 0.952 . . . . 0.0 111.765 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.81 -49.01 62.06 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -63.07 -42.05 99.57 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 5.3 mp -65.42 -45.66 83.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.846 -1.074 . . . . 0.0 108.852 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 22.7 ttp -64.35 -22.57 67.0 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.749 1.613 . . . . 0.0 111.362 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -72.25 -40.36 67.75 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.71 -33.08 35.56 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.53 147.98 68.89 Favored Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 124.752 1.221 . . . . 0.0 109.867 -179.204 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.92 -174.16 1.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.543 2.162 . . . . 0.0 110.162 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.253 13.3 pt20 -126.63 54.04 10.84 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.48 -52.51 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.935 2.423 . . . . 0.0 112.51 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.45 -41.78 85.9 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1130 ' ' VAL . . . . . 0.426 HG23 ' H ' ' D' 1130 ' ' VAL . 3.4 t -53.74 -50.27 52.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 C-N-CA 124.401 1.08 . . . . 0.0 110.529 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.29 70.22 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.491 0.662 . . . . 0.0 111.606 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 27.8 t -60.46 -46.28 90.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.792 0.837 . . . . 0.0 110.786 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.25 -45.24 81.29 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 124.716 1.206 . . . . 0.0 110.926 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.74 -45.26 66.92 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 124.5 1.12 . . . . 0.0 108.747 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -65.75 -55.96 14.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.229 0.468 . . . . 0.0 111.02 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.74 -30.88 64.0 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.579 -0.701 . . . . 0.0 112.408 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 -35.58 34.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.103 0.961 . . . . 0.0 108.772 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -58.12 -33.17 68.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.45 1.023 . . . . 0.0 108.935 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.42 -17.68 59.86 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.191 0.451 . . . . 0.0 112.135 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tt . . . . . 0 CA--C 1.538 0.51 0 C-N-CA 125.411 1.484 . . . . 0.0 108.912 179.036 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 . . . . . 0 N--CA 1.449 -0.482 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.5 tp -64.13 102.74 0.53 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.6 mt -112.77 167.71 10.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.833 2.053 . . . . 0.0 107.709 -179.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -130.26 159.43 36.92 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.808 0.843 . . . . 0.0 109.799 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.4 tp -140.39 94.72 8.41 Favored Pre-proline 0 CA--C 1.538 0.482 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.115 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.85 110.3 3.0 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 124.303 3.336 . . . . 0.0 111.653 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -139.32 151.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.535 1.134 . . . . 0.0 109.215 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -135.98 101.81 4.84 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.3 115.79 0.64 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 106.269 -2.732 . . . . 0.0 106.269 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.55 -52.01 66.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 121.315 2.558 . . . . 0.0 109.828 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -68.96 -30.72 69.2 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.4 m -63.39 -53.13 57.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.068 0.947 . . . . 0.0 109.182 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -64.87 -47.6 77.28 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.73 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -53.41 -44.87 69.07 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.422 0.556 . . . . 0.0 111.722 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.5 mtp -73.79 -43.78 57.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.554 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mp -55.24 -50.88 68.33 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.058 0.845 . . . . 0.0 109.186 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -52.71 63.2 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 126.759 2.023 . . . . 0.0 111.289 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -55.5 -49.38 72.71 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.005 0.821 . . . . 0.0 112.225 -178.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.438 HG23 HD22 ' B' ' 115' ' ' LEU . 80.9 mt -66.12 -48.84 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -55.13 -47.21 75.36 Favored 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.06 0.944 . . . . 0.0 111.0 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -59.03 -50.14 75.2 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.047 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.8 p -53.81 -51.44 63.5 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.937 1.244 . . . . 0.0 112.936 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -62.57 -49.74 74.06 Favored 'General case' 0 C--N 1.345 0.41 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.47 -43.31 94.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.638 -178.22 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.87 -36.71 85.22 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.634 -0.666 . . . . 0.0 109.778 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -60.26 -44.39 95.34 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -78.69 -17.33 56.08 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.987 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -81.46 -24.13 37.0 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.003 1.274 . . . . 0.0 109.735 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.8 tp . . . . . 0 CA--C 1.534 0.339 0 C-N-CA 124.14 0.976 . . . . 0.0 109.006 -179.963 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 120.302 0.096 . . . . 0.0 111.098 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.3 m -57.08 -51.13 70.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.234 1.414 . . . . 0.0 109.905 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 66.8 mt -59.1 -45.19 92.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 124.99 1.316 . . . . 0.0 108.92 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -60.23 -45.46 93.14 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.4 m -61.26 -48.19 82.58 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.109 0.963 . . . . 0.0 108.525 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.4 -50.42 71.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.784 0.833 . . . . 0.0 109.179 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttt-85 -56.09 -47.04 78.8 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 119.221 -0.419 . . . . 0.0 110.985 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -56.93 15.03 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.429 1.092 . . . . 0.0 110.423 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.76 -35.86 66.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.357 1.063 . . . . 0.0 111.352 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -69.51 -48.74 59.52 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -60.26 -38.8 84.65 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.59 1.156 . . . . 0.0 111.183 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 C-N-CA 124.037 0.935 . . . . 0.0 110.715 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 51.7 m . . . . . 0 N--CA 1.447 -0.614 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 99' ' ' TYR . . . . . 0.43 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 37.7 m-85 -120.68 130.58 54.15 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 121.675 0.75 . . . . 0.0 109.445 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -112.26 159.12 18.93 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 127.529 2.332 . . . . 0.0 109.846 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.445 ' HB3' ' HE2' ' D' 1116 ' ' LYS . 28.5 mt -150.65 142.27 23.59 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 179.082 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -147.69 106.92 3.87 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.117 1.767 . . . . 0.0 112.068 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.433 ' CG2' ' HE3' ' D' 1116 ' ' LYS . 53.2 t -155.22 149.75 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 120.39 1.45 . . . . 0.0 110.425 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.1 102.42 14.95 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 102.575 -3.12 . . . . 0.0 102.575 176.234 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.65 109.78 0.56 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 115.671 -2.738 . . . . 0.0 106.44 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -68.32 -56.98 6.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 121.873 2.837 . . . . 0.0 112.002 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -64.31 -46.55 83.06 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.29 -51.19 60.0 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 125.062 1.345 . . . . 0.0 110.781 -178.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 109' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' D' 1099 ' ' TYR . 57.4 t80 -65.78 -45.74 81.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 119.753 1.161 . . . . 0.0 112.497 -178.538 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -55.55 -53.65 53.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.964 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.0 -57.17 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 124.902 1.281 . . . . 0.0 109.452 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 49.6 mt -57.08 -27.99 62.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.823 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.5 mmm -72.39 -52.16 17.25 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.35 -45.44 69.13 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.438 HD22 HG23 ' A' ' 22' ' ' ILE . 42.6 mt -67.03 -31.47 72.02 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -68.01 -56.55 8.51 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -52.89 -57.0 11.72 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 128.64 2.776 . . . . 0.0 110.319 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 11.6 t -54.47 -52.12 62.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.083 1.353 . . . . 0.0 111.6 -179.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.441 ' HB3' HD21 ' D' 1108 ' ' ASN . 4.3 mm? -66.99 -30.75 70.95 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.485 1.039 . . . . 0.0 111.161 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -65.8 -45.43 82.41 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 120.998 1.726 . . . . 0.0 108.347 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 30.1 mt -63.14 -49.86 72.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.13 0.972 . . . . 0.0 109.582 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 ttt -56.86 -35.49 68.95 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.654 0.782 . . . . 0.0 110.605 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -72.43 -33.03 66.8 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.383 1.073 . . . . 0.0 112.458 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.1 pp -93.15 -31.37 14.81 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 66.3 t -84.32 145.68 46.03 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 125.476 1.51 . . . . 0.0 108.392 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.74 -176.7 1.01 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.549 2.833 . . . . 0.0 111.959 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.78 34.76 0.21 Allowed Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.1 -44.87 21.85 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 122.857 2.056 . . . . 0.0 112.766 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.5 -26.17 67.04 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 13.9 t -72.23 -47.76 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -59.24 -51.7 68.84 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.785 1.234 . . . . 0.0 111.319 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 19.4 m -62.08 -49.15 77.09 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 122.358 -0.214 . . . . 0.0 110.822 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -63.09 -38.37 90.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.306 -0.246 . . . . 0.0 110.996 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -44.69 87.57 Favored 'General case' 0 C--N 1.337 0.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -66.18 -44.44 83.98 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.244 0.618 . . . . 0.0 109.996 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -59.66 -55.29 36.29 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.172 0.989 . . . . 0.0 111.233 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -37.49 84.8 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.279 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -58.21 -34.84 70.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.719 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.86 -25.33 68.23 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 120.314 1.415 . . . . 0.0 111.457 178.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp . . . . . 0 N--CA 1.464 0.265 0 CA-C-N 119.461 1.028 . . . . 0.0 112.911 -179.903 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.73 109.32 0.9 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.14 151.36 34.5 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 105.709 -1.96 . . . . 0.0 105.709 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -117.83 101.28 8.18 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.36 0.982 . . . . 0.0 109.461 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 10.3 tp -75.52 112.04 17.22 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 117.154 -1.403 . . . . 0.0 109.845 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -88.84 117.46 0.88 Allowed 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 124.46 3.44 . . . . 0.0 111.514 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.8 t -145.75 149.24 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.129 0.877 . . . . 0.0 112.981 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -133.64 100.41 4.78 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 175.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.57 104.19 0.22 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 105.633 -2.987 . . . . 0.0 105.633 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 24.2 tpt180 -57.27 -51.43 69.41 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 121.122 2.461 . . . . 0.0 111.8 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.7 -41.5 87.92 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 118.593 0.633 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -62.53 -35.98 81.14 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.131 0.972 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 35.0 t80 -69.45 -50.45 45.47 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.825 -1.172 . . . . 0.0 109.298 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -56.33 -54.51 44.65 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.502 1.121 . . . . 0.0 110.297 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 45.9 mtp -63.45 -38.05 89.64 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.506 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.88 -46.15 86.18 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.106 1.321 . . . . 0.0 110.021 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.33 -48.21 76.42 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 123.924 0.89 . . . . 0.0 111.431 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -55.65 -49.09 73.82 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.612 0.765 . . . . 0.0 110.783 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 95.6 mt -66.54 -49.62 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -53.38 -44.43 68.61 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 124.132 0.973 . . . . 0.0 111.164 -179.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -62.65 -48.67 78.32 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.42 -179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 86.4 p -53.64 -46.85 70.66 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.822 1.192 . . . . 0.0 112.781 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.93 -58.08 5.14 Favored 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 123.331 0.652 . . . . 0.0 112.552 -179.116 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.94 -52.47 62.89 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.372 1.069 . . . . 0.0 111.398 -178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.9 -43.33 94.88 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.496 -0.752 . . . . 0.0 111.757 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 17.0 tmm? -62.95 -43.76 97.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 118.72 0.691 . . . . 0.0 110.956 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -67.51 -23.45 65.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.684 0.675 . . . . 0.0 111.02 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.93 -23.01 39.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.282 0.633 . . . . 0.0 110.407 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 24.5 tp . . . . . 0 CA--C 1.537 0.453 0 C-N-CA 124.687 1.195 . . . . 0.0 110.609 179.899 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 14.9 m-70 . . . . . 0 CA--C 1.534 0.344 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 57.0 m -61.63 -50.62 71.81 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 72.1 mt -59.79 -47.12 92.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 126.341 1.856 . . . . 0.0 108.726 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -54.51 -48.22 72.17 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.779 1.632 . . . . 0.0 111.033 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.0 m -66.3 -46.13 78.02 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.122 0.969 . . . . 0.0 108.87 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -42.72 81.11 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 124.011 0.925 . . . . 0.0 110.192 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -58.54 -46.76 86.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.51 -41.81 96.2 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.643 -1.17 . . . . 0.0 111.0 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.34 -49.46 72.16 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.951 1.25 . . . . 0.0 109.111 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -60.33 -47.25 86.82 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.072 0.949 . . . . 0.0 110.28 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -64.65 -29.73 70.73 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.73 0.812 . . . . 0.0 111.977 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.336 0 C-N-CA 124.685 1.194 . . . . 0.0 110.764 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 29.0 m . . . . . 0 C--O 1.235 0.32 0 CA-C-O 121.448 0.642 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' D' D 1099 ' ' TYR . . . . . 0.426 ' HB3' ' CD2' ' B' ' 109' ' ' PHE . 43.8 m-85 -107.16 134.8 49.73 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.59 144.67 47.99 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 128.206 2.602 . . . . 0.0 112.437 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 62.2 mt -147.57 155.16 41.55 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.353 1.461 . . . . 0.0 110.145 178.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -152.16 108.84 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.565 1.546 . . . . 0.0 111.927 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 95.0 t -153.19 150.15 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-N 120.344 1.429 . . . . 0.0 109.757 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.54 102.92 12.82 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.2 113.68 0.79 Allowed Glycine 0 N--CA 1.454 -0.141 0 N-CA-C 106.65 -2.58 . . . . 0.0 106.65 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -64.92 -57.03 9.86 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 121.265 2.533 . . . . 0.0 110.538 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 19.8 mttp -63.18 -42.5 99.37 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.965 0.802 . . . . 0.0 108.98 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1108 ' ' ASN . . . . . 0.441 HD21 ' HB3' ' B' ' 119' ' ' LEU . 88.7 m-20 -60.03 -40.75 90.42 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.296 -178.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1109 ' ' PHE . . . . . 0.43 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 28.8 t80 -65.25 -43.7 90.51 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 120.372 1.442 . . . . 0.0 109.23 178.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -58.37 -53.75 54.82 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.113 0.87 . . . . 0.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.75 -57.91 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.197 1.399 . . . . 0.0 110.132 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 66.8 mt -59.47 -35.85 74.87 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 117.15 -1.405 . . . . 0.0 111.309 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -49.46 74.42 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 120.557 1.526 . . . . 0.0 108.602 178.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 51.8 mttm -53.57 -50.94 64.47 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.29 -33.01 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1116 ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' B' ' 101' ' ' LEU . 27.8 tptt -64.79 -57.96 7.52 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -52.28 -49.39 64.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.487 1.915 . . . . 0.0 108.319 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 28.7 t -52.96 -55.02 26.54 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.238 1.815 . . . . 0.0 114.281 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.56 -36.47 82.73 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.473 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -68.81 -38.1 79.68 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.738 1.154 . . . . 0.0 110.222 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 46.7 mt -65.33 -44.93 86.24 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.923 -0.486 . . . . 0.0 109.882 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttt -61.86 -38.32 87.8 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.244 1.018 . . . . 0.0 110.693 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.47 -44.08 79.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.749 -0.594 . . . . 0.0 110.643 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.3 pp -75.65 -31.78 59.95 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.42 147.37 34.28 Favored Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 120.105 1.32 . . . . 0.0 110.064 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -73.2 177.48 7.78 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.057 1.838 . . . . 0.0 108.95 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.61 47.12 0.28 Allowed Pre-proline 0 CA--C 1.556 1.178 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -178.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.45 -48.03 0.64 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.091 1.861 . . . . 0.0 112.981 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.92 -25.89 68.35 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 17.2 t -72.12 -48.15 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 126.22 1.808 . . . . 0.0 108.755 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.67 -41.41 81.48 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.505 0.722 . . . . 0.0 110.145 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 50.8 m -70.84 -50.23 37.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.352 1.061 . . . . 0.0 110.877 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.53 -35.59 78.16 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.323 0.965 . . . . 0.0 110.368 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.61 -47.16 86.68 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -60.84 -48.12 83.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.499 1.045 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -56.57 -57.86 10.56 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.312 1.045 . . . . 0.0 111.448 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -34.86 78.95 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.859 -0.526 . . . . 0.0 111.976 -178.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.87 -27.53 68.29 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.42 -38.75 85.05 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.714 0 C-N-CA 126.581 1.952 . . . . 0.0 112.338 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 121.917 0.865 . . . . 0.0 111.574 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 13.0 tp -73.16 94.7 1.98 Allowed 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mt -93.32 161.24 14.48 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.029 0.931 . . . . 0.0 110.761 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -134.16 118.61 17.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.627 1.571 . . . . 0.0 108.756 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 43.6 tp -108.96 100.2 38.87 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 123.796 0.838 . . . . 0.0 110.532 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.74 125.42 7.45 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.202 2.601 . . . . 0.0 111.16 178.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.2 t -145.15 146.18 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.788 1.635 . . . . 0.0 107.919 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -126.01 100.19 6.25 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.4 126.14 1.37 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -66.99 -52.68 39.75 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 120.781 2.291 . . . . 0.0 109.712 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.95 -33.72 75.2 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 122.4 0.28 . . . . 0.0 110.751 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -45.87 92.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -67.03 -40.05 87.11 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.089 0.404 . . . . 0.0 111.435 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -60.48 -57.36 13.07 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.588 0.755 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.4 ppp? -62.87 -38.94 92.88 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.822 -0.608 . . . . 0.0 110.591 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.38 -50.6 72.24 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mt -59.51 -47.31 86.03 Favored 'General case' 0 C--O 1.23 0.066 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.298 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -62.59 -47.37 84.11 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.489 1.04 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.5 mt -65.03 -41.03 90.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 123.707 0.803 . . . . 0.0 110.371 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -62.47 -60.07 4.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.569 1.148 . . . . 0.0 108.726 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.19 -47.14 84.35 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.192 0.932 . . . . 0.0 110.557 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.7 t -52.46 -51.61 58.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.287 0.949 . . . . 0.0 112.631 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.46 -47.67 69.44 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.462 0.574 . . . . 0.0 109.484 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -55.25 -49.44 72.03 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 118.203 0.456 . . . . 0.0 111.665 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.26 -46.23 67.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 117.541 -1.219 . . . . 0.0 110.112 -178.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -36.02 72.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 120.134 1.334 . . . . 0.0 110.596 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -69.64 -35.59 75.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.104 1.362 . . . . 0.0 110.678 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -83.72 -36.86 23.36 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.673 0.789 . . . . 0.0 113.016 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 CA--C 1.536 0.406 0 CA-C-N 119.228 0.922 . . . . 0.0 108.55 179.549 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 83.0 t60 . . . . . 0 CA--C 1.535 0.38 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.9 m -59.84 -38.24 81.51 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.751 0.705 . . . . 0.0 110.963 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.58 -42.45 96.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.95 0.9 . . . . 0.0 109.16 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -62.82 -50.08 72.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.557 0.743 . . . . 0.0 109.132 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.46 -37.52 83.87 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.265 0.555 . . . . 0.0 110.191 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -66.73 -54.08 26.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.318 1.047 . . . . 0.0 111.362 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -63.94 -33.23 75.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.845 1.202 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -61.32 -57.99 10.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.678 -1.231 . . . . 0.0 107.678 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -65.17 -30.71 71.64 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.205 0.911 . . . . 0.0 113.206 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -58.17 -46.72 85.24 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -76.11 -51.34 12.43 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 111.593 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 . . . . . 0 C--O 1.222 -0.376 0 CA-C-O 116.698 -1.62 . . . . 0.0 113.649 -177.922 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.445 0 CA-C-O 121.051 0.453 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -122.65 148.75 44.91 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.094 0.957 . . . . 0.0 109.425 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -134.3 160.18 38.69 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 124.603 1.161 . . . . 0.0 109.292 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 79.1 mt -144.3 161.19 39.57 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -150.57 110.11 4.02 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.287 1.835 . . . . 0.0 106.954 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 1.9 m -155.89 151.32 9.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.115 0.966 . . . . 0.0 111.473 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.443 ' HB3' ' HA ' ' D' 1098 ' ' THR . 3.7 ptt180 -117.6 100.62 7.75 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 119.744 1.156 . . . . 0.0 111.682 178.06 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.4 119.65 1.25 Allowed Glycine 0 CA--C 1.521 0.427 0 CA-C-O 116.429 -2.317 . . . . 0.0 109.058 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -61.55 -56.89 15.09 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 121.451 2.626 . . . . 0.0 109.298 178.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -58.59 -47.13 85.33 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.23 0.612 . . . . 0.0 109.652 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -58.89 -44.71 91.22 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 112.525 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -64.13 -44.92 90.72 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 120.645 1.566 . . . . 0.0 110.596 -178.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -56.37 -54.16 48.78 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 122.016 0.912 . . . . 0.0 111.694 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.519 HG21 HD11 ' C' 1022 ' ' ILE . 57.6 mt -69.1 -49.18 64.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -177.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 76.7 mt -61.44 -38.17 86.2 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 119.75 1.159 . . . . 0.0 110.657 -179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 69.4 mtp -61.42 -52.89 62.71 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.316 0.962 . . . . 0.0 110.032 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -63.34 -40.73 98.11 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.379 -178.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.84 -36.45 78.17 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.547 1.067 . . . . 0.0 111.207 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 7.2 tptp -70.66 -47.34 60.45 Favored 'General case' 0 N--CA 1.462 0.152 0 O-C-N 120.343 -1.473 . . . . 0.0 108.484 178.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -58.16 -51.59 69.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.411 1.485 . . . . 0.0 110.233 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.3 m -61.0 -39.94 91.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.509 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -41.96 89.92 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 119.128 0.876 . . . . 0.0 109.122 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.16 -36.72 84.97 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.48 0.582 . . . . 0.0 111.149 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -68.17 -47.97 66.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 33.1 ttp -65.9 -27.97 68.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 118.728 0.695 . . . . 0.0 109.993 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -68.63 -39.57 80.69 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.061 -0.971 . . . . 0.0 109.191 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.9 -24.23 44.3 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.993 1.27 . . . . 0.0 111.55 179.072 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.54 145.05 66.64 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.21 -84.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.841 0 N-CA-C 108.377 -1.432 . . . . 0.0 108.377 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -167.65 63.04 0.63 Allowed Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 125.013 1.325 . . . . 0.0 110.14 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -70.93 -106.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 124.049 3.166 . . . . 0.0 112.178 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.41 -25.6 66.06 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 120.906 -1.122 . . . . 0.0 109.168 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 t -54.98 -45.15 76.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.509 1.124 . . . . 0.0 108.559 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -74.9 -44.17 50.3 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.861 0.865 . . . . 0.0 110.998 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 22.9 t -61.96 -51.55 67.63 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.288 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.6 -39.5 93.83 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.072 0.949 . . . . 0.0 110.488 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -55.83 -46.98 77.99 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-N 118.999 0.818 . . . . 0.0 109.152 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -65.36 -51.89 57.44 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.89 -47.69 70.84 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.148 0.979 . . . . 0.0 112.996 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.98 -34.5 75.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.576 1.08 . . . . 0.0 109.053 179.333 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -28.05 69.2 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.039 -1.038 . . . . 0.0 109.536 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 58.9 mt -63.45 -15.65 58.34 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.087 0.858 . . . . 0.0 112.235 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.8 tt . . . . . 0 CA--C 1.536 0.428 0 C-N-CA 124.917 1.287 . . . . 0.0 110.302 178.822 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 7.3 tp10 . . . . . 0 N--CA 1.441 -0.923 0 CA-C-O 121.969 0.89 . . . . 0.0 112.673 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.5 tp -72.86 95.91 2.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.881 1.672 . . . . 0.0 106.787 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 46.3 mt -100.31 168.81 9.54 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -140.23 147.23 39.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.878 1.271 . . . . 0.0 108.743 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 33.3 tp -124.02 94.5 45.48 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.037 1.335 . . . . 0.0 108.02 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.56 121.48 5.59 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.764 2.309 . . . . 0.0 109.505 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.9 t -144.94 159.92 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.298 1.039 . . . . 0.0 109.674 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 12.7 ptt-85 -136.52 102.9 5.08 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.988 1.267 . . . . 0.0 109.186 176.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.97 139.01 5.5 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 117.613 -1.66 . . . . 0.0 110.274 178.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -71.03 -52.09 21.55 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.618 2.209 . . . . 0.0 106.901 177.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.3 -46.5 67.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.669 1.188 . . . . 0.0 107.817 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -56.41 -44.93 80.83 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.217 0.462 . . . . 0.0 111.308 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.2 t80 -65.29 -51.57 59.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.765 0.712 . . . . 0.0 111.0 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -54.97 -57.11 12.99 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.477 1.111 . . . . 0.0 111.414 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ppp? -61.02 -46.78 89.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.513 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 33.9 mt -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 117.747 -1.121 . . . . 0.0 110.427 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.63 -53.14 61.11 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 120.048 1.295 . . . . 0.0 110.632 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -55.58 -48.62 74.52 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1022 ' ' ILE . . . . . 0.519 HD11 HG21 ' B' ' 111' ' ' ILE . 84.5 mt -67.69 -43.07 86.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 122.996 0.518 . . . . 0.0 112.264 -178.309 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -66.57 -48.92 68.08 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 118.159 -0.924 . . . . 0.0 109.817 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.83 -44.86 91.96 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.238 -0.887 . . . . 0.0 108.611 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 16.2 t -56.97 -38.09 72.52 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.661 1.119 . . . . 0.0 111.737 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.5 tm? -71.09 -57.75 4.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.195 0.598 . . . . 0.0 110.743 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -56.35 -48.04 77.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.875 0.47 . . . . 0.0 110.119 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.14 -47.04 86.75 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 118.279 -0.867 . . . . 0.0 109.523 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.3 68.66 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.372 0.987 . . . . 0.0 110.907 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -71.58 -34.59 70.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.663 0.785 . . . . 0.0 111.734 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -77.84 -27.51 49.91 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.887 1.221 . . . . 0.0 110.637 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 CA--C 1.537 0.454 0 C-N-CA 123.946 0.898 . . . . 0.0 109.357 178.95 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.5 t-160 . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 23.8 m -65.49 -34.1 77.47 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.981 -1.074 . . . . 0.0 111.123 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.91 -44.94 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.268 1.427 . . . . 0.0 109.921 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.77 -56.75 13.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.584 1.153 . . . . 0.0 108.759 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 83.0 m -59.24 -36.43 75.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.339 -0.838 . . . . 0.0 110.67 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 32.0 t80 -61.09 -53.89 51.46 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.293 0.951 . . . . 0.0 109.158 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -41.67 94.47 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.975 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.58 -46.58 89.69 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.061 0.846 . . . . 0.0 110.708 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -66.41 -40.23 89.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.957 0.799 . . . . 0.0 110.625 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -57.74 -52.62 64.72 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.701 1.2 . . . . 0.0 108.822 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -64.15 -43.86 93.92 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.069 0.948 . . . . 0.0 111.017 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 . . . . . 0 C--N 1.339 0.121 0 CA-C-O 117.078 -1.439 . . . . 0.0 113.108 -179.125 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' D' D 1098 ' ' THR . . . . . 0.443 ' HA ' ' HB3' ' B' ' 104' ' ' ARG . 40.6 m . . . . . 0 C--O 1.233 0.199 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -115.69 158.27 23.03 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -138.13 161.26 37.26 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.973 0.909 . . . . 0.0 108.961 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 69.3 mt -139.08 153.36 48.03 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -146.94 99.49 3.19 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 127.861 2.465 . . . . 0.0 105.798 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.49 151.09 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 124.467 1.107 . . . . 0.0 111.146 -178.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.49 102.06 8.01 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 122.212 1.006 . . . . 0.0 110.266 178.044 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.63 110.02 0.57 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.848 -2.501 . . . . 0.0 106.848 178.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 -55.53 -57.46 11.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 121.358 2.579 . . . . 0.0 112.43 -179.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 98.7 mttt -66.37 -39.51 89.16 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.001 -0.437 . . . . 0.0 110.026 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -56.5 -50.71 71.0 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.976 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.08 -43.88 97.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.15 0.886 . . . . 0.0 111.464 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.33 -51.62 69.01 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.551 0.614 . . . . 0.0 110.823 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 83.9 mt -66.9 -54.53 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.58 1.152 . . . . 0.0 110.742 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.34 -32.66 68.73 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.189 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 31.4 mtp -66.3 -52.08 50.92 Favored 'General case' 0 C--N 1.345 0.383 0 CA-C-N 119.764 1.166 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -60.69 -41.56 95.4 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 119.303 -0.959 . . . . 0.0 110.712 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.07 -60.79 2.64 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.659 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 15.7 tptp -53.88 -45.11 70.94 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.298 0.954 . . . . 0.0 112.724 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.05 -49.75 74.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.661 0.6 . . . . 0.0 109.481 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.9 m -61.71 -34.84 76.5 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.85 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -66.07 -42.07 89.91 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.928 1.291 . . . . 0.0 108.508 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.32 -44.01 89.19 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.83 -38.02 89.09 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.424 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttp -77.26 -20.05 55.69 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 120.548 1.522 . . . . 0.0 109.957 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -81.89 -26.07 34.45 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.077 -1.014 . . . . 0.0 111.079 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -92.08 -33.55 14.74 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.316 -0.865 . . . . 0.0 110.441 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 80.5 t -85.32 147.14 46.47 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.93 -88.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.018 3.145 . . . . 0.0 114.818 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -170.64 58.64 0.29 Allowed Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.341 1.456 . . . . 0.0 110.864 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.3 -90.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.421 2.747 . . . . 0.0 113.39 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.6 -25.1 67.24 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.7 t -54.61 -56.4 10.54 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.675 1.19 . . . . 0.0 108.937 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 13.2 t0 -69.4 -44.64 71.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.683 0.674 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 7.6 t -55.82 -50.44 70.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.118 0.567 . . . . 0.0 111.621 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 17.9 t80 -69.08 -43.75 73.92 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -45.58 69.51 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 119.411 1.005 . . . . 0.0 110.56 179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -64.76 -53.12 52.15 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 119.623 1.101 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.5 -40.89 75.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.44 1.496 . . . . 0.0 111.39 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.04 -32.29 39.5 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.341 1.856 . . . . 0.0 110.251 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -57.08 -39.25 74.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 58.0 mt -53.62 -21.44 6.74 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.565 0 C-N-CA 124.489 1.116 . . . . 0.0 111.99 179.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 . . . . . 0 C--O 1.233 0.225 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.94 127.29 32.12 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 43.0 mt -120.47 173.91 6.87 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.297 1.439 . . . . 0.0 109.634 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -139.84 149.82 43.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -116.12 96.55 47.57 Favored Pre-proline 0 CA--C 1.536 0.439 0 C-N-CA 124.772 1.229 . . . . 0.0 108.653 -179.437 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.71 110.97 1.69 Allowed 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.3 3.333 . . . . 0.0 112.9 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.9 t -144.84 158.77 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.849 1.204 . . . . 0.0 110.46 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 50.0 ttt-85 -135.05 103.44 5.56 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.062 1.345 . . . . 0.0 108.651 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.22 132.6 2.65 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 108.181 -1.968 . . . . 0.0 108.181 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt85 -70.63 -51.35 28.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 121.132 2.466 . . . . 0.0 109.885 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.09 -36.3 77.43 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 m -63.29 -52.22 62.86 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.218 -0.896 . . . . 0.0 109.787 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -58.17 -47.79 82.3 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 119.719 1.145 . . . . 0.0 110.337 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -54.15 -57.19 12.07 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.803 0.69 . . . . 0.0 112.319 -179.124 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -66.95 -43.8 82.22 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.076 0.55 . . . . 0.0 111.929 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.2 tp -55.83 -49.21 73.89 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.785 0.834 . . . . 0.0 110.016 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 tt -70.48 -47.87 58.5 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.032 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -55.35 -44.84 76.33 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.887 1.221 . . . . 0.0 113.657 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -75.4 -32.17 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -68.29 -41.88 80.32 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.462 -1.399 . . . . 0.0 109.252 178.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.34 -55.5 17.88 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 125.653 1.581 . . . . 0.0 110.791 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 p -54.16 -43.41 70.59 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.626 0.648 . . . . 0.0 110.594 179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.01 -56.49 8.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.808 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -53.71 -43.39 68.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.406 1.003 . . . . 0.0 111.743 -178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.9 -53.68 19.79 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.165 -0.922 . . . . 0.0 108.842 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -54.93 -49.08 72.19 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.122 1.328 . . . . 0.0 110.835 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -64.03 -27.18 68.94 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.047 0.84 . . . . 0.0 110.995 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -77.39 -49.26 15.26 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.516 1.053 . . . . 0.0 110.687 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.494 HD22 HD22 ' B' ' 129' ' ' LEU . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.537 0 C-N-CA 125.084 1.353 . . . . 0.0 113.027 -179.02 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 t60 . . . . . 0 CA--C 1.534 0.36 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.74 -49.12 78.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.331 1.452 . . . . 0.0 111.813 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.6 mm -60.68 -43.51 95.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 124.924 1.289 . . . . 0.0 109.699 -178.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.62 -53.16 61.44 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 125.524 1.53 . . . . 0.0 108.407 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.6 m -63.3 -34.67 78.2 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.085 -0.96 . . . . 0.0 110.96 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -61.53 -49.16 77.81 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 120.618 1.554 . . . . 0.0 107.942 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.61 -45.86 92.28 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.238 1.015 . . . . 0.0 109.093 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -60.34 -44.8 95.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.543 1.537 . . . . 0.0 111.93 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.24 -45.89 91.29 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.076 1.351 . . . . 0.0 110.528 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -60.05 -50.95 71.7 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.05 -0.66 . . . . 0.0 110.635 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.52 -35.27 80.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 118.505 -0.759 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 . . . . . 0 C--O 1.225 -0.221 0 CA-C-N 119.293 0.951 . . . . 0.0 111.022 179.759 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.239 0.521 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -113.16 131.08 55.99 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -107.22 159.74 16.12 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.016 0.926 . . . . 0.0 112.574 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 mp -143.65 156.17 44.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 126.004 1.722 . . . . 0.0 106.97 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 100.85 2.86 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.452 1.901 . . . . 0.0 106.574 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.584 HG21 ' HD2' ' D' 1116 ' ' LYS . 3.6 m -149.22 151.55 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -178.106 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt85 -118.52 101.7 8.34 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 122.68 1.228 . . . . 0.0 109.066 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.13 106.59 0.42 Allowed Glycine 0 N--CA 1.451 -0.366 1 N-CA-C 102.924 -4.07 . . . . 0.0 102.924 176.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -60.26 -56.69 18.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.099 2.949 . . . . 0.0 111.353 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -62.93 -39.9 95.98 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -61.99 -52.38 64.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.019 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.5 -51.39 59.73 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 120.206 1.366 . . . . 0.0 111.819 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -58.36 -53.49 57.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.671 0.668 . . . . 0.0 111.03 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.2 mt -61.3 -54.11 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 O-C-N 121.438 -0.789 . . . . 0.0 110.731 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 82.8 mt -54.97 -41.7 71.49 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.384 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 14.2 mtp -57.2 -51.26 70.05 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 120.928 1.695 . . . . 0.0 108.848 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.33 -52.33 66.1 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 122.611 0.365 . . . . 0.0 110.291 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 43.2 mt -58.6 -42.89 89.17 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 122.775 0.43 . . . . 0.0 111.12 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 116' ' ' LYS . . . . . 0.538 ' HD2' HG11 ' D' 1103 ' ' VAL . 25.5 ttpt -62.5 -57.43 11.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.6 1.16 . . . . 0.0 110.889 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -60.45 -41.17 93.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 118.649 0.658 . . . . 0.0 110.016 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 2.9 t -61.02 -42.24 98.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.986 -0.446 . . . . 0.0 109.874 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.26 -35.92 71.57 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 117.351 -1.309 . . . . 0.0 109.92 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -63.52 -40.01 95.91 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.252 1.387 . . . . 0.0 108.931 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 36.3 mt -66.89 -53.35 33.07 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 5.7 tpt -56.89 -34.66 68.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.041 0.936 . . . . 0.0 110.355 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.43 -41.73 84.32 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.485 1.514 . . . . 0.0 110.857 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.45 -33.03 64.68 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.529 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 20.3 m -86.79 148.7 46.52 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-N 119.521 1.055 . . . . 0.0 111.831 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -75.94 -106.1 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.05 2.5 . . . . 0.0 106.875 178.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.73 74.44 7.12 Favored Pre-proline 0 CA--C 1.542 0.638 0 O-C-N 119.71 -1.869 . . . . 0.0 111.431 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -81.12 -100.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 124.725 3.617 . . . . 0.0 111.539 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 129' ' ' LEU . . . . . 0.494 HD22 HD22 ' A' ' 32' ' ' LEU . 9.7 tt -56.11 -34.71 66.3 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 120.724 -1.235 . . . . 0.0 109.499 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 73.5 t -51.83 -54.44 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 126.114 1.765 . . . . 0.0 109.698 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.09 -49.52 77.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.036 0.934 . . . . 0.0 110.007 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 25.9 t -56.03 -50.54 70.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.363 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -67.01 -35.01 78.97 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.541 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -58.08 -48.53 79.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.643 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.75 -42.6 70.27 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.078 0.854 . . . . 0.0 111.763 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -57.17 -45.42 83.69 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 118.64 0.655 . . . . 0.0 111.233 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -77.32 -31.72 54.8 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.092 0.957 . . . . 0.0 110.773 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -57.72 -37.78 74.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 119.792 1.178 . . . . 0.0 109.188 178.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.8 -18.21 53.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.737 0.815 . . . . 0.0 112.237 179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 19.9 tp . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 124.461 1.104 . . . . 0.0 111.141 179.074 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 26.9 tp -78.22 108.29 11.43 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.99 165.04 11.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.288 0.949 . . . . 0.0 111.456 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -142.58 156.67 45.12 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.455 1.502 . . . . 0.0 108.17 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -135.0 105.79 10.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.393 -179.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -79.58 116.5 3.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.437 2.758 . . . . 0.0 110.941 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.8 t -145.03 147.13 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.593 1.088 . . . . 0.0 111.039 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -133.97 101.61 5.12 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.5 126.97 1.49 Allowed Glycine 0 CA--C 1.519 0.315 0 N-CA-C 105.447 -3.061 . . . . 0.0 105.447 177.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -65.68 -51.57 58.4 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 121.54 2.67 . . . . 0.0 108.791 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.22 -42.82 83.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.338 0.655 . . . . 0.0 109.758 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 8.0 m -55.78 -47.71 76.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.213 1.405 . . . . 0.0 108.785 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.0 t80 -69.32 -50.48 46.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.515 1.126 . . . . 0.0 111.068 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.68 -51.0 66.88 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.952 1.301 . . . . 0.0 112.761 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.4 ttm -65.6 -51.3 60.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.804 0.442 . . . . 0.0 110.147 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -41.54 95.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.253 -178.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.79 -38.25 79.84 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.502 1.501 . . . . 0.0 108.85 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -59.38 -42.14 90.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.164 0.893 . . . . 0.0 108.735 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1022 ' ' ILE . . . . . 0.478 HG23 HD22 ' D' 1115 ' ' LEU . 94.1 mt -72.66 -38.28 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.797 0.839 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -61.45 -54.43 43.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 O-C-N 121.071 -1.018 . . . . 0.0 109.492 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -53.08 60.86 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.132 1.373 . . . . 0.0 111.058 -178.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 35.7 p -55.24 -51.56 66.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.99 -41.58 82.06 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 118.774 -0.632 . . . . 0.0 112.439 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.33 -44.93 95.36 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.59 -48.86 65.62 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.665 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 7.7 tmm? -55.36 -44.64 76.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.587 0.63 . . . . 0.0 109.977 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -79.9 -19.9 47.1 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 118.122 -0.942 . . . . 0.0 113.43 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 72.1 t80 -86.3 -27.73 24.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.437 1.017 . . . . 0.0 110.169 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 25.3 tp . . . . . 0 CA--C 1.541 0.614 0 C-N-CA 125.548 1.539 . . . . 0.0 110.177 179.541 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 71.2 t60 . . . . . 0 C--O 1.224 -0.242 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -45.19 83.73 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.113 -0.992 . . . . 0.0 111.686 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 9.4 mm -64.13 -34.45 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 124.908 1.283 . . . . 0.0 110.037 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -69.77 -56.69 6.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 14.0 m -54.01 -40.87 67.38 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.571 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 3.7 t80 -60.25 -54.41 46.11 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.69 1.586 . . . . 0.0 109.819 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -34.72 78.03 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.518 0.727 . . . . 0.0 111.908 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -72.29 -46.64 54.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.811 1.244 . . . . 0.0 109.841 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -60.01 -42.12 93.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.336 1.054 . . . . 0.0 110.937 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -67.31 -47.59 70.12 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.136 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -57.74 -40.83 80.6 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.124 0.57 . . . . 0.0 110.493 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 . . . . . 0 C--O 1.225 -0.185 0 C-N-CA 124.036 0.934 . . . . 0.0 111.623 179.568 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.38 0 CA-C-O 120.785 0.326 . . . . 0.0 110.914 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -101.58 128.45 47.83 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.903 -2.629 . . . . 0.0 103.903 178.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -103.59 145.04 30.63 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.984 1.314 . . . . 0.0 108.874 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.6 mp -140.1 151.39 45.31 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -139.95 111.1 6.99 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.712 1.605 . . . . 0.0 108.861 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1103 ' ' VAL . . . . . 0.538 HG11 ' HD2' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -155.82 150.86 10.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 124.485 1.114 . . . . 0.0 111.805 179.394 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -124.53 99.73 6.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 122.093 0.949 . . . . 0.0 108.501 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.43 119.76 1.4 Allowed Glycine 0 CA--C 1.509 -0.318 0 N-CA-C 105.932 -2.867 . . . . 0.0 105.932 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -63.52 -56.91 12.29 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 121.533 2.666 . . . . 0.0 108.426 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -69.36 -38.29 78.0 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.155 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.63 -52.57 65.1 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.709 -178.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.39 -41.86 98.97 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.149 -0.969 . . . . 0.0 111.832 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -60.66 -53.94 51.33 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.507 0.723 . . . . 0.0 111.555 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 55.1 mt -70.32 -45.92 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 118.459 -0.782 . . . . 0.0 109.679 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.66 -44.71 81.62 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 119.576 1.08 . . . . 0.0 110.363 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 27.1 mtp -60.53 -45.98 91.83 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.008 1.276 . . . . 0.0 109.736 178.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -56.63 -49.63 74.41 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1115 ' ' LEU . . . . . 0.478 HD22 HG23 ' C' 1022 ' ' ILE . 34.1 mt -60.17 -48.46 81.63 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.58 0.752 . . . . 0.0 111.243 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D 1116 ' ' LYS . . . . . 0.584 ' HD2' HG21 ' B' ' 103' ' ' VAL . 24.3 ttpt -54.62 -59.62 4.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 110.653 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.54 -47.97 75.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.008 0.923 . . . . 0.0 110.07 -179.296 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 34.4 t -53.35 -53.22 54.21 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.005 0.922 . . . . 0.0 111.119 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.82 -30.94 66.02 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 117.614 -1.184 . . . . 0.0 111.89 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -62.41 -41.65 98.84 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.969 1.713 . . . . 0.0 108.384 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 35.8 mt -67.95 -47.04 69.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.6 tpt -57.01 -35.84 69.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.377 0.671 . . . . 0.0 111.639 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.23 -43.08 74.77 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.872 1.669 . . . . 0.0 110.438 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.33 -25.32 60.58 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 33.5 m -92.65 148.85 36.97 Favored Pre-proline 0 CA--C 1.537 0.474 0 CA-C-N 119.226 0.921 . . . . 0.0 108.992 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -74.13 -105.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.059 2.506 . . . . 0.0 108.041 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -151.07 66.04 7.05 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 120.239 -1.538 . . . . 0.0 106.946 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.22 -103.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.427 2.751 . . . . 0.0 113.064 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.3 tt -62.52 -25.73 68.18 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.96 -1.088 . . . . 0.0 109.438 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 45.8 t -53.86 -56.96 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 C-N-CA 125.69 1.596 . . . . 0.0 109.192 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.22 -39.12 86.23 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.08 0.237 . . . . 0.0 111.08 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 1.9 t -60.12 -50.9 71.87 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.609 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.23 -33.09 74.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.097 0.959 . . . . 0.0 109.345 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -48.5 80.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 117.089 -1.434 . . . . 0.0 110.009 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -72.13 -46.42 56.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 120.052 1.296 . . . . 0.0 110.918 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -46.54 64.72 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.497 0.719 . . . . 0.0 110.324 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . 0.295 1.7 tp60 -81.08 -26.03 36.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -59.46 -36.2 75.51 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 120.403 1.456 . . . . 0.0 107.183 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 31.0 mt -61.97 -18.08 59.17 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.103 0.961 . . . . 0.0 112.243 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 8.3 tp . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 125.239 1.415 . . . . 0.0 111.635 179.625 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 . . . . . 0 C--O 1.233 0.2 0 N-CA-C 111.233 0.086 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -84.74 121.52 27.8 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 45.2 mt -108.15 161.94 14.52 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -140.5 104.89 4.85 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tp -87.87 110.22 33.42 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.362 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -87.04 123.26 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.424 3.416 . . . . 0.0 112.045 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 t -146.1 154.81 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 O-C-N 120.546 -1.346 . . . . 0.0 107.682 178.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 -135.08 100.67 4.63 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 134.72 3.37 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 106.674 -2.571 . . . . 0.0 106.674 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -69.87 -52.76 22.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 121.397 2.599 . . . . 0.0 110.595 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -66.43 -42.94 86.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.598 0.759 . . . . 0.0 110.004 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 62.8 m -65.32 -34.04 77.39 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.213 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -73.07 -48.35 36.67 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.96 1.709 . . . . 0.0 108.774 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -53.43 -56.08 19.78 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 123.936 0.894 . . . . 0.0 110.553 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 20.9 ptm -60.85 -42.68 98.28 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.127 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.07 -47.01 81.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 119.989 1.268 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -55.84 19.81 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.538 0.608 . . . . 0.0 110.278 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.68 -47.7 79.27 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 125.614 1.566 . . . . 0.0 112.828 -178.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.42 -36.18 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.333 0.653 . . . . 0.0 109.89 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.7 -48.89 65.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.17 -1.581 . . . . 0.0 108.197 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -55.22 -52.03 64.68 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.426 1.49 . . . . 0.0 110.327 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.2 p -56.72 -41.53 77.63 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.7 0.682 . . . . 0.0 111.572 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.1 -48.72 61.82 Favored 'General case' 0 CA--C 1.521 -0.163 0 O-C-N 121.412 -0.805 . . . . 0.0 111.432 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.39 -53.98 51.08 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 126.762 2.025 . . . . 0.0 111.928 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.53 -38.72 90.47 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 117.303 -1.332 . . . . 0.0 110.184 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 10.8 tmm? -63.44 -45.17 92.13 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.034 1.288 . . . . 0.0 107.792 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.89 -22.41 66.99 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.59 0.632 . . . . 0.0 110.508 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.82 -25.7 22.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.478 -1.389 . . . . 0.0 111.132 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 mt . . . . . 0 C--O 1.236 0.351 0 C-N-CA 126.926 2.09 . . . . 0.0 107.722 -179.24 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.43 -48.46 77.67 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.815 -0.553 . . . . 0.0 111.768 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.2 mm -62.52 -34.43 64.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.732 0.813 . . . . 0.0 111.203 -179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -61.72 -56.73 16.56 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.583 1.553 . . . . 0.0 108.472 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.7 m -61.35 -42.26 98.39 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' B' ' 121' ' ' LEU . 2.4 t80 -56.69 -53.42 57.94 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.438 0.695 . . . . 0.0 111.982 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -65.17 -39.62 93.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 118.762 -0.637 . . . . 0.0 110.821 -178.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.26 -49.26 78.33 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.34 -48.79 79.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.2 1.8 . . . . 0.0 110.559 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.16 -46.06 79.42 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 123.898 0.879 . . . . 0.0 110.148 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 tt0 -69.18 -42.64 75.58 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.021 1.328 . . . . 0.0 111.114 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 . . . . . 0 N--CA 1.465 0.316 0 C-N-CA 125.69 1.596 . . . . 0.0 108.864 179.523 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -109.45 143.79 38.57 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -117.48 161.64 19.25 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.175 1.39 . . . . 0.0 110.23 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' B' ' 101' ' ' LEU . 12.0 tp -161.22 117.32 2.18 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.16 103.17 9.29 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.214 1.406 . . . . 0.0 109.367 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.485 HG11 ' HE2' ' D' 1116 ' ' LYS . 93.4 t -150.03 150.62 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.29 1.036 . . . . 0.0 110.318 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -108.44 102.67 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.806 1.242 . . . . 0.0 108.673 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.5 122.16 1.72 Allowed Glycine 0 N--CA 1.467 0.723 0 CA-C-O 115.802 -2.665 . . . . 0.0 109.067 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -68.03 -59.62 3.12 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 122.504 3.152 . . . . 0.0 113.387 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -73.24 -43.86 60.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -51.39 -51.0 58.52 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.799 1.639 . . . . 0.0 110.471 -178.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -72.11 -39.77 68.63 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.764 1.165 . . . . 0.0 111.411 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.53 -53.48 50.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.871 0.843 . . . . 0.0 109.544 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.488 HG21 HD11 ' C' 1022 ' ' ILE . 12.5 mt -61.6 -48.27 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.752 1.621 . . . . 0.0 109.427 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -57.49 -41.04 79.94 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 117.983 -1.008 . . . . 0.0 111.311 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 20.2 mtp -66.25 -44.73 82.86 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.357 1.435 . . . . 0.0 110.179 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -55.63 -45.98 77.5 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 73.3 mt -72.59 -27.39 62.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.032 1.333 . . . . 0.0 112.84 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 116' ' ' LYS . . . . . 0.417 ' HE2' HG11 ' D' 1103 ' ' VAL . 0.0 OUTLIER -64.13 -60.68 2.92 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.46 1.104 . . . . 0.0 109.032 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -63.09 -38.14 90.01 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 124.403 1.065 . . . . 0.0 108.755 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 41.9 t -52.78 -54.25 36.64 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.922 0.783 . . . . 0.0 112.219 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.15 -33.09 72.88 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.036 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.7 -43.08 97.68 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.02 1.282 . . . . 0.0 109.601 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 121' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 40' ' ' TYR . 80.8 mt -65.26 -50.22 66.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.742 1.217 . . . . 0.0 109.566 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 10.4 tpt -62.77 -29.94 71.08 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.668 0.387 . . . . 0.0 110.936 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -76.13 -41.7 49.21 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.637 0.775 . . . . 0.0 110.714 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 pp -78.12 -33.47 50.53 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -86.74 146.63 41.66 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 119.298 0.954 . . . . 0.0 109.208 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.31 -172.74 0.37 Allowed 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.2 2.6 . . . . 0.0 109.575 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -107.64 62.51 0.22 Allowed Pre-proline 0 CA--C 1.548 0.876 0 O-C-N 120.288 -1.507 . . . . 0.0 113.519 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.37 -87.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.757 2.304 . . . . 0.0 112.792 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.3 -39.48 83.14 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 121.486 -0.759 . . . . 0.0 110.239 -178.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 m -56.05 -48.02 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 117.051 -1.452 . . . . 0.0 111.716 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -75.39 -32.22 60.71 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 120.869 1.668 . . . . 0.0 111.795 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 t -65.41 -46.89 78.21 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -69.35 -39.39 78.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.168 0.987 . . . . 0.0 109.459 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.02 -48.68 77.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 119.24 0.927 . . . . 0.0 110.122 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -68.85 -46.53 68.26 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -57.89 -44.17 86.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.393 0.542 . . . . 0.0 111.404 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -72.99 -33.61 65.91 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.864 1.666 . . . . 0.0 110.626 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -61.8 -37.24 83.65 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 119.524 1.056 . . . . 0.0 110.08 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.79 -24.21 63.92 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.675 0.39 . . . . 0.0 110.474 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 11.8 tp . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.623 1.169 . . . . 0.0 110.959 179.316 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 16.3 tp10 . . . . . 0 N--CA 1.452 -0.372 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 58.1 tp -73.39 112.84 9.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 177.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.3 mt -107.43 162.18 14.16 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.067 1.347 . . . . 0.0 108.783 -179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -137.71 144.35 41.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.202 1.001 . . . . 0.0 108.544 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 13.8 tp -118.57 96.25 49.73 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.79 115.27 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 123.298 2.665 . . . . 0.0 109.452 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.7 t -143.51 153.14 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 123.677 0.791 . . . . 0.0 110.462 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 41.5 ttt-85 -132.93 101.79 5.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 103.92 -2.622 . . . . 0.0 103.92 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.66 121.94 1.0 Allowed Glycine 0 CA--C 1.516 0.155 0 N-CA-C 105.479 -3.048 . . . . 0.0 105.479 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -66.43 -52.32 47.71 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 121.913 2.856 . . . . 0.0 109.801 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.37 -47.76 75.29 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -55.26 -41.47 72.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.343 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 29.8 t80 -73.9 -50.0 22.22 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.799 1.181 . . . . 0.0 111.095 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -54.47 -50.71 67.1 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.87 0.759 . . . . 0.0 110.707 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 25.7 ptm -65.52 -43.06 91.22 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.433 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.66 -42.08 99.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 120.014 1.279 . . . . 0.0 109.804 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.48 -56.46 21.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -56.74 -48.8 76.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.247 0.619 . . . . 0.0 112.5 -178.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1022 ' ' ILE . . . . . 0.488 HD11 HG21 ' B' ' 111' ' ' ILE . 97.9 mt -67.36 -36.32 76.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.362 1.065 . . . . 0.0 112.143 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -48.8 46.33 Favored 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 120.44 -1.412 . . . . 0.0 108.267 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.14 -41.94 97.65 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.727 0.811 . . . . 0.0 109.298 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 95.4 p -59.97 -46.38 89.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.495 1.043 . . . . 0.0 110.818 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 8.1 tt -67.89 -51.07 52.29 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.745 0.818 . . . . 0.0 111.647 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -59.91 -53.73 54.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 124.009 0.924 . . . . 0.0 111.513 -178.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.72 -31.65 72.77 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 119.112 0.869 . . . . 0.0 111.581 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -69.01 -45.57 70.19 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 178.051 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -65.34 -29.85 70.63 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.611 -0.68 . . . . 0.0 110.222 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.9 t80 -80.28 -31.87 38.24 Favored 'General case' 0 C--N 1.339 0.116 0 C-N-CA 124.193 0.997 . . . . 0.0 111.267 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1032 ' ' LEU . . . . . 0.554 HD11 HD22 ' D' 1129 ' ' LEU . 15.6 mt . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.999 1.32 . . . . 0.0 110.812 -178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 77.8 m80 . . . . . 0 CA--C 1.534 0.35 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.87 -51.6 66.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.882 0.765 . . . . 0.0 111.573 -178.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.48 -37.75 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 124.254 1.021 . . . . 0.0 112.35 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -69.21 -53.84 17.86 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.285 0.948 . . . . 0.0 109.076 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.2 m -52.61 -43.69 65.53 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.447 0.567 . . . . 0.0 110.425 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1040 ' ' TYR . . . . . 0.406 ' CD2' HD21 ' D' 1121 ' ' LEU . 3.5 t80 -61.68 -54.27 44.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.306 1.442 . . . . 0.0 111.049 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -62.74 -33.46 75.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.959 0.345 . . . . 0.0 110.487 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -65.3 -44.93 86.35 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -59.14 -48.72 80.59 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 119.78 1.173 . . . . 0.0 109.535 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -53.81 -51.61 62.98 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.386 0.674 . . . . 0.0 111.16 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.84 -41.64 82.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.061 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 15.0 mm100 . . . . . 0 N--CA 1.462 0.137 0 CA-C-N 119.1 0.864 . . . . 0.0 109.307 179.182 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -102.64 145.42 29.68 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.918 -1.114 . . . . 0.0 108.894 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -124.58 143.64 50.59 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 125.274 1.43 . . . . 0.0 107.324 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 9.4 tp -144.9 142.26 29.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 118.327 -0.844 . . . . 0.0 108.928 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -139.51 107.97 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.031 1.332 . . . . 0.0 109.138 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1103 ' ' VAL . . . . . 0.417 HG11 ' HE2' ' B' ' 116' ' ' LYS . 82.7 t -149.81 147.12 16.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 119.001 0.818 . . . . 0.0 109.095 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -102.19 103.61 14.14 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.775 0.83 . . . . 0.0 111.598 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.82 117.34 1.06 Allowed Glycine 0 N--CA 1.464 0.52 0 CA-C-O 115.994 -2.559 . . . . 0.0 108.125 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -67.48 -57.07 7.19 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 122.827 3.314 . . . . 0.0 111.452 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 30.7 mttp -68.44 -44.8 74.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -51.76 -50.88 59.8 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.025 1.33 . . . . 0.0 110.265 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.68 -45.91 77.36 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.88 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -58.42 -48.37 80.91 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.881 1.219 . . . . 0.0 109.931 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 65.7 mt -56.34 -53.95 33.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 C-N-CA 124.858 1.263 . . . . 0.0 108.658 179.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.85 -39.44 81.32 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.927 -179.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.6 mtp -65.21 -49.54 69.31 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 120.607 1.548 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -53.8 -46.6 71.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.88 0.848 . . . . 0.0 109.433 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.8 -27.2 61.01 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.404 0.682 . . . . 0.0 112.215 -179.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1116 ' ' LYS . . . . . 0.485 ' HE2' HG11 ' B' ' 103' ' ' VAL . 0.1 OUTLIER -63.04 -60.01 4.03 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.555 1.07 . . . . 0.0 109.696 -179.776 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.12 -42.74 99.08 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 31.1 t -52.76 -52.36 56.88 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.69 0.677 . . . . 0.0 112.55 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.21 -35.46 76.23 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.665 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -64.37 -48.39 75.65 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.013 1.279 . . . . 0.0 109.183 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1121 ' ' LEU . . . . . 0.406 HD21 ' CD2' ' C' 1040 ' ' TYR . 59.3 mt -58.16 -52.34 65.95 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.078 1.351 . . . . 0.0 111.548 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.9 tpt -64.16 -26.34 68.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.146 0.979 . . . . 0.0 111.392 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.86 -40.47 28.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.179 0.9 . . . . 0.0 109.85 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1124 ' ' LEU . . . . . . . . . . . . 0.32 2.0 pp -73.71 -32.42 63.89 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.2 t -94.31 148.39 34.97 Favored Pre-proline 0 CA--C 1.537 0.455 0 CA-C-N 119.068 0.849 . . . . 0.0 108.81 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.17 -164.21 0.09 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 123.715 2.944 . . . . 0.0 110.747 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -116.14 66.2 3.0 Favored Pre-proline 0 CA--C 1.547 0.851 0 O-C-N 120.183 -1.573 . . . . 0.0 113.737 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -79.96 -85.62 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 121.813 1.675 . . . . 0.0 112.662 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1129 ' ' LEU . . . . . 0.554 HD22 HD11 ' C' 1032 ' ' LEU . 7.9 tt -64.86 -38.12 89.93 Favored 'General case' 0 C--N 1.347 0.497 0 O-C-N 121.095 -1.003 . . . . 0.0 109.721 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 m -54.71 -36.06 35.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.542 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.39 -41.95 38.22 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 119.06 0.845 . . . . 0.0 109.433 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.95 -47.64 82.33 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.08 -51.38 68.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.985 0.914 . . . . 0.0 108.561 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -43.55 67.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 123.651 0.78 . . . . 0.0 110.447 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -62.84 -54.06 44.69 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 118.493 0.588 . . . . 0.0 110.031 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 10.0 tp60 -59.63 -37.28 78.2 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -40.82 43.94 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.082 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -58.91 -39.49 81.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.344 1.429 . . . . 0.0 107.397 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.03 -15.23 55.77 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.187 -0.946 . . . . 0.0 112.75 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 15.5 tp . . . . . 0 CA--C 1.538 0.49 0 C-N-CA 125.094 1.358 . . . . 0.0 110.855 179.171 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -67.05 -55.64 13.48 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 178.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -72.54 24.9 0.05 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.999 2.12 . . . . 0.0 114.257 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -55.16 106.51 0.23 Allowed 'General case' 0 C--O 1.233 0.211 0 C-N-CA 126.006 1.722 . . . . 0.0 109.5 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.5 tp -74.02 94.32 2.36 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.3 mt -93.03 167.45 11.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -134.0 159.58 40.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.44 90.29 49.04 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -71.28 108.27 2.32 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 125.249 3.966 . . . . 0.0 108.645 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.0 t -138.5 148.64 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 124.338 1.055 . . . . 0.0 110.516 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.2 102.06 4.88 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 175.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.46 124.49 1.25 Allowed Glycine 0 CA--C 1.522 0.472 0 N-CA-C 104.955 -3.258 . . . . 0.0 104.955 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -52.19 26.84 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 120.34 2.07 . . . . 0.0 111.476 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.84 -42.17 95.14 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -56.9 -47.79 79.7 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.24 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.93 -53.99 51.74 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.835 0.743 . . . . 0.0 111.211 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -55.33 -47.59 75.45 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -69.68 -44.16 71.02 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 118.237 0.472 . . . . 0.0 112.267 -179.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.88 -44.11 94.04 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.22 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -50.36 63.27 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.947 0.794 . . . . 0.0 109.757 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.59 -50.1 73.95 Favored 'General case' 0 C--O 1.225 -0.202 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.83 -32.25 57.35 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 CA-C-N 119.672 1.124 . . . . 0.0 110.155 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.561 ' HE2' HG11 ' C' 1010 ' ' VAL . 19.3 tptp -66.59 -46.55 75.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.69 -54.24 34.73 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.786 1.234 . . . . 0.0 110.924 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 m -53.61 -44.72 69.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 119.941 1.246 . . . . 0.0 112.086 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.53 -50.95 48.18 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.616 0.644 . . . . 0.0 110.017 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -54.42 -47.88 72.27 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.386 1.074 . . . . 0.0 110.817 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -64.62 -43.77 92.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.907 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 54.2 ttp -55.61 -48.19 75.3 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.115 0.87 . . . . 0.0 109.676 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -76.54 -14.39 60.02 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -86.33 -54.26 4.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 119.631 1.105 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 pp -65.85 151.34 95.21 Favored Pre-proline 0 CA--C 1.534 0.35 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.98 111.97 2.81 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.478 2.119 . . . . 0.0 107.036 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -66.61 37.76 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.494 2.317 . . . . 0.0 114.054 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -53.51 -57.82 9.34 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.361 -1.462 . . . . 0.0 111.837 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.0 m -59.79 -47.52 85.35 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 123.417 0.687 . . . . 0.0 111.006 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.408 HG13 ' H ' ' A' ' 37' ' ' ILE . 8.3 mt -60.3 -44.55 95.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 126.395 1.878 . . . . 0.0 111.933 -177.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.07 -58.72 7.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.5 m -55.83 -41.01 73.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.622 0.769 . . . . 0.0 111.162 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -65.34 -53.93 36.43 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.986 0.914 . . . . 0.0 110.993 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -61.73 -41.58 97.82 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.582 -0.699 . . . . 0.0 110.502 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.94 -54.24 33.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.014 0.926 . . . . 0.0 109.415 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -58.5 -44.39 89.42 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 119.649 1.113 . . . . 0.0 110.707 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -58.03 -36.39 72.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.441 1.019 . . . . 0.0 109.662 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.27 -53.73 33.35 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -57.64 -35.72 70.88 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.815 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -60.43 -33.33 72.38 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-O 118.436 -0.793 . . . . 0.0 111.069 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -44.03 78.48 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.306 0.957 . . . . 0.0 111.238 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -70.13 -26.3 63.88 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.648 0.779 . . . . 0.0 112.364 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -88.24 -21.56 24.44 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.611 0.765 . . . . 0.0 110.937 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -16.6 15.37 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.648 1.979 . . . . 0.0 112.902 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.7 mp -64.69 -24.31 67.53 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 95.09 106.47 0.02 OUTLIER 'General case' 0 C--N 1.342 0.273 1 C-N-CA 132.052 4.141 . . . . 0.0 108.08 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -143.29 -13.03 0.71 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -90.84 155.97 18.37 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 120.088 1.313 . . . . 0.0 109.09 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 12.5 t -71.01 -38.46 72.64 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 122.735 0.414 . . . . 0.0 110.285 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.7 m -146.87 139.03 24.67 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.414 1.086 . . . . 0.0 109.172 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.9 mt -141.66 146.97 22.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 126.813 2.045 . . . . 0.0 105.576 178.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -146.71 158.57 43.94 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.95 1.3 . . . . 0.0 109.016 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.254 1.313 0 C-N-CA 125.041 1.336 . . . . 0.0 108.649 179.589 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.89 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 17.4 m 145.45 -166.25 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.644 1 C-N-CA 133.493 4.717 . . . . 0.0 105.992 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -66.05 -163.23 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 127.439 2.295 . . . . 0.0 111.406 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -109.22 -0.26 19.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.291 1.837 . . . . 0.0 110.091 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -95.17 157.18 16.0 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.962 1.305 . . . . 0.0 111.801 -179.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 56.4 m -141.65 148.72 39.61 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.912 1.685 . . . . 0.0 107.609 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -101.62 138.52 38.5 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -117.22 145.63 43.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.428 1.491 . . . . 0.0 109.577 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.3 mt -136.06 128.83 30.97 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 125.027 1.331 . . . . 0.0 107.469 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -129.46 100.52 5.58 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.22 149.87 11.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 124.065 0.946 . . . . 0.0 108.797 -179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -114.11 102.36 10.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.4 0.68 . . . . 0.0 110.739 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.57 113.76 0.75 Allowed Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 116.396 -2.335 . . . . 0.0 108.72 177.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -60.59 -56.42 21.55 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.669 2.735 . . . . 0.0 110.501 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -63.06 -52.03 64.36 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -51.96 -49.62 62.85 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.825 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -63.24 -44.84 94.09 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 120.623 1.556 . . . . 0.0 111.596 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -57.06 -50.69 71.98 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.346 0.976 . . . . 0.0 110.4 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.472 HG21 HD11 ' C' 1022 ' ' ILE . 81.2 mt -62.01 -58.27 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 127.058 2.143 . . . . 0.0 110.609 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.61 -36.79 77.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 116.647 -1.644 . . . . 0.0 110.043 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 64.0 mtp -63.08 -52.88 60.97 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 121.423 1.919 . . . . 0.0 110.316 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.45 -43.21 97.1 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.513 0.597 . . . . 0.0 111.827 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 74.6 mt -69.66 -34.49 74.07 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.67 0.668 . . . . 0.0 110.815 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' LYS . . . . . 0.42 ' HB2' HD21 ' D' 1112 ' ' LEU . 0.2 OUTLIER -66.24 -54.16 28.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.684 0.794 . . . . 0.0 109.78 180.0 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -60.93 -41.94 97.21 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.011 1.325 . . . . 0.0 108.818 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.6 t -52.78 -52.97 54.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.827 0.851 . . . . 0.0 110.992 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.2 -38.64 82.17 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.92 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -46.09 88.37 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.577 1.081 . . . . 0.0 109.071 178.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' B' ' 121' ' ' LEU . 3.7 mm? -67.45 -45.07 77.08 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 117.151 -1.404 . . . . 0.0 108.01 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 6.3 tpt -53.89 -33.35 56.27 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 120.101 1.319 . . . . 0.0 110.383 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.47 -31.92 48.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.847 0.859 . . . . 0.0 111.107 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 51.1 tp -87.88 -33.43 18.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 4.1 m -93.46 148.08 34.85 Favored Pre-proline 0 C--O 1.235 0.313 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.59 175.41 9.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 120.981 1.121 . . . . 0.0 110.071 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.36 33.47 0.05 OUTLIER Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 117.538 2.422 . . . . 0.0 117.538 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.26 -57.23 0.79 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 123.07 2.132 . . . . 0.0 112.551 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -28.89 69.9 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.974 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 9.9 t -63.25 -56.54 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.109 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.218 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.46 -35.68 77.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.157 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 9.6 t -61.71 -50.26 73.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 109.247 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.79 -40.41 72.58 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.896 -0.502 . . . . 0.0 109.759 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -52.89 -48.22 67.34 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.145 1.378 . . . . 0.0 111.448 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -77.7 -46.18 22.62 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 123.362 0.665 . . . . 0.0 112.09 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -55.59 -39.03 70.19 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.8 tm0? -80.55 -29.61 37.12 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 125.306 1.443 . . . . 0.0 109.048 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.28 -30.06 64.38 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.546 1.521 . . . . 0.0 108.035 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 14.3 mt -59.38 -13.66 9.2 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 118.917 0.78 . . . . 0.0 112.797 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.39 -21.03 27.39 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.218 1.807 . . . . 0.0 108.94 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -89.12 157.49 18.28 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 . . . . . 0 C--O 1.249 1.069 0 C-N-CA 124.084 0.954 . . . . 0.0 109.746 -179.507 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 11.6 t70 -66.93 -30.0 70.02 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.709 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -95.0 27.98 2.95 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.322 2.249 . . . . 0.0 112.973 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.52 119.18 7.55 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 121.804 -0.56 . . . . 0.0 109.672 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 61.5 tp -77.17 95.29 4.24 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 16.7 mt -96.48 127.41 42.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.723 2.009 . . . . 0.0 108.874 -178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -106.2 122.61 46.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.591 0.756 . . . . 0.0 109.465 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.3 mt -95.72 100.24 5.99 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 117.552 -1.213 . . . . 0.0 108.842 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -75.33 121.94 6.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.809 2.34 . . . . 0.0 110.252 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1010 ' ' VAL . . . . . 0.561 HG11 ' HE2' ' A' ' 23' ' ' LYS . 4.8 t -145.63 152.37 14.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 O-C-N 120.951 -1.093 . . . . 0.0 110.716 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.18 102.02 4.87 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.22 130.49 2.13 Favored Glycine 0 CA--C 1.52 0.365 0 CA-C-O 116.311 -2.383 . . . . 0.0 107.646 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -52.53 22.77 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.655 2.727 . . . . 0.0 111.911 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -72.54 -31.14 65.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.54 -41.55 98.45 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.822 0.849 . . . . 0.0 110.203 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 11.1 t80 -69.61 -52.04 29.57 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.057 0.844 . . . . 0.0 108.947 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -54.3 -57.42 11.29 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.81 -45.87 91.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.03 0.532 . . . . 0.0 111.999 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.5 mm? -67.29 -38.2 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.962 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.24 -49.03 47.52 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 119.988 1.267 . . . . 0.0 111.079 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.21 -46.97 75.93 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.407 1.003 . . . . 0.0 110.959 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1022 ' ' ILE . . . . . 0.472 HD11 HG21 ' B' ' 111' ' ' ILE . 84.5 mt -68.69 -45.39 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.2 tptp -58.02 -45.84 86.25 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 124.537 1.135 . . . . 0.0 110.615 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -67.36 -50.98 57.55 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.434 1.094 . . . . 0.0 108.894 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 30.2 m -53.96 -42.6 69.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.368 0.985 . . . . 0.0 111.134 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -68.89 -52.13 32.82 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.452 1.101 . . . . 0.0 109.894 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -58.55 -43.55 89.36 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 122.956 0.502 . . . . 0.0 110.886 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.09 -40.02 86.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.762 -1.113 . . . . 0.0 109.516 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1029 ' ' MET . . . . . 0.432 ' HA ' HE21 ' C' 1034 ' ' GLN . 49.0 ttp -63.13 -35.73 81.26 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.005 0.821 . . . . 0.0 110.163 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -87.6 -12.87 44.37 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.28 0.945 . . . . 0.0 112.496 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 7.2 t80 -98.58 -57.85 2.1 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.859 1.264 . . . . 0.0 113.029 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.73 156.26 91.38 Favored Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 123.727 0.811 . . . . 0.0 111.933 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.21 78.89 1.82 Allowed 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 124.139 3.226 . . . . 0.0 110.805 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1034 ' ' GLN . . . . . 0.432 HE21 ' HA ' ' C' 1029 ' ' MET . 22.7 mm-40 -75.27 65.01 1.55 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.466 1.106 . . . . 0.0 113.103 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.0 t60 -67.86 -40.09 83.67 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.246 -0.909 . . . . 0.0 110.241 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 44.4 m -59.14 -43.51 92.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.044 -0.979 . . . . 0.0 108.463 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 42.4 mt -61.54 -45.41 98.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 119.791 1.178 . . . . 0.0 109.334 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -56.26 -55.37 34.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.806 0.842 . . . . 0.0 110.266 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 41.2 m -65.24 -34.85 79.35 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.819 -0.55 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.68 -52.61 56.32 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.473 1.109 . . . . 0.0 109.929 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -55.65 -47.33 76.83 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -59.32 -57.15 14.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.915 0.886 . . . . 0.0 109.966 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -50.2 -50.47 49.39 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.722 0.809 . . . . 0.0 111.349 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -63.13 -40.7 98.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.612 0.642 . . . . 0.0 110.97 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -62.89 -43.95 97.42 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.545 0.738 . . . . 0.0 109.455 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -67.41 -46.79 72.17 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.135 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -52.88 -45.72 67.62 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 124.137 0.975 . . . . 0.0 111.874 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 17.4 t60 -53.79 -37.56 63.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.667 0.667 . . . . 0.0 112.527 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -70.74 -31.85 68.83 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.025 0.93 . . . . 0.0 111.595 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 31.3 m170 -88.34 -8.88 54.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.837 1.255 . . . . 0.0 112.18 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.48 -11.63 3.12 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.746 2.019 . . . . 0.0 112.818 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 1.9 tp -71.9 16.57 0.11 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.928 2.091 . . . . 0.0 111.554 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 51.89 71.63 0.44 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 129.373 3.069 . . . . 0.0 112.438 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -113.61 3.06 15.5 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.329 1.052 . . . . 0.0 113.661 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -87.88 166.19 14.73 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 119.247 0.93 . . . . 0.0 109.816 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 14.8 t -75.48 -50.26 16.27 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 106.568 -1.642 . . . . 0.0 106.568 178.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 50.8 m -139.31 151.09 46.14 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 126.208 1.803 . . . . 0.0 107.77 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 65.4 mt -136.73 137.33 47.5 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -146.93 158.55 43.95 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.196 0.999 . . . . 0.0 109.846 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.256 1.397 0 C-N-CA 126.917 2.087 . . . . 0.0 106.86 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.73 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 17.6 t -162.79 -169.01 1.94 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.422 2.689 . . . . 0.0 105.929 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -61.15 162.17 7.73 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -83.11 -9.84 59.0 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.793 -1.192 . . . . 0.0 112.66 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 24.4 t0 -80.15 169.93 17.14 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.602 -1.311 . . . . 0.0 109.29 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.5 m -158.41 156.96 31.37 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 119.472 -2.017 . . . . 0.0 108.569 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -101.82 134.38 45.09 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -120.84 123.3 42.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 125.837 1.655 . . . . 0.0 109.209 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1101 ' ' LEU . . . . . 0.435 HD23 ' H ' ' D' 1102 ' ' GLN . 0.5 OUTLIER -126.65 147.83 49.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.174 0.99 . . . . 0.0 108.884 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D 1102 ' ' GLN . . . . . 0.435 ' H ' HD23 ' D' 1101 ' ' LEU . 7.4 pm0 -136.06 110.87 8.73 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.098 2.159 . . . . 0.0 109.428 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -155.2 151.21 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.471 1.509 . . . . 0.0 110.639 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.67 102.44 7.6 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.732 1.151 . . . . 0.0 110.535 177.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.56 122.87 2.04 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 105.197 -3.161 . . . . 0.0 105.197 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.57 -58.19 5.7 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 120.989 2.395 . . . . 0.0 114.3 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -63.06 -41.02 99.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.596 0.635 . . . . 0.0 109.327 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 1.2 m120 -53.02 -48.58 67.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.288 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.6 t80 -63.76 -48.38 77.2 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 119.514 1.052 . . . . 0.0 111.727 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.0 -47.29 68.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.197 0.908 . . . . 0.0 111.313 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.4 mt -68.57 -57.56 8.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 126.104 1.762 . . . . 0.0 110.79 -179.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1112 ' ' LEU . . . . . 0.42 HD21 ' HB2' ' B' ' 116' ' ' LYS . 5.1 mp -56.68 -39.0 73.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 118.925 0.784 . . . . 0.0 110.797 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 42.1 mtp -63.55 -52.67 60.08 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.362 0.983 . . . . 0.0 110.237 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.08 -33.33 75.25 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.428 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1115 ' ' LEU . . . . . 0.429 HD22 ' CG2' ' C' 1022 ' ' ILE . 31.6 mt -70.32 -38.37 74.91 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 120.215 1.37 . . . . 0.0 109.951 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1116 ' ' LYS . . . . . 0.403 ' HE3' ' CG ' ' D' 1120 ' ' GLU . 21.8 tptt -62.67 -52.49 63.08 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -57.01 -42.37 80.22 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.412 1.485 . . . . 0.0 109.693 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 44.8 t -52.64 -54.63 30.71 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.529 1.132 . . . . 0.0 110.255 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.09 -43.39 74.61 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.411 -0.805 . . . . 0.0 110.977 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1120 ' ' GLU . . . . . 0.403 ' CG ' ' HE3' ' D' 1116 ' ' LYS . 2.0 mm-40 -55.36 -48.15 74.69 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.172 0.896 . . . . 0.0 111.7 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1121 ' ' LEU . . . . . 0.457 ' HA ' HD13 ' D' 1121 ' ' LEU . 3.4 mm? -72.35 -48.76 39.4 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 116.208 -1.853 . . . . 0.0 109.058 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.5 tpt -54.51 -33.06 59.2 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.846 1.657 . . . . 0.0 109.436 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -74.87 -32.96 62.01 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 117.897 -1.049 . . . . 0.0 110.572 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 43.7 tp -87.03 -32.55 19.95 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.179 1.354 . . . . 0.0 113.624 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 9.7 m -92.41 148.45 36.44 Favored Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 120.752 -1.218 . . . . 0.0 108.322 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -68.84 177.34 5.03 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 N-CA-C 109.426 -1.028 . . . . 0.0 109.426 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -113.4 47.71 0.38 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 116.361 1.986 . . . . 0.0 116.361 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.41 -51.18 0.77 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.744 2.296 . . . . 0.0 113.014 -178.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -29.6 69.43 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.136 -0.978 . . . . 0.0 110.625 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.6 t -61.17 -54.48 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 124.034 0.934 . . . . 0.0 108.669 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.63 -45.73 92.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.02 0.827 . . . . 0.0 111.428 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.8 t -59.07 -50.46 74.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.095 0.958 . . . . 0.0 110.484 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.1 t80 -68.39 -42.16 79.48 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.035 1.334 . . . . 0.0 110.853 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.49 -49.15 68.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 119.107 0.867 . . . . 0.0 111.023 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -74.43 -39.93 62.29 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.1 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -62.79 -29.9 71.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.822 0.449 . . . . 0.0 111.42 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -80.19 -39.06 29.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -56.75 -32.67 65.8 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.814 -0.554 . . . . 0.0 109.518 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 15.1 mt -64.26 -12.19 38.83 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.605 1.162 . . . . 0.0 113.097 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 3.0 tt -83.03 -21.54 33.81 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.618 1.167 . . . . 0.0 109.122 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -94.35 177.26 6.01 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 127.619 2.368 . . . . 0.0 109.166 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 123.4 0.68 . . . . 0.0 109.589 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.2 t . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.299 0.095 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -72.27 -10.66 60.08 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.058 0.943 . . . . 0.0 112.039 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -113.72 9.61 17.77 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.018 1.727 . . . . 0.0 111.297 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.25 112.28 4.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.691 0.796 . . . . 0.0 109.288 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.3 95.4 0.43 Allowed 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -104.14 129.16 51.85 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.292 1.037 . . . . 0.0 110.243 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -103.38 118.6 37.12 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -101.93 96.02 6.23 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 125.806 1.642 . . . . 0.0 111.118 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -75.38 113.95 3.88 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 125.12 3.88 . . . . 0.0 111.466 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.9 t -145.11 154.91 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.278 -0.889 . . . . 0.0 109.487 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -135.34 101.88 4.97 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 125.046 1.339 . . . . 0.0 107.817 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.94 121.36 0.97 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 107.64 -2.184 . . . . 0.0 107.64 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.92 -51.57 31.81 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 120.232 2.016 . . . . 0.0 108.45 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.98 -32.82 73.5 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -61.52 -53.37 57.27 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.135 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -67.65 -39.16 84.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.02 -57.23 12.56 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.332 0.515 . . . . 0.0 110.397 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -71.48 -33.38 69.24 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 119.322 -0.37 . . . . 0.0 111.494 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 tp -61.22 -53.34 58.11 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.172 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.88 -34.95 77.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.225 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.25 -49.22 72.6 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.602 1.092 . . . . 0.0 110.607 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.0 mt -83.25 -35.05 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 123.612 0.765 . . . . 0.0 112.169 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.52 -46.63 87.54 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 120.186 -1.571 . . . . 0.0 109.359 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -67.83 -48.9 64.9 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 117.346 -1.311 . . . . 0.0 109.812 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.3 p -53.03 -41.26 64.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 120.04 1.291 . . . . 0.0 112.158 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 26' ' ' LEU . 1.1 tm? -74.19 -49.67 22.53 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.898 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -54.46 -47.61 72.71 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.031 0.832 . . . . 0.0 109.913 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.426 HD22 HG22 ' B' ' 130' ' ' VAL . 55.8 mt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.709 1.604 . . . . 0.0 110.857 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.9 ttt -56.75 -47.1 80.84 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.586 1.154 . . . . 0.0 109.079 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -64.84 -40.28 94.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.866 1.267 . . . . 0.0 111.532 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.8 -30.33 65.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.696 1.199 . . . . 0.0 112.307 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.3 tp -126.3 70.06 69.08 Favored Pre-proline 0 C--O 1.238 0.449 0 C-N-CA 123.657 0.783 . . . . 0.0 109.918 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.29 77.92 3.4 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.235 2.624 . . . . 0.0 111.487 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 62.9 mm-40 -69.27 167.95 15.25 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.0 m80 -59.25 -28.07 66.37 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.593 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.6 m -57.15 -48.53 78.46 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.252 1.387 . . . . 0.0 107.798 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.4 mt -65.35 -44.48 94.69 Favored 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 124.38 1.072 . . . . 0.0 108.616 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.04 -39.27 77.97 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.449 0.568 . . . . 0.0 111.98 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.4 m -66.6 -52.48 44.81 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -55.76 -51.38 67.59 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 123.408 0.683 . . . . 0.0 111.042 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -53.21 -48.44 68.13 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.737 0.415 . . . . 0.0 111.3 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -64.02 -50.81 67.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.539 0.735 . . . . 0.0 111.924 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -61.53 -40.49 94.84 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.019 0.928 . . . . 0.0 111.846 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -45.37 67.95 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -58.02 -29.15 65.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.412 1.005 . . . . 0.0 111.709 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -59.46 -46.29 89.19 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -60.21 -31.88 70.58 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.559 -0.713 . . . . 0.0 111.372 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -70.33 -57.12 5.21 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -55.52 -36.61 66.91 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.152 0.581 . . . . 0.0 110.811 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -68.19 -44.62 75.46 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.081 -0.961 . . . . 0.0 111.345 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.5 mt -73.99 -44.02 56.1 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.95 1.25 . . . . 0.0 111.601 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.88 -46.0 92.34 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 49.16 69.04 0.62 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.094 1.357 . . . . 0.0 111.094 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.478 ' HE2' ' HA ' ' A' ' 54' ' ' LYS . 9.1 mmpt? -133.46 170.99 14.68 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.353 1.061 . . . . 0.0 111.877 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -144.38 90.36 2.09 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.336 1.454 . . . . 0.0 109.969 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.2 p -143.3 -24.65 0.6 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.154 0.981 . . . . 0.0 111.57 178.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 56.7 m -128.84 99.12 5.19 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.186 1.795 . . . . 0.0 106.411 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 pp -81.47 7.44 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 123.223 0.609 . . . . 0.0 111.063 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.0 158.46 26.72 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.196 2.999 . . . . 0.0 106.294 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.154 0 C-N-CA 125.034 1.334 . . . . 0.0 109.195 -178.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.816 0 N-CA-C 111.919 -0.472 . . . . 0.0 111.919 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -163.52 165.01 24.12 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.41 1.884 . . . . 0.0 108.606 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -90.94 101.96 14.73 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -72.55 8.63 1.34 Allowed 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 126.636 1.974 . . . . 0.0 114.582 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 28.1 t0 72.17 167.81 0.31 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.778 2.431 . . . . 0.0 112.5 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 59.2 m -86.04 167.05 15.36 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.539 1.936 . . . . 0.0 110.896 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -123.37 142.24 51.17 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 124.488 1.115 . . . . 0.0 108.567 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -127.2 147.45 50.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.06 0.944 . . . . 0.0 109.777 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.16 144.87 51.15 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.357 1.863 . . . . 0.0 107.371 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.08 98.92 4.12 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.223 1.009 . . . . 0.0 112.321 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -151.72 150.35 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.174 -1.579 . . . . 0.0 112.108 -178.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.428 ' HB3' ' HA ' ' D' 1098 ' ' THR . 0.0 OUTLIER -124.2 100.85 6.9 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 121.924 0.869 . . . . 0.0 108.883 177.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.64 116.54 1.04 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 103.753 -3.739 . . . . 0.0 103.753 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.7 -56.78 14.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 120.473 2.137 . . . . 0.0 111.002 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -61.11 -48.96 79.25 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 -54.86 -45.5 74.57 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.428 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -61.83 -55.05 33.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.356 -1.307 . . . . 0.0 111.216 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -48.45 -54.32 14.6 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.291 1.036 . . . . 0.0 111.049 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.3 mt -60.62 -57.73 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 126.13 1.772 . . . . 0.0 110.028 -179.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.44 -25.77 67.44 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.195 -0.94 . . . . 0.0 112.136 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 5.5 ttt -68.91 -52.42 29.63 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.657 1.117 . . . . 0.0 108.218 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -65.58 -37.67 87.31 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 118.894 -1.123 . . . . 0.0 110.344 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.0 mt -63.89 -38.89 92.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.756 -0.59 . . . . 0.0 111.241 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -54.21 28.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 O-C-N 121.344 -0.848 . . . . 0.0 110.025 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -54.66 -42.83 71.79 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 125.377 1.673 . . . . 0.0 108.337 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 40.8 t -58.04 -48.65 79.45 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.242 1.017 . . . . 0.0 110.899 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.26 -43.43 86.48 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.65 0.659 . . . . 0.0 111.26 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.07 -45.63 91.24 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.198 0.908 . . . . 0.0 109.598 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -48.05 75.02 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.635 -0.666 . . . . 0.0 109.818 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -24.0 67.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.129 0.972 . . . . 0.0 111.098 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -89.31 -20.65 23.8 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.747 1.158 . . . . 0.0 110.521 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.08 -33.18 11.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 120.034 1.288 . . . . 0.0 112.149 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.1 t -95.49 148.08 34.04 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.729 1.612 . . . . 0.0 108.487 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.25 -178.1 3.98 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 123.481 2.788 . . . . 0.0 111.635 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -129.0 62.84 64.43 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 116.752 2.13 . . . . 0.0 116.752 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.19 -54.83 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.517 2.811 . . . . 0.0 113.728 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 tt -56.33 -34.09 66.24 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.627 0.771 . . . . 0.0 109.767 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.426 HG22 HD22 ' A' ' 28' ' ' LEU . 14.8 t -61.25 -47.57 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 126.101 1.76 . . . . 0.0 109.3 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -63.49 -36.29 83.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.646 1.112 . . . . 0.0 109.74 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 2.8 t -70.62 -39.05 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.881 0.472 . . . . 0.0 110.166 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -70.1 -50.76 37.57 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.315 1.446 . . . . 0.0 109.371 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.17 -48.12 68.25 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.447 1.499 . . . . 0.0 110.445 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 -68.34 -48.05 65.87 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.732 1.151 . . . . 0.0 110.648 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -56.0 -40.47 73.41 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.004 -0.435 . . . . 0.0 110.924 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -80.74 -27.71 36.74 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.541 1.137 . . . . 0.0 111.264 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -63.68 -33.3 75.32 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.654 1.57 . . . . 0.0 108.483 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.7 mt -63.96 -15.68 59.78 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.043 0.937 . . . . 0.0 111.756 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.4 tt -73.37 -16.45 61.34 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.094 1.357 . . . . 0.0 109.433 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.82 169.83 8.31 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.801 1.64 . . . . 0.0 110.183 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 49.0 mtt-85 . . . . . 0 C--O 1.249 1.056 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 178.299 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.685 0 CA-C-O 121.173 0.511 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 23.1 t0 -70.9 -33.73 70.85 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.439 1.095 . . . . 0.0 109.639 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -87.81 4.77 43.21 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.719 2.007 . . . . 0.0 111.85 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -71.97 104.72 3.61 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 21.9 tp -73.78 95.15 2.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.82 176.36 5.32 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.306 2.242 . . . . 0.0 109.276 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -138.42 144.83 40.36 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.633 1.573 . . . . 0.0 107.224 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.9 tp -126.11 105.78 25.32 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.418 1.487 . . . . 0.0 110.494 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -82.66 115.43 2.47 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 123.868 3.045 . . . . 0.0 111.43 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 96.4 t -139.93 150.86 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 120.299 -1.501 . . . . 0.0 108.056 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.39 104.77 5.71 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.205 0.602 . . . . 0.0 110.775 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -165.96 125.42 1.34 Allowed Glycine 0 CA--C 1.519 0.319 0 N-CA-C 105.881 -2.888 . . . . 0.0 105.881 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -68.52 -51.78 39.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 121.779 2.79 . . . . 0.0 109.881 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.0 -41.71 97.4 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.561 0.696 . . . . 0.0 109.138 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -61.93 -46.82 87.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 124.344 1.057 . . . . 0.0 111.647 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 17.1 t80 -66.77 -41.91 86.93 Favored 'General case' 0 C--O 1.23 0.065 0 CA-C-N 120.157 1.344 . . . . 0.0 111.863 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -55.54 -56.99 13.86 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.563 0.745 . . . . 0.0 110.716 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 tmm? -70.47 -40.26 73.77 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 118.507 -0.758 . . . . 0.0 112.594 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 8.5 tp -58.11 -40.95 82.49 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.242 0.928 . . . . 0.0 108.904 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 6.6 mt -66.87 -47.14 72.8 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.919 -1.039 . . . . 0.0 109.142 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -55.52 -49.14 73.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.382 0.992 . . . . 0.0 111.976 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.76 -36.89 66.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 O-C-N 121.866 -0.521 . . . . 0.0 111.183 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -66.59 -57.9 6.29 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.108 -0.995 . . . . 0.0 109.122 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -54.96 -55.23 33.08 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.327 1.451 . . . . 0.0 109.731 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 33.1 p -53.37 -49.9 66.2 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.958 1.254 . . . . 0.0 112.49 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.28 -52.07 63.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 118.197 0.453 . . . . 0.0 110.767 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.84 -40.67 80.66 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.452 0.701 . . . . 0.0 112.089 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 31.5 mt -71.36 -44.5 64.91 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.036 -1.04 . . . . 0.0 110.012 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -43.25 85.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -66.61 -44.45 82.06 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.404 1.882 . . . . 0.0 110.951 179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 t80 -68.64 -44.46 74.12 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 12.6 tp -116.04 73.92 5.13 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.621 1.168 . . . . 0.0 110.869 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.38 99.47 1.21 Allowed 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 122.129 1.886 . . . . 0.0 109.023 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1034 ' ' GLN . . . . . 0.483 ' H ' HD12 ' C' 1037 ' ' ILE . 36.6 mm-40 -85.07 167.03 16.17 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.511 1.124 . . . . 0.0 108.206 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 13.3 m80 -54.2 -36.98 64.03 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.126 0.421 . . . . 0.0 111.344 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -51.55 66.81 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.75 1.22 . . . . 0.0 108.801 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C 1037 ' ' ILE . . . . . 0.483 HD12 ' H ' ' C' 1034 ' ' GLN . 48.3 mt -65.39 -45.31 93.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 125.743 1.617 . . . . 0.0 108.676 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.48 -45.3 69.57 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 124.911 1.284 . . . . 0.0 111.314 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.7 m -65.68 -52.9 47.88 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.752 1.221 . . . . 0.0 109.784 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -55.78 -48.97 74.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.027 0.931 . . . . 0.0 111.208 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -55.22 -48.53 73.76 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.3 0.64 . . . . 0.0 110.468 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -33.72 75.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.97 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.76 -48.74 77.86 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.522 0.729 . . . . 0.0 109.089 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -60.25 -46.58 89.3 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.896 0.479 . . . . 0.0 109.718 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -58.64 -33.49 70.12 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.198 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -60.44 -45.38 93.88 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.826 1.194 . . . . 0.0 108.443 178.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -70.42 -29.84 66.55 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.574 -0.704 . . . . 0.0 111.756 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -64.29 -47.1 80.8 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.303 0.956 . . . . 0.0 108.628 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -65.39 -39.81 92.68 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.187 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 63.3 m170 -59.67 -43.55 93.92 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.083 1.31 . . . . 0.0 113.238 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 8.6 mt -75.51 -45.75 36.38 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 56.1 tp -75.12 -31.26 61.06 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 13.8 tt0 53.66 7.01 0.09 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 128.543 2.737 . . . . 0.0 116.238 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -67.65 164.43 19.24 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 119.614 -1.929 . . . . 0.0 111.692 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -141.61 83.2 1.85 Allowed 'General case' 0 C--N 1.33 -0.279 1 N-CA-C 99.644 -4.206 . . . . 0.0 99.644 178.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 46.5 p -133.99 -15.14 2.33 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.101 1.76 . . . . 0.0 112.915 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 15.8 m -143.6 118.4 9.91 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 104.249 -2.5 . . . . 0.0 104.249 179.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 2.3 pp -100.77 10.56 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 124.506 1.122 . . . . 0.0 113.307 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.39 153.28 47.61 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 126.01 1.724 . . . . 0.0 106.563 178.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.251 1.134 0 C-N-CA 126.556 1.942 . . . . 0.0 105.836 179.982 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.61 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.17 177.97 4.73 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.352 1.061 . . . . 0.0 109.763 178.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 1.4 t70 -77.36 153.68 33.52 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -122.83 22.74 9.64 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.601 0.76 . . . . 0.0 111.592 -177.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 3.0 t70 68.0 -165.59 0.2 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.453 1.101 . . . . 0.0 111.012 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1098 ' ' THR . . . . . 0.428 ' HA ' ' HB3' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -121.3 167.69 12.46 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.051 1.34 . . . . 0.0 108.533 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -119.83 130.49 54.93 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -120.6 142.79 49.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.401 1.08 . . . . 0.0 109.227 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.31 134.83 54.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.703 1.201 . . . . 0.0 108.197 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -128.25 111.52 13.49 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.7 m -155.38 151.68 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 126.209 1.804 . . . . 0.0 108.71 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.88 101.68 7.38 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.86 122.32 1.81 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 106.833 -2.507 . . . . 0.0 106.833 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -67.51 -58.0 5.51 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 120.799 2.299 . . . . 0.0 113.683 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 51.6 mttm -65.83 -42.93 89.93 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -51.98 -49.01 64.08 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.227 -0.892 . . . . 0.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 75.2 t80 -62.94 -49.63 73.99 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.301 0.955 . . . . 0.0 112.558 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -56.77 -49.71 74.47 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.208 0.913 . . . . 0.0 110.551 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.8 mt -58.98 -48.81 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 1.8 mm? -62.3 -34.7 77.1 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.313 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -52.85 57.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.189 0.904 . . . . 0.0 108.562 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -62.97 -42.47 99.84 Favored 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.72 -0.792 . . . . 0.0 111.232 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 34.9 mt -64.1 -44.59 91.85 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 118.209 0.459 . . . . 0.0 112.157 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.62 -51.96 55.6 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 118.703 0.683 . . . . 0.0 110.475 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.05 -52.12 59.55 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.583 1.177 . . . . 0.0 108.815 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 42.2 t -56.5 -44.7 80.94 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.143 -1.408 . . . . 0.0 112.839 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.87 -44.9 91.68 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.899 1.227 . . . . 0.0 110.487 -179.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.77 -48.26 81.45 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.635 0.774 . . . . 0.0 109.511 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -44.95 89.26 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.2 1.0 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.4 -30.55 70.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.769 1.227 . . . . 0.0 111.47 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 40.0 tp10 -78.7 -34.69 45.85 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.843 -0.599 . . . . 0.0 109.914 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.1 pp -85.75 -29.81 23.58 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.1 p -94.2 144.26 27.74 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 119.917 1.235 . . . . 0.0 109.059 -178.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.65 175.51 7.92 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.484 1.456 . . . . 0.0 110.667 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -117.93 39.96 0.31 Allowed Pre-proline 0 CA--C 1.553 1.083 0 N-CA-C 118.07 2.619 . . . . 0.0 118.07 -176.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -57.54 -48.76 15.8 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.727 2.284 . . . . 0.0 115.08 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 9.1 tt -65.1 -38.98 92.45 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.4 t -58.11 -48.32 84.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 123.773 0.829 . . . . 0.0 109.01 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.85 -45.08 78.55 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 2.5 m -63.05 -48.0 80.58 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 119.183 -0.437 . . . . 0.0 110.238 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.38 -52.59 64.73 Favored 'General case' 0 C--O 1.227 -0.109 0 C-N-CA 124.834 1.253 . . . . 0.0 110.948 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -53.23 -46.04 68.94 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.37 1.868 . . . . 0.0 110.822 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.75 -50.78 26.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.626 0.648 . . . . 0.0 110.226 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -56.08 -35.15 66.66 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.818 -0.552 . . . . 0.0 110.888 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -78.1 -32.89 50.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.165 0.986 . . . . 0.0 110.286 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -59.57 -33.09 71.0 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.7 mt -61.2 -9.93 5.75 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.423 0.689 . . . . 0.0 112.544 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.71 12.48 36.49 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.582 1.953 . . . . 0.0 109.665 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -134.0 157.36 46.27 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 126.292 1.837 . . . . 0.0 108.887 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 75.9 mtt-85 . . . . . 0 C--O 1.246 0.908 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 179.435 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.4 p . . . . . 0 CA--C 1.533 0.294 0 CA-C-O 119.683 -0.198 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -2.62 1.18 Allowed 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -89.16 1.58 55.43 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 128.575 2.75 . . . . 0.0 113.388 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.83 107.81 0.57 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.314 0.961 . . . . 0.0 108.84 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.9 tp -77.58 108.91 11.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.034 1.334 . . . . 0.0 111.429 -178.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -103.34 162.64 12.84 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -135.97 102.25 4.98 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.338 -0.852 . . . . 0.0 111.094 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mp -75.73 119.4 76.97 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 119.897 1.226 . . . . 0.0 108.626 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -86.85 117.42 1.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 122.836 2.358 . . . . 0.0 107.839 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.4 t -141.13 152.07 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 119.955 1.252 . . . . 0.0 108.763 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.16 102.9 5.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.93 124.58 1.24 Allowed Glycine 0 C--O 1.225 -0.444 0 CA-C-O 115.695 -2.725 . . . . 0.0 107.682 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -69.88 -52.0 28.45 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 122.617 3.209 . . . . 0.0 111.288 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -76.17 -30.85 58.24 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.816 1.246 . . . . 0.0 109.29 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 m -67.0 -51.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -58.88 -37.9 77.61 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 119.036 0.835 . . . . 0.0 109.912 179.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -57.64 9.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.472 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -64.95 -44.09 90.57 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.497 0.59 . . . . 0.0 111.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.04 -51.4 69.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.2 1.0 . . . . 0.0 108.49 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -70.77 -45.56 64.51 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.323 0.965 . . . . 0.0 111.85 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -56.31 -48.85 75.87 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.657 1.117 . . . . 0.0 113.367 -177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.7 mt -74.4 -32.97 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.718 -0.614 . . . . 0.0 109.352 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.89 -48.23 79.89 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.98 -45.46 93.55 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 125.554 1.541 . . . . 0.0 109.139 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.2 t -53.17 -51.35 62.33 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.747 0.819 . . . . 0.0 110.72 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tt -61.6 -55.56 29.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.865 0.866 . . . . 0.0 109.946 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.89 -51.63 65.4 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 124.547 1.139 . . . . 0.0 112.588 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.05 -41.55 86.31 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.141 -0.974 . . . . 0.0 112.521 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.89 -45.5 93.48 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -67.23 -31.51 71.92 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 118.36 -0.829 . . . . 0.0 111.378 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -71.39 -27.59 63.43 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.159 0.89 . . . . 0.0 109.767 178.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.2 mt -126.34 76.58 73.01 Favored Pre-proline 0 C--O 1.241 0.631 0 CA-C-N 119.743 1.156 . . . . 0.0 109.417 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -72.91 2.52 5.32 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.249 3.299 . . . . 0.0 113.208 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -113.14 -65.01 1.23 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.472 1.109 . . . . 0.0 108.895 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -47.84 -50.1 27.25 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.454 1.502 . . . . 0.0 113.902 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -45.68 79.02 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.759 -0.588 . . . . 0.0 112.026 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.2 mm -67.49 -34.76 70.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 123.849 0.86 . . . . 0.0 111.048 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -58.7 -54.85 42.47 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -58.74 -41.11 85.72 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.649 0.78 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -60.42 -53.4 57.99 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.22 0.918 . . . . 0.0 110.558 179.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.07 -40.46 81.09 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.074 0.55 . . . . 0.0 109.867 -178.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.55 -47.92 65.64 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.77 -0.633 . . . . 0.0 109.712 179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.41 -46.8 76.6 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.41 1.484 . . . . 0.0 110.995 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -62.36 -49.72 74.45 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.713 0.805 . . . . 0.0 110.47 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.08 -41.87 98.62 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.635 1.174 . . . . 0.0 111.253 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -60.8 -32.61 71.96 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.064 0.546 . . . . 0.0 111.896 -179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -61.84 -36.83 82.36 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -73.62 -37.61 65.34 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 -61.14 -33.02 72.74 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.689 -0.632 . . . . 0.0 109.965 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -61.72 -51.31 68.9 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 24.9 tp -62.05 -19.6 63.08 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.284 1.034 . . . . 0.0 112.409 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.39 -15.99 60.41 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.733 0.813 . . . . 0.0 110.013 178.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 37.9 52.96 1.53 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 128.489 2.716 . . . . 0.0 112.68 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -144.82 9.84 1.34 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 114.798 1.406 . . . . 0.0 114.798 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -130.1 155.19 46.59 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 121.051 1.75 . . . . 0.0 109.687 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 p -91.83 -47.17 7.47 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.753 1.221 . . . . 0.0 108.152 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.1 t -157.28 -169.57 2.96 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.38 1.872 . . . . 0.0 107.248 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.4 tt -66.9 -12.74 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 125.635 1.574 . . . . 0.0 110.953 178.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -131.9 158.35 41.6 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 128.341 2.656 . . . . 0.0 105.397 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 m . . . . . 0 C--O 1.256 1.409 0 C-N-CA 127.082 2.153 . . . . 0.0 106.328 179.673 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.548 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 5.2 m -138.38 151.05 47.15 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 123.303 0.641 . . . . 0.0 110.002 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -161.78 117.43 2.04 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 104.783 -2.303 . . . . 0.0 104.783 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -132.44 -15.3 2.83 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 125.782 1.633 . . . . 0.0 110.685 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.79 91.47 3.51 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 103.125 -2.917 . . . . 0.0 103.125 178.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.3 m -148.82 151.5 34.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -102.74 129.61 49.43 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -105.68 155.14 19.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.71 145.91 26.94 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.27 108.6 5.27 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.367 1.867 . . . . 0.0 109.892 -179.045 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.576 HG11 ' HE3' ' D' 1116 ' ' LYS . 54.6 t -155.37 146.37 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.54 1.136 . . . . 0.0 109.372 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -97.27 104.77 16.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.07 108.06 0.5 Allowed Glycine 0 C--O 1.225 -0.45 0 CA-C-O 116.448 -2.306 . . . . 0.0 111.451 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -64.53 -57.23 9.74 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.546 3.173 . . . . 0.0 110.775 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -50.09 66.64 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.927 0.891 . . . . 0.0 109.908 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -56.71 -43.57 80.69 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 118.481 -0.771 . . . . 0.0 112.031 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -61.47 -49.96 74.69 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.225 0.921 . . . . 0.0 109.483 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.62 -53.73 54.28 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 124.04 0.837 . . . . 0.0 112.349 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.34 -58.03 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.601 1.56 . . . . 0.0 110.921 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.31 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 117.606 -1.188 . . . . 0.0 111.184 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -70.25 -44.81 67.72 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 120.821 1.646 . . . . 0.0 108.169 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.04 -47.6 71.4 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 18.5 mt -67.99 -39.54 83.23 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.013 0.925 . . . . 0.0 111.454 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -57.93 -59.07 5.81 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.751 1.62 . . . . 0.0 109.012 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -54.27 -50.3 67.57 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.769 2.028 . . . . 0.0 110.369 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 16.4 m -59.07 -36.25 74.75 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -38.42 64.14 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.097 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.96 -42.75 98.9 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.48 -42.64 99.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.25 -38.11 89.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.64 0.776 . . . . 0.0 110.85 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.63 -38.16 70.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.775 0.83 . . . . 0.0 111.404 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -32.97 28.24 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 65.4 t -93.72 141.28 23.59 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 119.3 0.955 . . . . 0.0 108.524 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -67.72 -164.38 0.1 OUTLIER 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 122.841 2.361 . . . . 0.0 110.389 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -108.77 47.3 0.2 Allowed Pre-proline 0 CA--C 1.555 1.154 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -67.89 -71.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.314 2.676 . . . . 0.0 112.602 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.76 -38.69 79.01 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 7.5 t -52.89 -55.86 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 126.777 2.031 . . . . 0.0 109.975 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -66.01 -43.39 87.84 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.314 1.046 . . . . 0.0 111.583 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.1 t -56.73 -49.92 73.77 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.513 0.725 . . . . 0.0 109.986 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -64.77 -48.79 73.24 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.686 1.594 . . . . 0.0 108.111 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.0 66.3 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.761 1.224 . . . . 0.0 112.098 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.32 -56.62 10.26 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.91 0.777 . . . . 0.0 110.692 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -53.98 -41.39 67.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.096 0.558 . . . . 0.0 110.94 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -69.56 -41.63 75.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.569 1.148 . . . . 0.0 110.261 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -56.96 -31.45 65.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 119.434 1.015 . . . . 0.0 109.871 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.37 -11.49 6.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.15 0.886 . . . . 0.0 112.45 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 tt -76.94 -12.37 59.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.57 1.548 . . . . 0.0 109.638 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -141.13 177.11 8.3 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.577 1.551 . . . . 0.0 110.792 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' ARG . . . . . 0.544 ' H ' ' HD3' ' B' ' 142' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.239 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 121.291 0.567 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.05 -22.1 16.44 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.797 2.439 . . . . 0.0 112.465 -178.068 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.58 7.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 126.38 1.872 . . . . 0.0 114.969 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.92 113.27 4.82 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.261 0.937 . . . . 0.0 109.119 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.59 106.58 8.32 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.373 1.869 . . . . 0.0 110.462 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.07 154.27 19.9 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.025 1.73 . . . . 0.0 109.072 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -119.16 145.32 46.09 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.217 0.917 . . . . 0.0 111.519 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.8 mt -117.79 90.3 35.89 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.711 1.604 . . . . 0.0 110.661 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.0 106.72 2.27 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.952 3.768 . . . . 0.0 110.769 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 15.3 t -139.41 156.91 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.339 1.456 . . . . 0.0 108.917 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.57 101.56 4.83 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 123.156 0.583 . . . . 0.0 110.026 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.87 121.92 1.02 Allowed Glycine 0 CA--C 1.522 0.512 0 N-CA-C 108.363 -1.895 . . . . 0.0 108.363 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -69.19 -51.84 33.96 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.277 2.039 . . . . 0.0 111.255 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -70.7 -33.46 70.91 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.48 0.657 . . . . 0.0 109.465 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 33.1 m -60.1 -51.29 70.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.319 1.448 . . . . 0.0 108.552 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.12 -44.52 95.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.751 1.221 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -55.91 -57.18 13.16 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.6 ppp? -65.24 -39.12 92.28 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.682 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 19.7 tp -60.07 -49.6 77.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.671 -0.681 . . . . 0.0 112.078 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.63 -45.86 88.33 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.594 0.634 . . . . 0.0 109.856 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -55.2 -45.58 75.86 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.266 0.626 . . . . 0.0 111.549 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 25.8 mt -76.27 -46.73 32.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.207 0.603 . . . . 0.0 111.169 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -59.6 -37.24 78.02 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.35 0.66 . . . . 0.0 110.221 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -66.64 -51.97 50.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.3 t -53.44 -51.52 62.4 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.693 0.797 . . . . 0.0 112.131 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.18 -53.64 54.42 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.609 0.764 . . . . 0.0 110.764 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -58.84 -51.03 71.74 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.159 0.584 . . . . 0.0 111.967 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.8 -38.03 89.6 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.655 0.782 . . . . 0.0 111.4 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.2 tmt? -62.04 -46.79 87.58 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -74.93 -20.27 59.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.702 0.683 . . . . 0.0 110.888 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -76.64 -38.09 55.22 Favored 'General case' 0 C--N 1.346 0.445 0 O-C-N 120.568 -1.332 . . . . 0.0 108.396 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 17.5 mt -118.44 76.03 12.61 Favored Pre-proline 0 N--CA 1.467 0.411 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -70.78 0.92 5.67 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.57 2.846 . . . . 0.0 114.91 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -105.32 -58.34 1.91 Allowed 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 119.777 1.171 . . . . 0.0 109.962 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -47.38 -47.92 26.05 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 -177.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.92 71.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.148 1.34 . . . . 0.0 111.281 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.34 -36.95 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.687 1.195 . . . . 0.0 110.45 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.5 -52.46 61.16 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.131 1.772 . . . . 0.0 108.762 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.8 m -64.11 -40.81 97.0 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -56.59 -53.65 55.18 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.409 1.084 . . . . 0.0 109.614 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -63.09 -40.09 96.61 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.444 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -60.75 -48.83 80.05 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.879 0.763 . . . . 0.0 109.031 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -62.09 -50.77 70.6 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.276 1.43 . . . . 0.0 111.283 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -57.02 -43.79 82.21 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.386 1.074 . . . . 0.0 108.978 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -64.66 -54.32 33.63 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.791 0.837 . . . . 0.0 109.3 178.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -53.87 -31.47 49.82 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 112.675 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -55.88 -48.35 75.75 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.557 1.071 . . . . 0.0 108.976 178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -74.27 -35.03 63.74 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.472 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -58.68 -38.42 78.19 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.117 0.872 . . . . 0.0 108.733 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -47.99 83.77 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.853 0.861 . . . . 0.0 110.366 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 50.1 tp -59.46 -22.61 61.78 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.361 0.664 . . . . 0.0 112.219 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.29 -14.0 59.61 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.184 1.394 . . . . 0.0 111.8 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 14.0 mm100 38.57 55.31 1.89 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.57 2.348 . . . . 0.0 112.335 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -132.76 2.13 3.7 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -139.84 153.48 47.06 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 121.551 1.978 . . . . 0.0 108.95 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 3.3 p -80.24 -44.45 19.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.045 0.938 . . . . 0.0 111.233 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 15.8 t -160.02 -165.7 1.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.214 1.006 . . . . 0.0 108.385 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 19.7 tt -63.66 -19.87 25.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.752 2.021 . . . . 0.0 110.994 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -125.4 156.42 38.83 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 127.367 2.267 . . . . 0.0 105.709 178.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 62.6 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 128.101 2.56 . . . . 0.0 105.841 179.55 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 60.3 m -112.54 143.22 44.08 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.048 1.339 . . . . 0.0 108.414 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 28.1 p-10 -164.69 63.65 0.13 Allowed 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.364 1.466 . . . . 0.0 109.369 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -92.16 -23.59 19.35 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.957 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -67.14 100.92 0.82 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.14 147.74 18.13 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -178.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -102.22 128.91 48.54 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.63 160.87 13.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.165 1.386 . . . . 0.0 109.453 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1101 ' ' LEU . . . . . 0.496 HD23 ' H ' ' D' 1102 ' ' GLN . 0.5 OUTLIER -152.8 152.67 31.87 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.409 -1.432 . . . . 0.0 107.893 176.847 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D 1102 ' ' GLN . . . . . 0.496 ' H ' HD23 ' D' 1101 ' ' LEU . 1.1 tm0? -151.39 98.0 2.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.779 1.232 . . . . 0.0 109.032 -177.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 55.2 t -148.73 149.65 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.983 1.713 . . . . 0.0 108.35 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -118.94 102.06 8.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.403 1.456 . . . . 0.0 112.606 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.37 124.93 2.42 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 107.164 -2.374 . . . . 0.0 107.164 176.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -67.3 -57.15 7.18 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 120.641 2.22 . . . . 0.0 110.979 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.58 -47.98 83.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.84 -50.52 63.57 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.482 1.513 . . . . 0.0 112.402 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 66.7 t80 -64.31 -48.01 77.24 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.17 -178.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.84 -53.03 54.61 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.022 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.98 -57.95 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 125.474 1.51 . . . . 0.0 110.597 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.24 -40.05 88.89 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.9 -1.048 . . . . 0.0 111.551 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.5 tmt? -64.1 -48.9 74.33 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 120.418 1.463 . . . . 0.0 109.726 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 14.3 ttmm -53.47 -51.89 61.28 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.492 0.717 . . . . 0.0 109.205 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 40.0 mt -62.7 -42.06 99.44 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.407 1.083 . . . . 0.0 111.57 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1116 ' ' LYS . . . . . 0.576 ' HE3' HG11 ' B' ' 103' ' ' VAL . 39.0 tptt -59.77 -53.3 59.55 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.748 1.219 . . . . 0.0 110.798 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -59.54 -51.38 70.07 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.385 1.474 . . . . 0.0 109.491 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.5 m -54.76 -44.61 73.78 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.09 0.956 . . . . 0.0 112.179 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -36.74 77.94 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.265 0.484 . . . . 0.0 110.988 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.65 -41.29 92.75 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.399 1.0 . . . . 0.0 109.127 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.72 -52.25 58.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.805 1.242 . . . . 0.0 110.376 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.5 -19.87 65.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.235 0.471 . . . . 0.0 111.75 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -79.64 -39.16 32.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.857 1.208 . . . . 0.0 109.065 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -75.62 -28.9 59.01 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 118.245 -0.883 . . . . 0.0 112.61 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.91 147.39 33.87 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.781 0.832 . . . . 0.0 110.057 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.45 -176.53 2.54 Favored 'Trans proline' 0 CA--C 1.547 1.14 0 C-N-CA 123.314 2.676 . . . . 0.0 110.496 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -104.22 40.94 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.256 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.84 -56.76 0.23 Allowed 'Trans proline' 0 C--N 1.355 0.875 0 CA-C-N 124.34 2.586 . . . . 0.0 113.096 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.57 -44.63 90.09 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.193 0.906 . . . . 0.0 108.824 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 t -53.07 -53.46 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 125.544 1.538 . . . . 0.0 110.504 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 7.4 t70 -63.53 -38.51 91.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.154 0.888 . . . . 0.0 111.44 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 21.5 t -62.89 -50.09 72.25 Favored 'General case' 0 N--CA 1.457 -0.119 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -62.14 -42.57 99.37 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -48.02 73.66 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.62 0.768 . . . . 0.0 110.011 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -69.66 -47.79 62.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.175 0.898 . . . . 0.0 110.672 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -55.7 -40.44 72.4 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.814 1.246 . . . . 0.0 111.231 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -80.64 -33.77 35.47 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.058 1.743 . . . . 0.0 110.611 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -60.5 -30.89 70.0 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.483 1.038 . . . . 0.0 108.671 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.3 -20.48 59.34 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.441 0.564 . . . . 0.0 111.956 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.01 -0.41 54.32 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.956 1.302 . . . . 0.0 112.014 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -135.38 178.75 6.79 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.264 1.826 . . . . 0.0 111.465 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.035 0 C-N-CA 125.946 1.698 . . . . 0.0 107.453 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 73.6 m . . . . . 0 CA--C 1.514 -0.405 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -95.73 -32.13 12.88 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -93.42 -50.66 5.34 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 62.8 160.92 0.09 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.162 2.185 . . . . 0.0 110.322 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -81.53 101.54 10.01 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.18 -1.575 . . . . 0.0 107.002 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.64 168.79 11.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.711 1.205 . . . . 0.0 108.602 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -133.26 138.28 46.39 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.919 1.288 . . . . 0.0 108.653 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.8 90.43 48.37 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 124.823 1.249 . . . . 0.0 111.966 -178.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.74 112.39 2.66 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 124.5 3.467 . . . . 0.0 111.806 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.7 t -144.71 152.96 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.554 1.141 . . . . 0.0 108.501 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -135.18 100.88 4.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.67 1.123 . . . . 0.0 108.858 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.99 124.21 1.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-O 116.343 -2.365 . . . . 0.0 107.356 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -66.16 -51.09 61.11 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 121.399 2.6 . . . . 0.0 110.055 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.02 -41.65 92.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.202 1.001 . . . . 0.0 111.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -64.81 -50.0 68.47 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.125 1.37 . . . . 0.0 108.692 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -56.92 -51.82 67.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.643 -0.694 . . . . 0.0 111.028 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -55.3 -54.87 38.05 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 124.159 0.912 . . . . 0.0 111.942 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.434 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 37.6 ttm -59.55 -50.45 73.85 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.488 0.315 . . . . 0.0 111.391 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.82 -41.69 91.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.854 0.862 . . . . 0.0 110.813 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 tt -68.05 -45.72 73.1 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.46 -40.16 81.91 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.949 0.795 . . . . 0.0 111.512 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mt -72.77 -43.64 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -59.26 -46.23 89.06 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.545 -0.722 . . . . 0.0 109.316 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -56.03 -55.21 35.57 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.935 1.694 . . . . 0.0 109.65 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 p -64.18 -44.32 92.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.04 -47.88 84.34 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 118.669 0.668 . . . . 0.0 109.88 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -62.13 -43.57 98.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.502 HD21 HG22 ' B' ' 130' ' ' VAL . 0.6 OUTLIER -55.02 -49.92 70.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 118.733 0.697 . . . . 0.0 111.324 -179.769 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.0 ttm -57.4 -37.17 72.29 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.72 -34.55 64.85 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.022 -1.049 . . . . 0.0 111.628 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.43 ' C ' HD22 ' A' ' 32' ' ' LEU . 32.0 m-85 -77.07 -30.85 55.71 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.606 1.094 . . . . 0.0 110.894 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.43 HD22 ' C ' ' A' ' 31' ' ' TYR . 2.6 mm? -123.96 69.12 46.94 Favored Pre-proline 0 CA--C 1.539 0.532 0 C-N-CA 126.68 1.992 . . . . 0.0 107.896 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -72.58 -6.26 18.72 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.331 2.021 . . . . 0.0 113.982 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -129.93 -47.38 1.13 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.982 -178.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -51.81 -51.9 53.05 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.447 1.099 . . . . 0.0 112.786 -178.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 m -61.73 -45.54 93.5 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.086 -1.008 . . . . 0.0 109.359 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 9.1 mm -63.47 -41.07 91.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 123.837 0.855 . . . . 0.0 110.578 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.9 -36.92 78.01 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.609 1.564 . . . . 0.0 109.726 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.5 m -68.52 -52.39 32.66 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -60.36 -36.07 77.16 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.309 1.044 . . . . 0.0 111.55 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -48.96 76.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.684 1.194 . . . . 0.0 108.712 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -67.22 -55.88 12.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 118.499 -0.762 . . . . 0.0 111.205 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.92 -54.76 34.28 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.425 1.09 . . . . 0.0 111.576 -178.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.39 -39.55 93.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.516 -0.754 . . . . 0.0 111.373 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -64.02 -49.81 70.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.833 0.742 . . . . 0.0 109.347 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -60.09 -44.89 94.48 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.798 0.726 . . . . 0.0 110.03 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.7 -50.91 72.14 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.245 1.018 . . . . 0.0 109.47 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -63.76 -43.56 96.06 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.291 0.636 . . . . 0.0 110.963 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.59 -43.27 99.22 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.725 1.21 . . . . 0.0 110.729 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -65.02 -21.12 66.79 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.968 0.804 . . . . 0.0 112.503 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 37.8 tp -93.2 -46.5 7.38 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.755 1.222 . . . . 0.0 109.921 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.85 -55.73 15.55 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 124.63 1.172 . . . . 0.0 110.126 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 52.04 4.68 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 130.589 3.556 . . . . 0.0 115.599 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -112.3 154.14 26.12 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 127.118 2.167 . . . . 0.0 107.108 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -74.12 -52.19 13.31 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.8 m 56.94 78.56 0.22 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.272 1.429 . . . . 0.0 109.752 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.8 m -152.71 174.98 13.33 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.221 1.408 . . . . 0.0 108.078 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.4 mm -71.39 -18.05 20.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 124.134 0.974 . . . . 0.0 111.71 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -133.22 151.48 51.93 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 119.191 0.905 . . . . 0.0 109.403 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.9 m . . . . . 0 C--O 1.251 1.141 0 C-N-CA 124.83 1.252 . . . . 0.0 109.514 178.439 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.683 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 3.0 p -138.56 160.42 39.63 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -133.52 -46.25 0.82 Allowed 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 118.651 0.66 . . . . 0.0 109.673 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -73.08 -36.95 66.92 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 177.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 38.2 t0 65.74 -63.74 0.21 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 130.131 3.372 . . . . 0.0 108.476 -178.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 96.8 m -71.38 125.24 26.48 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 177.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -102.1 150.93 22.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -123.56 137.14 54.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.52 1.128 . . . . 0.0 109.777 -177.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 19.7 tp -139.68 149.83 44.16 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 123.387 0.675 . . . . 0.0 110.805 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -145.68 108.29 4.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.367 -2.457 . . . . 0.0 104.367 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 m -149.66 150.67 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.804 1.184 . . . . 0.0 112.153 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.42 102.14 10.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.67 114.42 0.82 Allowed Glycine 0 C--O 1.227 -0.316 0 CA-C-O 116.006 -2.552 . . . . 0.0 109.873 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -68.05 -57.44 6.12 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 122.489 3.144 . . . . 0.0 108.404 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -70.3 -49.88 45.06 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.14 -51.32 58.65 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.059 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -67.12 -36.52 82.08 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.958 1.254 . . . . 0.0 111.682 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -60.71 -54.14 48.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 120.003 1.274 . . . . 0.0 110.768 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.77 -51.08 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 125.745 1.618 . . . . 0.0 110.611 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.3 mt -60.41 -33.88 73.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.718 -179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -45.92 70.21 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.771 1.623 . . . . 0.0 108.212 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 114' ' ' LYS . . . . . 0.45 ' HE3' ' HE2' ' C' 1018 ' ' MET . 29.1 ttpt -55.83 -49.49 73.13 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 30.7 mt -60.43 -36.34 77.96 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-O 119.009 -0.52 . . . . 0.0 110.97 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -59.99 4.46 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 119.477 1.035 . . . . 0.0 109.149 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -62.05 -43.81 98.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.619 -0.705 . . . . 0.0 111.423 -178.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 4.1 t -58.05 -45.29 87.27 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.405 1.002 . . . . 0.0 111.501 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -69.56 -46.34 66.63 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 117.846 -1.073 . . . . 0.0 109.679 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -57.01 -49.34 76.09 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.051 0.841 . . . . 0.0 109.939 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.51 -50.72 72.75 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 123.808 0.843 . . . . 0.0 110.726 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -69.6 -18.87 63.65 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -83.57 -47.38 11.36 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.034 1.334 . . . . 0.0 108.976 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.79 -32.67 72.56 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.699 -179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 77.6 t -92.76 144.51 28.71 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -67.61 -176.76 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.08 2.52 . . . . 0.0 111.274 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -111.5 48.37 0.29 Allowed Pre-proline 0 CA--C 1.551 1.0 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.93 -57.46 0.13 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.251 1.967 . . . . 0.0 113.782 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.7 tt -63.38 -31.96 73.26 Favored 'General case' 0 C--N 1.349 0.546 0 O-C-N 120.627 -1.296 . . . . 0.0 110.952 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.502 HG22 HD21 ' A' ' 28' ' ' LEU . 3.0 t -51.8 -56.78 4.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 C-N-CA 124.226 1.01 . . . . 0.0 111.943 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -73.9 -31.49 63.12 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.406 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.2 m -61.06 -47.88 84.32 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 122.398 1.094 . . . . 0.0 108.088 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -66.98 -38.36 85.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.466 1.506 . . . . 0.0 108.409 178.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -46.99 84.37 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.96 0.904 . . . . 0.0 109.188 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -59.03 -46.41 88.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -44.66 89.04 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.41 0.684 . . . . 0.0 110.906 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -35.36 73.71 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.169 0.987 . . . . 0.0 110.076 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -56.21 -40.31 73.85 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.2 -18.29 63.34 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.562 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp -72.58 -49.68 30.66 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.904 1.229 . . . . 0.0 110.154 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -140.91 105.97 4.98 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 126.207 1.803 . . . . 0.0 109.493 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ttt85 . . . . . 0 C--O 1.256 1.414 0 C-N-CA 124.045 0.938 . . . . 0.0 108.68 178.75 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -103.43 -7.67 20.77 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.342 1.057 . . . . 0.0 112.451 -177.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -108.71 -50.12 3.06 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.8 tp10 78.19 158.82 0.19 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 129.853 3.261 . . . . 0.0 110.727 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 33.7 tp -76.54 95.49 3.91 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 103.968 -2.605 . . . . 0.0 103.968 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 58.4 mt -89.54 124.64 34.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 124.35 1.06 . . . . 0.0 108.222 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -104.57 125.93 51.18 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 128.917 2.887 . . . . 0.0 108.1 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.95 92.01 19.75 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.244 1.417 . . . . 0.0 109.641 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.24 118.17 4.86 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.648 2.232 . . . . 0.0 107.501 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 22.0 t -145.15 155.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 119.706 1.139 . . . . 0.0 109.978 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -134.98 102.58 5.27 Favored 'General case' 0 C--N 1.343 0.312 0 O-C-N 121.214 -0.929 . . . . 0.0 109.134 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.37 116.83 0.7 Allowed Glycine 0 CA--C 1.519 0.31 0 CA-C-O 115.496 -2.836 . . . . 0.0 107.001 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.4 tpp85 -61.98 -51.82 66.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.697 2.749 . . . . 0.0 111.976 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -69.2 -41.07 77.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.868 0.758 . . . . 0.0 109.502 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -55.47 -46.49 76.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.3 t80 -65.57 -47.93 74.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.54 0.736 . . . . 0.0 109.998 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -53.18 -50.71 64.07 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.774 1.23 . . . . 0.0 110.69 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1018 ' ' MET . . . . . 0.45 ' HE2' ' HE3' ' B' ' 114' ' ' LYS . 3.1 tmm? -69.33 -43.16 74.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.314 0.646 . . . . 0.0 111.41 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.12 -46.55 89.26 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.735 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.25 -46.33 81.01 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 119.268 0.94 . . . . 0.0 111.612 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -54.98 -44.46 74.47 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.111 0.868 . . . . 0.0 110.335 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.5 mt -72.63 -44.11 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.839 1.256 . . . . 0.0 111.166 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -57.77 -49.08 77.78 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.847 0.859 . . . . 0.0 109.34 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.25 -45.45 80.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.305 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.7 p -61.08 -40.6 94.3 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 120.328 1.422 . . . . 0.0 111.536 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 64.4 mt -67.87 -46.32 72.02 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.124 0.97 . . . . 0.0 109.471 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.18 -44.18 97.18 Favored 'General case' 0 C--O 1.224 -0.264 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1028 ' ' LEU . . . . . 0.525 HD13 HD23 ' C' 1032 ' ' LEU . 1.4 mm? -57.95 -44.3 86.88 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 119.12 0.873 . . . . 0.0 110.515 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 4.6 ttm -57.19 -36.07 70.37 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -76.96 -37.17 55.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.365 -1.302 . . . . 0.0 111.669 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1031 ' ' TYR . . . . . 0.468 ' C ' HD22 ' C' 1032 ' ' LEU . 52.5 m-85 -83.1 -19.59 36.47 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 120.942 1.701 . . . . 0.0 113.667 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C 1032 ' ' LEU . . . . . 0.525 HD23 HD13 ' C' 1028 ' ' LEU . 1.9 mm? -124.55 65.2 42.15 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -68.08 -20.15 44.45 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.838 2.359 . . . . 0.0 115.282 -178.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -121.78 -41.0 2.49 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 119.7 1.136 . . . . 0.0 111.56 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -52.26 -52.64 51.51 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.218 0.917 . . . . 0.0 113.371 -178.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.18 -43.18 96.08 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.126 -0.984 . . . . 0.0 110.373 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 13.0 mm -63.93 -34.33 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.369 1.068 . . . . 0.0 109.808 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -69.56 -44.34 71.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.246 1.018 . . . . 0.0 108.892 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.3 m -62.94 -46.74 86.32 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.1 t80 -59.24 -50.36 74.29 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.247 1.419 . . . . 0.0 111.226 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 tpp85 -56.43 -48.48 76.91 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.923 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -57.26 -55.73 31.03 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.313 0.96 . . . . 0.0 109.585 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.96 -54.36 39.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.846 1.259 . . . . 0.0 112.968 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -65.23 -47.01 78.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.118 1.367 . . . . 0.0 111.592 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -56.62 -47.17 80.26 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.589 1.156 . . . . 0.0 108.231 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -61.64 -54.34 44.15 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.576 1.15 . . . . 0.0 110.471 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -53.72 -53.43 52.19 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 125.086 1.354 . . . . 0.0 112.003 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 8.6 t60 -68.61 -43.85 75.53 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.654 -0.688 . . . . 0.0 111.605 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -61.15 -38.95 88.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 119.885 1.221 . . . . 0.0 110.806 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -70.45 -20.17 62.91 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.831 0.452 . . . . 0.0 112.007 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 41.5 tp -85.04 -44.79 12.73 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.366 1.066 . . . . 0.0 109.939 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 57.2 tp -76.55 -51.28 11.98 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.559 0.744 . . . . 0.0 110.326 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 34.2 tt0 52.05 15.7 0.45 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.835 2.454 . . . . 0.0 114.234 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 31.0 mttp -131.95 121.43 23.95 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 125.506 1.523 . . . . 0.0 107.421 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -45.43 -42.91 10.88 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.691 1.196 . . . . 0.0 112.975 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 3.8 m 46.38 78.64 0.07 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.774 2.03 . . . . 0.0 111.822 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 68.6 m -150.86 172.48 15.57 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.915 1.286 . . . . 0.0 107.699 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 33.8 mm -69.41 -11.58 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 C-N-CA 124.081 0.952 . . . . 0.0 111.306 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -139.55 158.41 44.18 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.201 1.401 . . . . 0.0 108.828 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.407 1.483 . . . . 0.0 108.309 178.13 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.525 0 N-CA-C 108.554 -1.818 . . . . 0.0 108.554 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 14.4 p -68.68 141.78 55.23 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -88.39 -59.34 2.26 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -87.9 -27.43 22.18 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . 0.283 12.5 t70 68.67 -56.35 0.52 Allowed 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 129.39 3.076 . . . . 0.0 110.139 -177.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.17 140.67 32.44 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 126.347 1.859 . . . . 0.0 107.581 177.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -131.4 158.33 41.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.846 1.258 . . . . 0.0 109.069 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -124.44 160.58 27.9 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.152 1.381 . . . . 0.0 110.352 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 13.4 tp -159.88 139.01 10.93 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.585 1.154 . . . . 0.0 108.496 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -138.97 98.07 3.45 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 30.4 m -145.45 151.72 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 O-C-N 120.683 -1.26 . . . . 0.0 114.254 -176.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.14 103.48 12.69 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.45 100.56 0.24 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 103.661 -3.776 . . . . 0.0 103.661 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -61.82 -57.49 11.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 122.474 3.137 . . . . 0.0 112.803 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 6.5 mttp -66.34 -38.73 88.33 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.376 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -59.39 -51.76 68.51 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.67 -1.157 . . . . 0.0 111.36 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1109 ' ' PHE . . . . . 0.413 ' CZ ' ' HG3' ' D' 1113 ' ' MET . 84.2 t80 -60.84 -42.1 97.13 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 120.247 1.385 . . . . 0.0 110.333 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.45 -53.71 52.9 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.469 0.652 . . . . 0.0 110.068 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.96 -54.04 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 125.562 1.545 . . . . 0.0 110.607 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.11 -38.86 74.02 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.488 1.515 . . . . 0.0 111.186 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1113 ' ' MET . . . . . 0.413 ' HG3' ' CZ ' ' D' 1109 ' ' PHE . 0.0 OUTLIER -71.74 -43.99 64.86 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.213 1.369 . . . . 0.0 109.577 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D 1114 ' ' LYS . . . . . 0.434 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 8.8 ttpt -56.9 -44.74 82.66 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 68.9 mt -63.46 -36.09 82.6 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.869 0.868 . . . . 0.0 111.248 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -60.03 4.47 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.215 -0.928 . . . . 0.0 108.68 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -64.4 -29.37 70.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.368 0.267 . . . . 0.0 111.081 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 17.8 t -64.45 -47.68 78.17 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.842 0.747 . . . . 0.0 110.088 178.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.51 -44.3 58.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 116.959 -1.496 . . . . 0.0 111.979 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -59.28 -41.24 88.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.952 1.705 . . . . 0.0 110.827 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.1 mm? -66.33 -50.6 63.04 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 3.5 ttt -61.76 -27.4 68.7 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.31 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -78.6 -37.07 43.33 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.345 1.458 . . . . 0.0 111.773 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -79.43 -27.9 41.71 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 118.362 -0.828 . . . . 0.0 112.257 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.25 147.14 33.98 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 118.735 0.698 . . . . 0.0 109.988 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.92 -175.16 0.55 Allowed 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.243 2.629 . . . . 0.0 109.378 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.272 7.2 pt20 -111.63 51.18 0.34 Allowed Pre-proline 0 CA--C 1.557 1.232 0 O-C-N 120.039 -1.663 . . . . 0.0 114.425 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.42 -65.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.462 2.775 . . . . 0.0 113.127 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.15 -30.43 71.49 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.708 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -58.92 -55.79 21.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.814 1.246 . . . . 0.0 110.367 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 45.2 t0 -63.63 -40.71 97.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.649 0.659 . . . . 0.0 110.483 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 19.9 m -60.13 -50.4 73.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.327 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.7 t80 -62.96 -42.92 99.97 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.89 1.276 . . . . 0.0 110.39 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -45.61 70.44 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -69.03 -52.88 24.02 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.577 0.751 . . . . 0.0 110.512 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -50.47 -47.51 57.04 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.027 1.731 . . . . 0.0 111.183 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.72 -38.99 62.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.547 1.139 . . . . 0.0 109.281 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.5 -32.39 39.92 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.495 1.043 . . . . 0.0 110.882 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -56.98 -23.55 46.72 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 118.684 0.675 . . . . 0.0 112.171 177.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 32.2 tp -77.38 -40.95 41.96 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.485 1.493 . . . . 0.0 112.898 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -137.65 107.3 6.21 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 125.477 1.511 . . . . 0.0 107.598 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 . . . . . 0 C--O 1.252 1.219 0 C-N-CA 123.672 0.789 . . . . 0.0 110.464 -179.675 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.2 m . . . . . 0 N--CA 1.463 0.202 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -102.87 -83.77 0.47 Allowed 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.64 -35.5 11.58 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.447 0.699 . . . . 0.0 111.785 -179.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 76.01 167.93 0.27 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 127.239 2.215 . . . . 0.0 110.582 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.3 tp -79.38 95.24 5.69 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.1 mt -95.52 140.73 29.94 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -112.21 144.11 42.15 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.774 1.63 . . . . 0.0 107.902 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.4 tp -130.39 94.04 30.99 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 124.596 1.158 . . . . 0.0 109.546 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -78.58 121.26 5.07 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 109.356 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.4 t -144.78 156.08 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.03 1.286 . . . . 0.0 108.719 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -133.03 102.17 5.5 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.99 110.58 0.41 Allowed Glycine 0 C--O 1.219 -0.84 0 CA-C-O 115.839 -2.645 . . . . 0.0 107.526 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.32 65.29 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 122.94 3.37 . . . . 0.0 109.1 178.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -67.05 -46.84 73.14 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -36.85 84.8 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.925 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -71.11 -43.9 66.73 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 120.189 1.359 . . . . 0.0 108.672 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.14 -49.8 76.21 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.511 1.051 . . . . 0.0 109.308 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.4 ttp -57.22 -46.77 82.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.882 0.473 . . . . 0.0 109.82 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.54 -38.97 93.17 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 123.921 0.888 . . . . 0.0 110.027 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.37 -47.13 71.29 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 119.297 0.953 . . . . 0.0 109.718 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -48.95 74.01 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.582 0.753 . . . . 0.0 110.501 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.3 mt -73.01 -33.45 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.185 0.994 . . . . 0.0 110.957 -178.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -67.58 -56.9 7.62 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.57 -38.94 72.64 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.058 2.143 . . . . 0.0 110.426 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -61.19 -52.52 64.48 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.405 -0.807 . . . . 0.0 110.838 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -39.27 61.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.012 0.824 . . . . 0.0 111.851 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.79 -54.47 46.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.827 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.21 -41.45 77.05 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 117.97 -1.015 . . . . 0.0 110.264 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -57.86 -38.99 76.68 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.247 0.931 . . . . 0.0 110.668 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -79.53 -20.63 46.66 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.328 0.513 . . . . 0.0 110.119 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -82.59 -39.56 22.06 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.984 -1.072 . . . . 0.0 112.103 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.3 tp -122.38 76.06 43.66 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.876 1.67 . . . . 0.0 109.933 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -78.13 73.92 5.55 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 123.516 2.811 . . . . 0.0 111.914 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.86 170.49 2.05 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 121.177 -0.952 . . . . 0.0 109.273 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -60.6 -24.61 65.62 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.5 m -54.8 -51.16 66.65 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.165 2.186 . . . . 0.0 109.031 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.48 -45.87 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 125.607 1.563 . . . . 0.0 109.733 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.97 -55.6 32.06 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.817 0.447 . . . . 0.0 111.845 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -62.0 -43.01 99.74 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.42 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -58.02 -49.55 76.48 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 119.494 1.043 . . . . 0.0 108.9 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.97 -48.2 82.69 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.193 1.397 . . . . 0.0 111.725 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -59.85 -56.55 20.36 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.477 1.111 . . . . 0.0 110.091 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -58.48 -43.95 89.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.155 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -52.86 -46.75 68.01 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.163 0.985 . . . . 0.0 111.95 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.12 -53.9 38.11 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.009 0.524 . . . . 0.0 111.016 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -62.1 -32.66 73.24 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.011 0.434 . . . . 0.0 110.84 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -66.78 -45.58 78.02 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.648 1.579 . . . . 0.0 109.951 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -53.93 -50.52 66.25 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.163 0.892 . . . . 0.0 111.083 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -58.16 -29.85 65.9 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -83.74 -46.4 12.29 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.15 0.98 . . . . 0.0 111.044 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.0 mp -58.23 -55.46 34.67 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 124.568 1.147 . . . . 0.0 111.082 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 52.4 tp -53.8 -75.59 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.305 1.442 . . . . 0.0 113.606 -178.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -158.13 151.46 23.2 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.347 -0.846 . . . . 0.0 112.028 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -77.49 -25.53 50.49 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.963 0.905 . . . . 0.0 110.203 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -169.27 -65.99 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 129.336 3.055 . . . . 0.0 104.503 178.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 14.4 t -164.52 165.86 20.9 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.008 2.123 . . . . 0.0 106.314 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.9 m 33.49 -152.96 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 129.196 2.998 . . . . 0.0 116.146 178.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.7 pt -78.34 -30.26 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 124.826 1.25 . . . . 0.0 109.888 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -146.36 159.28 43.57 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 129.146 2.978 . . . . 0.0 105.685 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 54.7 p . . . . . 0 C--O 1.255 1.348 0 CA-C-O 113.64 -3.076 . . . . 0.0 104.289 179.403 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.542 0 N-CA-C 111.399 -0.681 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.0 t -174.61 -176.33 1.04 Allowed 'General case' 0 C--O 1.236 0.352 0 C-N-CA 126.998 2.119 . . . . 0.0 107.162 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.52 159.99 29.87 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 104.438 -2.43 . . . . 0.0 104.438 176.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -131.4 18.98 4.81 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.5 1.12 . . . . 0.0 110.152 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -132.33 153.07 51.1 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.799 0.839 . . . . 0.0 109.78 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.7 m -79.2 158.05 27.72 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -106.03 150.68 25.51 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -128.58 140.15 51.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.511 1.125 . . . . 0.0 110.718 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.5 mt -133.21 110.12 9.9 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -110.29 98.59 7.8 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 128.503 2.721 . . . . 0.0 105.808 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -154.41 151.17 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.226 1.41 . . . . 0.0 109.012 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.33 101.27 7.27 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.685 0.675 . . . . 0.0 110.813 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.19 105.42 0.39 Allowed Glycine 0 C--O 1.228 -0.28 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -53.79 -54.15 42.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 121.586 2.693 . . . . 0.0 112.918 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.89 -40.65 89.45 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.868 0.758 . . . . 0.0 109.854 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -60.18 -50.58 73.13 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.154 -0.926 . . . . 0.0 110.539 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' PHE . . . . . 0.415 ' CD2' ' HB3' ' D' 1099 ' ' TYR . 31.8 t80 -54.33 -46.04 72.8 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 119.256 0.935 . . . . 0.0 111.194 -178.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -61.74 -53.74 51.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.34 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 45.2 mt -58.05 -52.54 57.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.985 1.714 . . . . 0.0 110.543 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 73.6 mt -65.76 -32.28 73.73 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.154 1.381 . . . . 0.0 111.885 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 24.3 mtp -68.24 -54.56 16.85 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.85 1.205 . . . . 0.0 109.433 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -60.71 -35.95 77.62 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.674 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.95 -54.77 11.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 117.836 -1.078 . . . . 0.0 110.697 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 5.3 tptp -58.16 -40.83 82.42 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 121.059 1.754 . . . . 0.0 110.018 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.5 -58.53 7.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 126.322 1.849 . . . . 0.0 106.39 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 90.2 p -57.68 -36.16 71.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.3 -42.77 65.11 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.17 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -64.84 -40.03 94.52 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.012 1.278 . . . . 0.0 107.583 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 44.6 mt -64.24 -46.16 85.0 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.026 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -71.2 -19.08 62.43 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.312 0.96 . . . . 0.0 110.7 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -89.08 -42.79 11.51 Favored 'General case' 0 C--N 1.343 0.323 0 O-C-N 121.01 -1.056 . . . . 0.0 113.225 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -76.3 -33.01 59.07 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.0 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -95.5 147.56 33.2 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 178.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -71.68 177.89 6.36 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.508 1.472 . . . . 0.0 110.382 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -112.17 50.85 0.37 Allowed Pre-proline 0 CA--C 1.554 1.099 0 O-C-N 121.08 -1.013 . . . . 0.0 112.389 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.37 -57.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.732 2.288 . . . . 0.0 113.292 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.2 tt -65.33 -33.52 76.16 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 119.992 1.269 . . . . 0.0 109.206 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 40.2 t -54.36 -56.33 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.851 1.661 . . . . 0.0 109.228 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.59 -47.35 85.88 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.81 0.844 . . . . 0.0 111.233 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 30.1 t -54.75 -50.78 67.58 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 0.0 110.442 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -68.55 -44.08 75.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.87 1.268 . . . . 0.0 111.019 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -54.96 -46.0 74.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 118.822 0.737 . . . . 0.0 109.729 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -65.81 -49.63 67.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.448 0.567 . . . . 0.0 110.917 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -57.28 -44.77 84.29 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.229 0.612 . . . . 0.0 111.673 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.69 -29.82 61.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.882 0.873 . . . . 0.0 109.547 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -61.75 -32.83 73.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -6.0 3.62 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.07 1.348 . . . . 0.0 113.021 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 4.7 tt -76.5 -49.34 16.75 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -90.93 178.2 6.09 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.923 2.089 . . . . 0.0 111.328 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 117.644 -1.17 . . . . 0.0 108.815 -179.65 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.468 0.448 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.87 -74.12 0.41 Allowed 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -100.88 -50.48 3.82 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.867 0.758 . . . . 0.0 109.976 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.5 tp10 75.24 163.84 0.26 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 127.503 2.321 . . . . 0.0 110.894 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 67.2 tp -78.47 95.21 5.08 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 42.8 mt -90.52 153.75 20.13 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -123.29 142.31 51.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.584 1.154 . . . . 0.0 108.921 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 41.7 tp -134.11 94.89 17.43 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.11 0.964 . . . . 0.0 111.182 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.18 130.03 9.05 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.432 2.755 . . . . 0.0 109.964 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 2.4 t -145.78 152.04 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.602 1.161 . . . . 0.0 108.478 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -134.91 101.83 5.03 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 177.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.57 117.01 0.7 Allowed Glycine 0 CA--C 1.519 0.328 0 N-CA-C 105.402 -3.079 . . . . 0.0 105.402 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -52.41 58.85 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 122.067 2.934 . . . . 0.0 110.968 -179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.95 -41.14 78.43 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 54.0 m -58.27 -48.03 81.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 118.316 -0.849 . . . . 0.0 109.964 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.4 t80 -58.54 -50.59 73.21 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 119.147 0.885 . . . . 0.0 110.145 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.0 -48.8 78.72 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 ttt -58.69 -49.34 77.93 Favored 'General case' 0 N--CA 1.46 0.066 0 C-N-CA 124.754 1.222 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.86 -50.28 73.85 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.385 1.074 . . . . 0.0 109.132 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -55.86 28.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.011 0.924 . . . . 0.0 111.15 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -55.6 -48.52 74.75 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.676 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 76.7 mt -67.0 -43.93 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.669 -0.644 . . . . 0.0 111.176 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.16 -52.28 59.77 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 123.786 0.835 . . . . 0.0 111.539 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -66.92 -35.11 79.25 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.258 1.023 . . . . 0.0 110.044 -179.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 4.8 t -56.05 -51.77 66.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -48.27 80.17 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 123.193 0.308 . . . . 0.0 110.663 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -57.06 -54.62 44.68 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.51 0.724 . . . . 0.0 111.989 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.43 -41.4 84.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 119.342 0.974 . . . . 0.0 112.344 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -44.6 92.8 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 -22.99 46.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.733 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 t80 -79.14 -33.45 44.16 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.117 1.326 . . . . 0.0 111.311 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 49.8 tp -129.1 74.22 81.26 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -77.55 77.83 3.73 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.166 2.577 . . . . 0.0 110.57 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1034 ' ' GLN . . . . . 0.495 ' N ' HD13 ' C' 1037 ' ' ILE . 53.8 mt-30 -63.51 174.55 1.27 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.349 1.46 . . . . 0.0 109.875 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 38.3 m80 -54.99 -32.83 62.02 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.245 -0.91 . . . . 0.0 112.934 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.6 m -61.27 -49.39 77.27 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 120.117 1.326 . . . . 0.0 109.451 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1037 ' ' ILE . . . . . 0.608 ' H ' HD12 ' C' 1037 ' ' ILE . 2.2 mp -59.21 -42.95 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 126.342 1.857 . . . . 0.0 109.526 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.73 -59.41 4.93 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.676 1.19 . . . . 0.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.3 m -60.1 -52.74 64.05 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.153 1.381 . . . . 0.0 111.897 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.27 -50.33 69.8 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.466 0.706 . . . . 0.0 112.37 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -61.13 -44.7 96.94 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 118.887 0.767 . . . . 0.0 111.641 -179.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -61.93 -48.91 78.32 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -64.55 -36.24 83.56 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-O 116.984 -1.484 . . . . 0.0 111.127 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -60.46 -42.33 95.95 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 120.92 1.691 . . . . 0.0 108.239 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -47.6 84.89 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 118.997 0.817 . . . . 0.0 110.598 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -68.94 -54.11 17.2 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 123.41 0.444 . . . . 0.0 110.647 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -55.75 -42.59 75.62 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 126.23 1.812 . . . . 0.0 111.294 -179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -52.87 -49.77 65.16 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.115 1.325 . . . . 0.0 109.112 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -57.06 -43.46 82.05 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.14 0.976 . . . . 0.0 110.864 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -72.21 -43.63 64.19 Favored 'General case' 0 C--O 1.234 0.268 0 O-C-N 121.787 -0.57 . . . . 0.0 112.523 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.93 -23.07 66.12 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.091 1.356 . . . . 0.0 111.873 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 11.2 tp -74.18 -79.03 0.09 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -167.88 179.69 4.6 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.236 1.414 . . . . 0.0 109.424 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.43 -48.75 5.45 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -138.51 -78.57 0.35 Allowed 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 103.604 -2.739 . . . . 0.0 103.604 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 12.5 t -157.51 172.46 18.52 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.348 1.059 . . . . 0.0 108.287 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 6.4 m 25.33 -107.82 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 131.546 3.938 . . . . 0.0 112.904 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 42.4 pt -122.61 -24.09 2.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.143 1.377 . . . . 0.0 111.202 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -146.15 159.18 43.66 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 128.528 2.731 . . . . 0.0 105.527 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 46.5 p . . . . . 0 C--O 1.255 1.393 0 CA-C-O 113.921 -2.942 . . . . 0.0 105.6 179.819 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.85 0 N-CA-C 108.983 -1.647 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 2.1 t -149.89 169.87 20.13 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 105.204 -2.147 . . . . 0.0 105.204 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.91 147.42 50.36 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -108.33 21.63 17.05 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 126.029 1.732 . . . . 0.0 111.842 -178.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 1.4 t0 -138.02 164.87 27.98 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 113.442 0.905 . . . . 0.0 113.442 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 80.6 m -86.86 167.24 14.52 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.009 1.723 . . . . 0.0 111.12 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1099 ' ' TYR . . . . . 0.415 ' HB3' ' CD2' ' B' ' 109' ' ' PHE . 67.8 m-85 -120.38 143.12 48.59 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -126.83 142.94 51.41 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.777 1.231 . . . . 0.0 110.677 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 90.4 mt -129.86 140.97 50.89 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -136.87 98.44 3.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.423 1.077 . . . . 0.0 108.117 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.6 m -153.19 151.51 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.944 1.298 . . . . 0.0 111.671 -177.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.33 102.79 10.18 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.374 0.988 . . . . 0.0 111.604 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.25 116.81 0.99 Allowed Glycine 0 C--O 1.229 -0.168 0 CA-C-O 115.636 -2.758 . . . . 0.0 107.886 177.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.78 -56.93 11.81 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 122.521 3.16 . . . . 0.0 111.592 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.84 -43.8 97.83 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 14.7 m120 -54.13 -47.88 71.39 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 117.671 -1.156 . . . . 0.0 112.038 -178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.1 t80 -64.5 -46.25 83.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.524 1.056 . . . . 0.0 109.856 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.98 -52.39 65.7 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.537 1.062 . . . . 0.0 111.408 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.16 -48.61 84.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 126.971 2.108 . . . . 0.0 111.825 -178.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 53.8 mt -67.72 -36.14 80.06 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.901 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 68.8 mtp -65.45 -53.2 46.32 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 119.999 1.272 . . . . 0.0 109.729 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -56.37 -40.72 75.01 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.359 0.981 . . . . 0.0 111.276 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 38.6 mt -74.24 -41.0 62.03 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1116 ' ' LYS . . . . . 0.568 ' HZ1' ' HG2' ' D' 1120 ' ' GLU . 3.1 tptp -65.7 -43.44 89.17 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.476 -1.39 . . . . 0.0 107.941 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -59.47 -52.86 63.76 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.482 1.513 . . . . 0.0 108.021 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 84.2 p -60.6 -34.64 74.53 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.008 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1119 ' ' LEU . . . . . 0.42 HD13 ' HA ' ' D' 1119 ' ' LEU . 0.8 OUTLIER -69.07 -36.98 78.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.233 0.924 . . . . 0.0 109.489 179.035 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D 1120 ' ' GLU . . . . . 0.568 ' HG2' ' HZ1' ' D' 1116 ' ' LYS . 0.6 OUTLIER -64.71 -52.48 56.9 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.238 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 43.3 mt -57.8 -47.12 83.49 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.135 1.774 . . . . 0.0 112.122 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.0 ppp? -76.49 -24.61 53.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 120.074 1.306 . . . . 0.0 112.749 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -80.44 -42.9 21.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.115 0.87 . . . . 0.0 110.049 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.3 -32.24 38.07 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -178.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.77 149.07 35.86 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.766 1.226 . . . . 0.0 107.916 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -65.36 167.95 15.52 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 121.339 1.359 . . . . 0.0 110.954 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -118.79 57.05 3.1 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 124.507 1.123 . . . . 0.0 113.113 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -70.51 -64.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.25 2.633 . . . . 0.0 112.826 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.7 tt -58.81 -33.78 70.76 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.868 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.8 t -52.2 -53.52 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 C-N-CA 124.154 0.982 . . . . 0.0 110.054 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 35.5 t0 -70.52 -41.17 72.91 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.202 0.91 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 14.5 t -54.82 -49.82 70.07 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.16 -49.72 63.73 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.423 1.489 . . . . 0.0 109.8 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -53.53 -45.91 69.96 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.216 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.67 -49.18 69.55 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 120.525 1.511 . . . . 0.0 110.236 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -52.03 -49.26 63.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.125 1.37 . . . . 0.0 109.242 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -39.68 75.24 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 127.138 2.175 . . . . 0.0 111.173 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -59.94 -28.09 67.33 Favored 'General case' 0 N--CA 1.462 0.156 0 O-C-N 120.988 -1.07 . . . . 0.0 109.651 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -19.71 47.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.506 0.722 . . . . 0.0 111.076 177.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.44 -54.44 20.31 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.17 1.388 . . . . 0.0 110.332 179.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -92.34 155.05 18.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.635 0.652 . . . . 0.0 112.307 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 33.1 mtp85 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 116.625 -1.655 . . . . 0.0 107.343 178.688 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 120.394 0.14 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -60.39 -9.38 3.51 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 126.458 1.903 . . . . 0.0 114.655 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -80.24 31.6 0.28 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.11 1.364 . . . . 0.0 109.776 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -74.51 104.0 5.05 Favored 'General case' 0 CA--C 1.521 -0.149 0 O-C-N 119.508 -1.995 . . . . 0.0 109.618 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -66.19 96.43 0.34 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.785 1.634 . . . . 0.0 109.121 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.88 143.73 26.69 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -103.79 100.69 10.5 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 30.7 tp -92.11 107.36 22.48 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 128.468 2.707 . . . . 0.0 108.217 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -85.16 129.68 3.88 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.218 2.612 . . . . 0.0 110.767 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 t -145.43 150.62 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.92 1.236 . . . . 0.0 110.867 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -136.43 102.24 4.9 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.95 128.1 1.63 Allowed Glycine 0 N--CA 1.459 0.208 0 CA-C-O 114.845 -3.197 . . . . 0.0 107.765 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -52.97 17.64 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 122.791 3.295 . . . . 0.0 109.898 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.35 -33.79 76.51 Favored 'General case' 0 C--N 1.343 0.29 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 m -60.48 -50.26 74.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.287 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.95 -46.42 87.81 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.217 -178.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -59.24 -52.37 65.95 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.413 0.551 . . . . 0.0 111.067 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 34.6 ttm -59.12 -52.0 67.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.245 1.018 . . . . 0.0 109.215 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.7 mp -60.8 -30.72 70.23 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.78 0.718 . . . . 0.0 111.015 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -55.77 7.74 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 119.197 0.908 . . . . 0.0 108.849 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.14 -39.04 92.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -178.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.478 HG23 HD22 ' B' ' 115' ' ' LEU . 29.4 mt -62.13 -47.6 92.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 178.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.41 -58.04 9.82 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -51.97 -39.29 59.1 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.358 1.863 . . . . 0.0 113.386 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 p -69.02 -51.16 42.12 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.675 0.671 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 tt -62.83 -50.65 70.14 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 124.614 1.166 . . . . 0.0 111.553 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.91 -53.99 48.34 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.33 1.052 . . . . 0.0 110.79 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.34 -35.81 76.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.562 0.619 . . . . 0.0 111.365 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -27.03 68.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.509 1.05 . . . . 0.0 110.529 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -92.77 -28.26 16.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.791 -0.568 . . . . 0.0 109.848 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -75.46 -29.92 59.78 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.145 0.884 . . . . 0.0 110.65 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -114.78 75.86 3.93 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.677 1.591 . . . . 0.0 107.771 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -76.09 73.69 4.83 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.966 3.111 . . . . 0.0 110.424 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.98 159.92 27.44 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.968 -1.083 . . . . 0.0 109.471 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -54.4 -34.51 61.43 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.104 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.0 m -59.3 -45.15 92.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.614 1.097 . . . . 0.0 110.106 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.47 -49.66 82.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 C-N-CA 125.384 1.474 . . . . 0.0 108.148 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.34 -41.57 96.71 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.2 m -60.88 -50.22 74.29 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.11 -43.16 77.87 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.627 0.771 . . . . 0.0 110.287 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -49.38 78.01 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.86 -0.525 . . . . 0.0 110.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -65.52 -50.39 65.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.948 0.899 . . . . 0.0 110.899 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -54.93 36.82 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.543 1.137 . . . . 0.0 110.596 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.91 -32.9 74.84 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.886 1.221 . . . . 0.0 112.734 -178.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.47 -47.77 74.93 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 118.762 0.71 . . . . 0.0 109.159 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -66.27 -48.12 71.47 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.434 1.094 . . . . 0.0 109.502 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -52.67 -33.85 49.07 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 126.027 1.731 . . . . 0.0 112.342 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -57.69 -23.99 54.48 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.979 -0.451 . . . . 0.0 111.066 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -70.81 -38.98 73.35 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 125.971 1.709 . . . . 0.0 111.306 178.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -92.69 -3.88 54.14 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.185 0.994 . . . . 0.0 113.294 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.7 tt -43.03 -35.43 1.26 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 128.472 2.709 . . . . 0.0 114.4 -177.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 52.6 tp -47.4 -32.14 4.71 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.229 1.812 . . . . 0.0 112.758 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 17.38 102.33 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 130.243 3.417 . . . . 0.0 113.97 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -57.46 164.08 2.08 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.746 0.818 . . . . 0.0 110.863 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -66.08 69.59 0.06 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 127.428 2.291 . . . . 0.0 110.582 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -148.46 90.47 1.8 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.835 2.854 . . . . 0.0 104.459 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -63.52 112.61 2.86 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.61 1.564 . . . . 0.0 111.337 -179.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 8.9 tp -152.91 -10.88 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.468 0.707 . . . . 0.0 112.505 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -60.72 108.39 0.84 Allowed 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.093 0.861 . . . . 0.0 110.772 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 C--O 1.25 1.089 0 C-N-CA 128.627 2.771 . . . . 0.0 103.822 179.6 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.622 0 CA-C-O 121.383 0.435 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 9.1 p -135.95 -55.81 0.77 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.065 1.346 . . . . 0.0 109.844 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 49.74 67.6 0.87 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.8 2.04 . . . . 0.0 108.314 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -106.22 -4.32 20.33 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.756 2.022 . . . . 0.0 114.17 -178.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -80.64 35.86 0.37 Allowed 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.707 -1.246 . . . . 0.0 110.68 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m -52.77 143.73 15.86 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.606 2.362 . . . . 0.0 114.443 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -109.8 140.03 44.18 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.42 145.94 49.84 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 127.466 2.306 . . . . 0.0 107.867 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.633 HD22 ' HE2' ' D' 1116 ' ' LYS . 50.0 mt -147.94 150.16 33.54 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.772 0.829 . . . . 0.0 109.052 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.02 107.63 4.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.524 -1.227 . . . . 0.0 110.43 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.9 t -155.13 144.82 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 119.879 1.218 . . . . 0.0 109.374 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.06 103.85 15.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -141.38 112.75 0.79 Allowed Glycine 0 C--O 1.227 -0.307 0 N-CA-C 106.985 -2.446 . . . . 0.0 106.985 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 46.3 tpt85 -65.22 -59.21 4.32 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.991 2.396 . . . . 0.0 112.068 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -71.67 -42.02 68.0 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.16 -50.81 61.07 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 125.639 1.576 . . . . 0.0 110.468 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.31 -41.04 85.99 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.822 1.192 . . . . 0.0 110.322 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.85 -52.44 62.78 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.491 1.042 . . . . 0.0 109.134 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 56.2 mt -57.08 -57.88 8.14 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 C-N-CA 127.205 2.202 . . . . 0.0 110.118 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 mp -55.26 -54.01 48.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.571 1.148 . . . . 0.0 110.869 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 7.3 ttp -59.84 -45.12 93.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.356 0.98 . . . . 0.0 111.417 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -56.31 -52.43 64.55 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.897 0.879 . . . . 0.0 109.934 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.478 HD22 HG23 ' A' ' 22' ' ' ILE . 78.4 mt -70.49 -30.0 66.68 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 116' ' ' LYS . . . . . 0.463 ' HD2' HG21 ' D' 1103 ' ' VAL . 29.3 ttpp -58.81 -60.04 4.48 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.43 -45.27 80.84 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 124.201 0.938 . . . . 0.0 110.688 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 66.7 m -60.48 -44.06 96.32 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 118.034 -0.984 . . . . 0.0 113.389 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -38.21 63.01 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.894 1.224 . . . . 0.0 109.458 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -55.35 -52.81 62.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.798 0.808 . . . . 0.0 109.396 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.08 -42.41 94.13 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.452 -1.261 . . . . 0.0 109.288 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.52 -31.08 70.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.338 0.972 . . . . 0.0 111.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -77.09 -40.02 47.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.828 0.74 . . . . 0.0 110.013 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 26.7 tp -76.61 -22.46 54.15 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 33.3 m -94.5 147.61 33.54 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 119.848 1.203 . . . . 0.0 109.334 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.54 177.4 7.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 121.883 1.722 . . . . 0.0 108.639 178.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -112.09 56.58 0.47 Allowed Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 121.056 -1.028 . . . . 0.0 113.013 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.5 -72.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.584 2.19 . . . . 0.0 110.544 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.17 -36.91 85.18 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.8 t -54.29 -56.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 125.029 1.331 . . . . 0.0 111.597 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.18 -44.94 90.46 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.161 1.346 . . . . 0.0 111.497 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 17.4 t -57.83 -47.0 83.89 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -68.25 -35.63 78.21 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.235 1.414 . . . . 0.0 109.684 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 23.0 ttm-85 -55.46 -48.95 73.71 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.229 1.377 . . . . 0.0 108.834 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -69.72 -51.64 32.51 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.905 0.882 . . . . 0.0 111.631 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -51.11 -49.07 61.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.861 0.864 . . . . 0.0 110.068 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.26 -37.54 71.94 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.527 1.131 . . . . 0.0 110.579 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -57.13 -27.62 61.99 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.172 0.989 . . . . 0.0 110.6 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.25 -12.97 57.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.778 0.717 . . . . 0.0 112.186 177.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.66 2.8 35.82 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.943 -1.098 . . . . 0.0 111.045 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -133.1 177.45 7.65 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 126.009 1.724 . . . . 0.0 108.232 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 . . . . . 0 C--O 1.249 1.058 0 C-N-CA 125.12 1.368 . . . . 0.0 108.929 -179.711 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.474 0.74 0 CA-C-O 121.126 0.488 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -103.87 33.71 3.31 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 130.057 3.343 . . . . 0.0 109.26 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -118.13 39.28 3.44 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.755 1.222 . . . . 0.0 109.206 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -67.15 113.88 5.45 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 178.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 7.6 tt -79.37 98.88 6.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.147 1.379 . . . . 0.0 108.528 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.2 mt -87.64 152.74 21.93 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 126.125 1.77 . . . . 0.0 107.138 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -115.15 100.07 7.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 23.6 tp -82.04 108.57 11.84 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.455 1.502 . . . . 0.0 108.932 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -93.74 103.43 0.14 Allowed 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 124.772 3.648 . . . . 0.0 110.923 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 68.0 t -136.39 159.18 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 120.759 -1.213 . . . . 0.0 110.641 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -135.52 102.2 5.05 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.51 130.97 2.22 Favored Glycine 0 CA--C 1.517 0.176 0 CA-C-O 115.538 -2.812 . . . . 0.0 109.23 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -70.12 -52.68 21.77 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 121.351 2.576 . . . . 0.0 108.636 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.33 -34.93 78.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.199 0.599 . . . . 0.0 109.825 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.7 m -65.95 -47.98 72.85 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 89.9 t80 -64.33 -49.48 71.54 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.843 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -55.46 -53.23 58.94 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.527 1.131 . . . . 0.0 110.506 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 10.4 ttm -58.17 -53.59 56.6 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 123.285 0.634 . . . . 0.0 110.25 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.1 mp -62.75 -28.62 70.09 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.725 -1.131 . . . . 0.0 111.489 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.81 -56.6 5.96 Favored 'General case' 0 CA--C 1.522 -0.102 0 CA-C-N 120.696 1.589 . . . . 0.0 108.259 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -61.11 -46.9 88.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.479 0.712 . . . . 0.0 112.785 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 48.0 mt -67.9 -44.12 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.604 0.638 . . . . 0.0 110.632 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.2 tmpt? -66.73 -44.22 82.14 Favored 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 120.974 -1.079 . . . . 0.0 110.01 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -62.93 -50.85 69.21 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.582 0.753 . . . . 0.0 110.518 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 19.0 p -56.14 -46.41 79.25 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.184 0.902 . . . . 0.0 111.475 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 4.2 tt -62.94 -49.1 76.07 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.927 1.291 . . . . 0.0 110.056 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -60.27 -54.91 40.13 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.788 0.835 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.76 -40.93 94.31 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 124.416 1.086 . . . . 0.0 112.132 -178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmm? -63.27 -44.29 95.55 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -65.0 -37.11 86.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -33.54 76.15 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.801 1.24 . . . . 0.0 112.714 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -112.16 82.58 4.46 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 119.28 0.946 . . . . 0.0 109.713 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -73.83 62.0 4.72 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 125.095 3.863 . . . . 0.0 113.339 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.35 158.39 26.63 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.383 1.073 . . . . 0.0 109.224 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 26.5 m80 -61.46 -32.23 72.22 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.107 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 60.8 m -57.95 -47.67 82.24 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.473 1.033 . . . . 0.0 108.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 4.0 mp -59.29 -42.09 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.915 0.886 . . . . 0.0 109.062 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.06 -57.73 10.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.652 0.381 . . . . 0.0 111.213 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 91.2 m -57.82 -43.46 85.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.3 1.04 . . . . 0.0 109.745 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -58.43 -46.54 86.29 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.539 1.063 . . . . 0.0 110.302 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -49.16 76.54 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.69 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -68.32 -47.74 66.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 118.802 -0.618 . . . . 0.0 110.99 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -48.28 -51.19 26.88 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.081 1.353 . . . . 0.0 110.102 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . 0.296 3.7 pp0? -72.98 -31.72 64.71 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.74 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -66.25 -40.25 90.07 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.184 1.356 . . . . 0.0 108.456 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -70.31 -41.77 72.86 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -58.34 -36.88 74.09 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.481 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 1.9 t60 -54.98 -27.81 46.88 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.461 1.028 . . . . 0.0 112.363 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -70.51 -45.84 64.81 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.002 -1.061 . . . . 0.0 109.658 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -78.09 -9.35 59.11 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 128.405 2.682 . . . . 0.0 114.955 -178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 9.9 tt -44.78 -30.73 1.01 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 128.619 2.767 . . . . 0.0 114.376 -178.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 64.9 tp -51.09 -32.07 21.15 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 117.527 -1.225 . . . . 0.0 112.721 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 18.16 96.38 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 129.648 3.179 . . . . 0.0 115.989 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 30.8 tttt -52.81 139.79 25.91 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 125.6 1.56 . . . . 0.0 110.046 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.95 81.76 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.87 2.868 . . . . 0.0 111.939 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.91 103.08 0.78 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.207 -1.775 . . . . 0.0 106.207 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 5.8 m -57.44 138.28 55.2 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.549 1.14 . . . . 0.0 110.019 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 6.9 tp -160.41 -37.01 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 124.53 1.132 . . . . 0.0 110.267 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -60.79 148.96 37.33 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.884 0.874 . . . . 0.0 111.46 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 30.8 t . . . . . 0 C--O 1.252 1.206 0 N-CA-C 100.289 -3.967 . . . . 0.0 100.289 178.873 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.316 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 9.7 p -174.84 -53.37 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 125.612 1.565 . . . . 0.0 108.703 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 1.2 m-20 59.25 67.9 0.86 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 127.386 2.274 . . . . 0.0 109.458 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -117.29 -4.64 11.35 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.244 2.217 . . . . 0.0 114.02 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -82.96 29.67 0.46 Allowed 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.391 -1.443 . . . . 0.0 111.656 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 5.0 m -53.78 139.09 34.01 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 126.167 1.787 . . . . 0.0 110.687 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -106.99 145.4 32.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -130.03 143.29 50.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 125.571 1.548 . . . . 0.0 107.306 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 59.7 mt -144.42 154.81 43.35 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.095 0.558 . . . . 0.0 110.446 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -145.02 107.42 4.38 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.453 1.901 . . . . 0.0 108.116 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1103 ' ' VAL . . . . . 0.463 HG21 ' HD2' ' B' ' 116' ' ' LYS . 99.6 t -155.55 152.32 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 128.547 2.739 . . . . 0.0 106.497 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 103.49 7.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 121.128 1.785 . . . . 0.0 112.854 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.39 120.33 1.75 Allowed Glycine 0 C--O 1.228 -0.279 0 N-CA-C 105.957 -2.857 . . . . 0.0 105.957 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 9.3 tpt85 -57.85 -56.61 19.69 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.439 1.62 . . . . 0.0 111.688 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 58.7 mttp -67.51 -48.91 65.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -51.7 -52.03 51.47 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.051 0.94 . . . . 0.0 110.51 -177.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 93.1 t80 -61.06 -51.03 70.91 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 117.89 -1.052 . . . . 0.0 111.816 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -57.63 -47.56 81.88 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.875 1.216 . . . . 0.0 111.415 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 87.7 mt -61.21 -58.2 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.832 1.253 . . . . 0.0 108.896 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 4.6 mp -55.2 -47.47 75.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.264 0.626 . . . . 0.0 109.802 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -44.38 87.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.695 1.198 . . . . 0.0 110.279 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -62.72 -53.03 60.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.751 1.16 . . . . 0.0 108.558 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 59.4 mt -59.2 -30.06 67.94 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.084 0.553 . . . . 0.0 112.475 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1116 ' ' LYS . . . . . 0.633 ' HE2' HD22 ' B' ' 101' ' ' LEU . 28.5 ttpp -64.34 -60.52 3.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.703 1.201 . . . . 0.0 108.522 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.23 -41.21 99.07 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 123.704 0.628 . . . . 0.0 110.722 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 58.6 m -58.91 -48.18 82.36 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.35 0.977 . . . . 0.0 112.019 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -41.63 70.21 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -57.27 -46.55 82.97 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.645 1.111 . . . . 0.0 110.341 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.52 -39.67 88.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 117.804 -1.093 . . . . 0.0 108.783 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -66.97 -30.75 70.95 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.151 0.98 . . . . 0.0 110.605 178.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -75.7 -28.74 58.75 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.935 1.694 . . . . 0.0 109.661 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 40.9 tp -85.48 -33.1 21.92 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.597 1.159 . . . . 0.0 112.476 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 21.2 m -93.46 148.0 34.72 Favored Pre-proline 0 C--N 1.332 -0.181 0 O-C-N 120.934 -1.104 . . . . 0.0 110.233 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -70.82 -179.9 3.75 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 N-CA-C 108.105 -1.536 . . . . 0.0 108.105 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -112.0 61.52 0.57 Allowed Pre-proline 0 CA--C 1.544 0.718 0 O-C-N 120.814 -1.179 . . . . 0.0 111.936 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.96 -75.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 123.598 2.865 . . . . 0.0 109.974 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.4 tt -65.05 -30.35 71.31 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.9 t -55.9 -52.41 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.328 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.15 -45.96 75.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.182 1.355 . . . . 0.0 110.693 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -50.25 67.53 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.643 0.777 . . . . 0.0 109.839 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 24.8 t80 -67.02 -42.46 84.9 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 125.335 1.454 . . . . 0.0 110.064 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -57.06 -47.8 80.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.954 1.252 . . . . 0.0 110.866 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -67.45 -37.77 83.48 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.898 0.772 . . . . 0.0 110.453 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -64.67 -34.0 77.26 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.767 1.627 . . . . 0.0 111.238 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.97 -43.69 19.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.53 1.532 . . . . 0.0 108.501 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -57.76 -31.53 66.59 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.018 0.927 . . . . 0.0 110.498 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 19.3 mt -58.6 -21.35 53.16 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.708 0.803 . . . . 0.0 111.429 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.44 -5.49 54.83 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.368 0.667 . . . . 0.0 111.884 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -120.97 161.1 22.17 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.968 1.307 . . . . 0.0 110.29 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 . . . . . 0 C--O 1.254 1.314 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.881 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -102.79 21.28 15.79 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.268 1.427 . . . . 0.0 109.261 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -128.98 26.39 5.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 128.425 2.69 . . . . 0.0 107.895 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.32 142.63 56.75 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.0 tp -89.8 121.75 32.24 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -106.57 163.75 12.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.597 1.159 . . . . 0.0 108.011 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -132.44 145.17 51.0 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.588 HD21 ' HE2' ' C' 1023 ' ' LYS . 3.1 tt -132.99 96.91 17.26 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-O 118.272 -0.871 . . . . 0.0 109.255 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.05 126.4 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.582 2.855 . . . . 0.0 112.737 -179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 t -145.77 148.63 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 119.655 1.116 . . . . 0.0 109.917 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -136.28 100.94 4.53 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.55 117.45 0.74 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 105.389 -3.084 . . . . 0.0 105.389 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -65.09 -50.94 64.18 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 122.174 2.987 . . . . 0.0 111.592 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.267 0.939 . . . . 0.0 110.228 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.2 m -63.84 -49.57 72.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -59.0 -34.88 72.36 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.932 1.242 . . . . 0.0 112.123 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.05 -57.38 13.34 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.422 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 1.2 ptp -63.82 -37.8 88.74 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 119.74 -0.784 . . . . 0.0 112.336 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.55 -53.62 48.88 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 117.896 -1.05 . . . . 0.0 111.817 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.01 -52.6 64.3 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 119.661 1.119 . . . . 0.0 110.439 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -56.29 -47.57 78.39 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.67 -47.62 69.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 118.709 0.686 . . . . 0.0 109.979 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.49 -53.78 41.17 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.937 0.895 . . . . 0.0 109.817 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -61.52 -34.39 75.43 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.978 0.911 . . . . 0.0 112.69 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 p -67.77 -43.74 79.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.489 0.586 . . . . 0.0 110.291 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.07 -42.45 89.38 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.399 1.079 . . . . 0.0 109.333 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -54.74 -53.87 49.4 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 56.5 tp -60.07 -56.28 23.57 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.402 1.081 . . . . 0.0 112.765 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.497 ' HE1' HH21 ' A' ' 41' ' ' ARG . 0.2 OUTLIER -54.36 -32.35 56.68 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.347 1.459 . . . . 0.0 112.467 -178.545 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -89.92 -41.64 11.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.633 0.651 . . . . 0.0 111.129 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -70.58 -21.71 62.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 112.912 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp -132.29 75.74 73.86 Favored Pre-proline 0 C--O 1.236 0.364 0 C-N-CA 123.992 0.917 . . . . 0.0 110.652 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -70.03 81.84 0.85 Allowed 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.357 2.705 . . . . 0.0 111.252 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -72.17 153.6 41.54 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -61.6 -21.85 64.7 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.33 -0.856 . . . . 0.0 110.854 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 m -62.14 -51.25 68.64 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.5 mp -57.21 -48.1 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.531 1.132 . . . . 0.0 108.682 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -60.57 -58.68 7.45 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.8 p -59.93 -50.02 75.39 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 123.726 0.81 . . . . 0.0 111.9 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.84 -35.25 76.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 118.043 0.383 . . . . 0.0 111.069 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.497 HH21 ' HE1' ' A' ' 29' ' ' MET . 37.9 ttm180 -67.24 -48.57 67.4 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -58.61 -45.62 88.78 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.657 0.383 . . . . 0.0 110.672 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -63.59 -49.66 72.49 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.422 -0.799 . . . . 0.0 110.337 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -58.01 -40.14 80.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.142 0.883 . . . . 0.0 110.239 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -67.19 -49.79 63.34 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -61.62 -38.01 86.06 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.599 -0.688 . . . . 0.0 110.42 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -59.17 -38.97 81.05 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.421 1.089 . . . . 0.0 108.535 178.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -61.9 -25.21 67.43 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.415 0.552 . . . . 0.0 110.987 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -69.68 -44.06 71.23 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -82.37 4.39 24.14 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.643 1.577 . . . . 0.0 112.999 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -28.01 64.21 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 120.085 1.312 . . . . 0.0 112.121 -179.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.21 -9.45 53.05 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.925 0.89 . . . . 0.0 111.437 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -96.73 -175.63 3.35 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 120.189 1.359 . . . . 0.0 111.351 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -61.52 141.79 57.49 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -155.5 93.51 1.5 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.433 0.693 . . . . 0.0 111.419 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 72.2 p -139.06 140.63 38.12 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.014 -1.053 . . . . 0.0 110.073 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.8 m -72.47 105.4 4.14 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 125.463 1.505 . . . . 0.0 110.815 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.6 tt -143.16 165.36 15.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.0 151.85 37.64 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.578 1.551 . . . . 0.0 106.952 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 C--O 1.255 1.365 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 179.145 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.599 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 15.6 m -114.71 -23.53 9.17 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.417 0.687 . . . . 0.0 111.175 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 t0 59.08 28.13 17.31 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 123.17 1.462 . . . . 0.0 111.727 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -138.8 18.62 2.67 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 129.092 2.957 . . . . 0.0 108.98 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -50.15 -74.91 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.334 1.854 . . . . 0.0 109.447 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 98.3 m -159.71 147.61 17.12 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.637 3.175 . . . . 0.0 105.722 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -119.69 130.11 54.87 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 104.15 -2.537 . . . . 0.0 104.15 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -108.33 151.03 26.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.507 1.523 . . . . 0.0 110.43 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 45.1 mt -148.67 150.73 33.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.698 0.799 . . . . 0.0 109.362 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.26 106.02 4.13 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.327 1.451 . . . . 0.0 109.867 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 57.5 t -154.68 151.48 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.968 1.307 . . . . 0.0 109.156 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -113.08 102.33 10.29 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.51 1.504 . . . . 0.0 111.603 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.15 111.32 0.64 Allowed Glycine 0 CA--C 1.52 0.366 0 CA-C-O 116.046 -2.53 . . . . 0.0 108.08 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 11.2 tpt180 -60.32 -58.02 10.3 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.954 2.877 . . . . 0.0 112.566 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -67.28 -41.83 84.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 118.544 0.611 . . . . 0.0 110.613 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -58.78 -48.05 82.6 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.54 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -63.7 -44.13 94.56 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 119.007 0.821 . . . . 0.0 110.438 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -57.66 -53.92 52.71 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.737 0.699 . . . . 0.0 111.277 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.8 mt -59.7 -54.17 38.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 124.31 1.044 . . . . 0.0 109.757 -178.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 58.1 mt -58.63 -51.32 70.42 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 117.259 -1.353 . . . . 0.0 112.247 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 26.2 ttt -64.16 -44.59 91.63 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.96 1.255 . . . . 0.0 111.133 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.1 ttpt -54.05 -52.37 61.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 119.028 0.831 . . . . 0.0 109.115 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 81.6 mt -72.57 -23.88 61.03 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.384 0.674 . . . . 0.0 112.187 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' LYS . . . . . 0.472 ' HD3' HD11 ' D' 1112 ' ' LEU . 25.2 tptt -63.26 -60.11 3.83 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 120.196 1.362 . . . . 0.0 107.978 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -39.13 77.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.434 1.709 . . . . 0.0 108.649 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 7.0 t -57.03 -45.31 83.21 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 123.43 0.692 . . . . 0.0 111.322 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.27 -42.77 71.67 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.382 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.91 -37.03 85.9 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 120.728 1.604 . . . . 0.0 110.248 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 mt -66.57 -48.28 70.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -61.61 -31.9 72.0 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.935 0.894 . . . . 0.0 111.113 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -73.9 -33.35 63.97 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.178 0.899 . . . . 0.0 109.671 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 52.7 tp -83.54 -33.69 25.41 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.5 m -94.16 148.6 35.42 Favored Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -71.42 172.26 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.082 0 CA-C-N 119.904 1.002 . . . . 0.0 110.5 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -112.84 41.6 0.23 Allowed Pre-proline 0 CA--C 1.556 1.18 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.51 -48.81 2.88 Favored 'Trans proline' 0 C--N 1.354 0.836 0 CA-C-N 122.417 1.899 . . . . 0.0 111.502 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.2 -36.13 80.98 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.016 0.826 . . . . 0.0 109.567 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.25 -46.65 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.068 0 C-N-CA 123.809 0.844 . . . . 0.0 110.23 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 100.0 m-20 -62.12 -50.07 73.36 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.015 0.526 . . . . 0.0 110.31 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.3 t -62.37 -46.38 88.89 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.008 0.523 . . . . 0.0 111.176 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -61.32 -49.61 76.29 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.535 1.134 . . . . 0.0 109.006 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -56.55 -47.72 78.83 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 118.503 -0.76 . . . . 0.0 108.968 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -58.7 -54.48 46.6 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.039 0.836 . . . . 0.0 111.207 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -34.4 75.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.7 0.682 . . . . 0.0 112.4 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -74.56 -33.9 62.8 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.148 0.579 . . . . 0.0 110.069 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -61.76 -38.62 88.66 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.151 -1.593 . . . . 0.0 107.55 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.16 -13.4 60.15 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.112 0.565 . . . . 0.0 112.059 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -69.52 -41.47 75.98 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -68.15 174.95 3.48 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.361 1.464 . . . . 0.0 111.508 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 . . . . . 0 C--O 1.242 0.71 0 C-N-CA 126.979 2.112 . . . . 0.0 107.101 179.433 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -104.27 -27.17 12.17 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.539 -0.726 . . . . 0.0 112.425 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 38.9 t70 -82.67 39.36 0.61 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.495 1.518 . . . . 0.0 109.779 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.64 139.86 58.45 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 120.576 -1.328 . . . . 0.0 107.758 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 68.8 tp -86.57 124.23 32.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.87 169.1 10.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -137.97 152.24 48.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -119.43 99.84 49.91 Favored Pre-proline 0 C--O 1.235 0.311 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -80.04 108.15 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.821 3.014 . . . . 0.0 109.582 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.3 t -142.17 147.42 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 O-C-N 121.027 -1.046 . . . . 0.0 110.365 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -126.25 101.97 6.98 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.56 120.82 0.91 Allowed Glycine 0 N--CA 1.459 0.218 0 CA-C-O 116.035 -2.536 . . . . 0.0 108.578 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -66.73 -51.77 52.07 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 122.411 3.106 . . . . 0.0 110.395 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -67.9 -38.12 82.59 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.31 99.11 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.274 0.63 . . . . 0.0 110.691 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 20.9 t80 -68.9 -38.93 79.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 119.742 1.155 . . . . 0.0 108.921 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -60.51 -54.4 45.9 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.353 -0.832 . . . . 0.0 111.497 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 3.8 ptp -61.59 -33.04 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.619 0.645 . . . . 0.0 111.132 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.21 -46.83 66.47 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -43.2 98.31 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 119.467 1.03 . . . . 0.0 109.741 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.74 -48.88 74.47 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.194 0.998 . . . . 0.0 110.624 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 8.6 mt -79.76 -31.53 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.508 0.723 . . . . 0.0 111.837 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1023 ' ' LYS . . . . . 0.588 ' HE2' HD21 ' A' ' 8' ' ' LEU . 1.4 tmmt? -65.86 -56.69 10.55 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.14 -49.27 76.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.896 1.678 . . . . 0.0 113.055 -178.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 13.7 p -61.88 -50.19 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.688 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -65.77 -40.33 91.9 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.035 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.02 -54.53 41.88 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -47.56 78.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 117.916 0.326 . . . . 0.0 111.21 -179.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -54.76 -33.35 61.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.705 1.202 . . . . 0.0 111.297 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 -22.92 18.72 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.073 1.349 . . . . 0.0 111.354 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.48 -34.63 31.24 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.339 1.427 . . . . 0.0 109.752 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 22.6 tp -129.29 78.65 75.56 Favored Pre-proline 0 C--O 1.237 0.423 0 C-N-CA 126.433 1.893 . . . . 0.0 107.592 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.5 66.05 6.46 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.191 3.261 . . . . 0.0 109.443 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -56.14 152.16 11.15 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.549 1.54 . . . . 0.0 110.858 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 84.2 m-70 -51.28 -32.68 25.64 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.386 1.475 . . . . 0.0 112.464 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 7.3 m -61.75 -51.55 67.88 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.976 0.91 . . . . 0.0 109.002 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.98 -40.45 85.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 125.787 1.635 . . . . 0.0 109.116 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -65.21 -58.04 7.0 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.434 1.494 . . . . 0.0 112.625 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 26.3 p -59.2 -43.55 92.23 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.73 0.812 . . . . 0.0 110.744 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 6.5 t80 -59.72 -39.62 85.28 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.934 0.494 . . . . 0.0 109.789 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -62.86 -48.81 77.43 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 118.99 0.814 . . . . 0.0 109.653 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -57.83 -56.37 22.86 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.268 0.627 . . . . 0.0 111.009 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -60.47 -45.1 94.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.895 -1.05 . . . . 0.0 111.428 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.89 -33.77 76.44 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.258 0.935 . . . . 0.0 113.297 -178.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -69.33 -50.36 47.26 Favored 'General case' 0 N--CA 1.461 0.084 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -58.83 -35.1 72.35 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.054 0.942 . . . . 0.0 110.752 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -57.45 -29.6 64.33 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.875 1.27 . . . . 0.0 110.381 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -64.22 -30.05 71.13 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.506 0.594 . . . . 0.0 111.09 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -66.64 -42.41 86.74 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 120.803 -1.185 . . . . 0.0 109.886 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 13.2 m170 -77.75 -3.46 41.39 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.795 0.838 . . . . 0.0 111.674 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.17 -20.21 64.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.399 1.079 . . . . 0.0 110.885 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 6.3 mp -66.18 -24.9 66.72 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.974 -1.079 . . . . 0.0 109.232 178.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -91.58 172.21 8.65 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.084 1.353 . . . . 0.0 110.794 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -51.9 142.24 15.89 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.054 1.342 . . . . 0.0 111.046 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -140.35 103.5 4.58 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.72 114.84 7.88 Favored 'General case' 0 C--O 1.241 0.652 0 O-C-N 121.718 -0.614 . . . . 0.0 109.552 -178.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 15.7 m -67.92 106.12 2.21 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.276 1.03 . . . . 0.0 109.472 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 20.1 tt -163.05 140.11 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 104.613 -2.366 . . . . 0.0 104.613 178.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -145.94 158.4 43.87 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.058 1.343 . . . . 0.0 108.586 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.255 1.381 0 C-N-CA 124.268 1.027 . . . . 0.0 109.053 179.425 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.601 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 2.0 m -131.98 -81.92 0.5 Allowed 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.595 -1.631 . . . . 0.0 106.595 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 31.1 t0 -169.48 39.27 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.968 2.107 . . . . 0.0 107.245 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -126.49 26.14 6.39 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.932 1.293 . . . . 0.0 109.456 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.86 -80.89 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 125.393 1.477 . . . . 0.0 111.572 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 84.2 m -160.69 139.14 10.02 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 128.007 2.523 . . . . 0.0 106.385 177.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -113.24 130.16 56.31 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -105.69 140.03 39.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.942 2.897 . . . . 0.0 110.141 -177.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 77.5 mt -137.66 144.93 42.09 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.326 -0.859 . . . . 0.0 111.006 -178.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.84 101.39 3.94 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.03 1.732 . . . . 0.0 110.377 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D 1103 ' ' VAL . . . . . 0.452 HG11 ' HE3' ' B' ' 116' ' ' LYS . 63.9 t -151.25 152.01 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 120.585 -1.322 . . . . 0.0 109.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -115.79 101.47 8.84 Favored 'General case' 0 C--N 1.347 0.497 0 CA-C-N 120.486 1.494 . . . . 0.0 113.547 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.84 118.38 1.24 Allowed Glycine 0 CA--C 1.522 0.494 0 N-CA-C 107.717 -2.153 . . . . 0.0 107.717 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -66.73 -56.65 9.56 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 121.307 2.554 . . . . 0.0 111.014 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -63.38 -45.92 88.87 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.048 0.928 . . . . 0.0 109.328 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -57.99 -51.27 70.34 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 117.205 -1.378 . . . . 0.0 111.763 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.55 -44.97 95.54 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.498 1.499 . . . . 0.0 111.149 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -50.73 -54.1 26.03 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.807 0.843 . . . . 0.0 110.509 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.6 mt -65.88 -52.34 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.822 1.249 . . . . 0.0 110.383 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1112 ' ' LEU . . . . . 0.472 HD11 ' HD3' ' B' ' 116' ' ' LYS . 18.2 mt -51.73 -52.26 49.92 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.566 1.147 . . . . 0.0 111.974 -178.662 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 24.0 ttt -64.7 -44.26 90.84 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.25 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1114 ' ' LYS . . . . . 0.422 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 24.7 ttpt -54.99 -52.18 63.93 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.93 -45.8 76.76 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.576 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.6 tptt -53.76 -59.75 4.21 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 118.949 0.795 . . . . 0.0 111.755 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -30.31 71.18 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 18.4 t -60.86 -39.04 87.66 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 120.324 1.42 . . . . 0.0 109.7 178.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.07 -38.6 63.88 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.275 0.489 . . . . 0.0 110.093 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.73 -43.29 96.94 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.93 -48.85 70.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.6 tmt? -59.56 -22.49 61.79 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.752 0.821 . . . . 0.0 110.861 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.71 -46.8 35.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 65.1 tp -71.99 -33.11 67.84 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.864 0.866 . . . . 0.0 113.334 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 23.1 m -92.25 147.5 34.71 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 120.101 1.319 . . . . 0.0 110.4 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -71.45 174.86 10.25 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 N-CA-C 108.398 -1.424 . . . . 0.0 108.398 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -122.74 44.3 0.87 Allowed Pre-proline 0 CA--C 1.555 1.136 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -61.91 -48.72 8.03 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.158 2.572 . . . . 0.0 113.273 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 49.7 tp -65.64 -26.41 67.79 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.453 -0.779 . . . . 0.0 109.689 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 39.7 t -67.27 -46.56 83.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.237 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -56.84 -43.81 81.5 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -64.6 -48.47 74.82 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.137 0.575 . . . . 0.0 109.975 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.36 -41.85 94.54 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.205 1.002 . . . . 0.0 110.166 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.07 -48.44 80.12 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.66 -49.82 69.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 117.893 -1.051 . . . . 0.0 111.89 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -42.46 95.67 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.118 1.326 . . . . 0.0 111.384 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -71.01 -37.55 72.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.157 0.435 . . . . 0.0 111.12 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -65.82 -39.75 91.17 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 119.028 0.831 . . . . 0.0 109.659 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 43.4 mt -66.81 -26.13 66.79 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.887 0.767 . . . . 0.0 110.003 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tm? -77.21 -40.31 45.51 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.295 1.038 . . . . 0.0 108.677 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.24 138.0 56.66 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.672 1.989 . . . . 0.0 109.956 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 . . . . . 0 C--O 1.252 1.188 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 179.391 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.419 ' C ' ' H ' ' A' ' 3' ' ' ASP . 69.8 m . . . . . 0 N--CA 1.465 0.282 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -67.26 14.92 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 128.227 2.611 . . . . 0.0 112.09 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.419 ' H ' ' C ' ' A' ' 1' ' ' SER . 7.2 p-10 -86.41 12.59 9.86 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 128.375 2.67 . . . . 0.0 110.535 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.67 110.24 15.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.87 104.71 1.14 Allowed 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -92.2 169.25 10.75 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -123.93 127.92 48.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 13.5 tp -115.67 93.98 38.98 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 126.022 1.729 . . . . 0.0 107.353 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -77.8 119.92 4.94 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.062 2.508 . . . . 0.0 112.988 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -145.62 155.59 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.04 1.336 . . . . 0.0 108.775 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.0 101.4 4.71 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.2 0.6 . . . . 0.0 111.102 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.48 115.93 0.65 Allowed Glycine 0 CA--C 1.526 0.732 0 C-N-CA 126.805 2.145 . . . . 0.0 107.758 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.07 -51.98 65.92 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.6 2.7 . . . . 0.0 112.286 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -73.42 -32.38 64.38 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 123.27 0.628 . . . . 0.0 110.737 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -61.05 -43.4 98.94 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.123 1.369 . . . . 0.0 108.627 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -67.51 -54.43 20.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -54.64 -54.93 35.12 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.471 0.708 . . . . 0.0 112.909 -178.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 40.0 ttm -53.42 -54.02 42.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.983 0.913 . . . . 0.0 110.349 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.94 -28.73 67.73 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-O 118.014 -0.993 . . . . 0.0 112.911 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.22 -55.8 10.98 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.61 -40.49 72.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.031 0.932 . . . . 0.0 110.349 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.447 HG23 HD22 ' B' ' 115' ' ' LEU . 93.2 mt -67.9 -51.07 53.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.63 -0.7 . . . . 0.0 110.337 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -32.82 74.49 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.108 1.322 . . . . 0.0 110.721 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -66.16 -55.17 17.71 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.031 1.332 . . . . 0.0 110.395 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 p -54.38 -40.63 68.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 117.9 0.318 . . . . 0.0 110.326 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 tt -68.5 -55.43 11.77 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.734 1.214 . . . . 0.0 110.513 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -53.36 -52.78 58.16 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.244 1.817 . . . . 0.0 111.869 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.8 -46.22 90.46 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.993 -1.003 . . . . 0.0 109.641 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.54 -43.03 97.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 119.079 0.854 . . . . 0.0 109.281 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -71.69 -13.17 61.66 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -102.77 -28.96 11.78 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.299 0.954 . . . . 0.0 113.526 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.6 tp -110.81 115.03 53.88 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 125.206 1.402 . . . . 0.0 109.848 -178.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -60.98 -37.43 76.74 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.152 1.901 . . . . 0.0 112.428 -179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 47.54 115.06 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 129.727 3.211 . . . . 0.0 114.749 179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -52.53 -31.08 33.79 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.868 0.867 . . . . 0.0 112.501 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.8 m -67.83 -46.09 72.82 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.777 0.831 . . . . 0.0 108.942 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -65.28 -34.39 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -58.27 8.13 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.0 m -68.29 -49.43 60.5 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -52.2 -51.93 55.19 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 123.924 0.89 . . . . 0.0 111.256 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -69.05 -46.1 68.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.937 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -58.45 -52.99 63.29 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.986 0.514 . . . . 0.0 110.629 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -62.75 -41.18 99.08 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.676 -0.678 . . . . 0.0 109.372 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.78 -39.38 84.69 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.383 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.73 -52.15 61.76 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.187 1.358 . . . . 0.0 108.348 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.2 tm0? -57.69 -39.18 76.56 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.687 1.195 . . . . 0.0 111.712 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -78.6 -34.15 46.95 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.975 0.91 . . . . 0.0 110.291 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -58.74 -21.16 54.71 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.136 -0.978 . . . . 0.0 110.657 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.42 -45.61 76.74 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.704 1.602 . . . . 0.0 108.253 178.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -92.57 -38.41 11.92 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.238 1.015 . . . . 0.0 111.486 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.6 tp -57.54 -32.57 67.22 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.229 1.012 . . . . 0.0 113.639 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 69.0 mt -93.1 -0.8 56.93 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 122.853 0.461 . . . . 0.0 111.029 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 42.62 -134.6 0.41 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 127.34 2.256 . . . . 0.0 108.972 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.55 65.29 1.48 Allowed 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 103.622 -2.733 . . . . 0.0 103.622 178.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -137.6 -0.72 2.13 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -178.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t -139.8 147.58 40.98 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 120.924 1.693 . . . . 0.0 111.011 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.3 m -83.35 79.27 9.46 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 126.547 1.939 . . . . 0.0 110.767 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.6 pt -64.3 158.87 3.9 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.629 0.728 . . . . 0.0 111.407 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -65.82 158.7 27.08 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.665 1.586 . . . . 0.0 110.186 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.23 0 C-N-CA 124.65 1.18 . . . . 0.0 107.899 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.54 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 72.7 m -159.13 70.31 0.48 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 104.444 -2.428 . . . . 0.0 104.444 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -118.18 -74.26 0.61 Allowed 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 123.771 0.828 . . . . 0.0 110.344 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -66.83 -35.76 80.78 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.317 0.962 . . . . 0.0 111.486 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.31 -17.54 61.3 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.533 0.733 . . . . 0.0 111.167 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 98' ' ' THR . . . . . 0.488 ' HA ' ' HB3' ' D' 1104 ' ' ARG . 53.1 m -75.29 150.52 38.49 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' TYR . . . . . 0.513 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 86.9 m-85 -101.7 128.23 48.1 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.108 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -105.98 161.98 14.0 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 126.026 1.73 . . . . 0.0 109.317 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 93.7 mt -151.0 142.98 23.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 127.441 2.296 . . . . 0.0 106.285 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -144.39 98.87 3.28 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.251 1.42 . . . . 0.0 108.37 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 m -153.63 150.32 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 123.485 0.714 . . . . 0.0 111.682 -177.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -117.54 102.48 9.22 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.043 1.292 . . . . 0.0 114.201 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.31 129.28 3.82 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 106.781 -2.528 . . . . 0.0 106.781 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -66.73 -57.51 6.97 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.202 2.001 . . . . 0.0 110.88 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -70.35 -37.87 74.7 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -54.6 -41.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.233 0.613 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -75.12 -42.68 55.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.257 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -54.15 -54.93 32.88 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.853 1.66 . . . . 0.0 110.273 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.02 -54.92 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.466 1.506 . . . . 0.0 110.423 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -32.18 73.74 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-O 116.711 -1.614 . . . . 0.0 112.89 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 21.3 mtp -68.78 -53.24 22.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 121.019 1.736 . . . . 0.0 107.547 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -52.07 -48.55 64.6 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.297 1.039 . . . . 0.0 109.836 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.447 HD22 HG23 ' A' ' 22' ' ' ILE . 50.9 mt -67.46 -54.99 15.47 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.6 -0.715 . . . . 0.0 112.138 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -54.45 -37.85 65.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 120.095 1.316 . . . . 0.0 110.797 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.04 -57.59 8.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.731 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 73.0 m -55.54 -34.12 64.41 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.11 -0.947 . . . . 0.0 111.432 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.45 -40.24 67.17 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.713 1.205 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.77 -47.09 85.01 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.44 1.018 . . . . 0.0 108.478 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 75.5 mt -60.64 -47.3 86.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -26.77 68.02 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.263 1.025 . . . . 0.0 111.807 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -79.64 -54.79 5.54 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.808 0.843 . . . . 0.0 111.868 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -69.6 -32.72 71.61 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.86 148.27 34.49 Favored Pre-proline 0 CA--C 1.534 0.327 0 C-N-CA 125.105 1.362 . . . . 0.0 108.756 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -70.98 169.42 20.52 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 121.077 1.185 . . . . 0.0 109.576 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -115.7 58.88 1.46 Allowed Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.436 1.094 . . . . 0.0 113.207 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.07 -63.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 123.558 2.838 . . . . 0.0 115.645 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.31 -33.33 75.57 Favored 'General case' 0 CA--C 1.513 -0.477 0 O-C-N 121.162 -0.961 . . . . 0.0 108.934 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.424 HG23 ' H ' ' B' ' 130' ' ' VAL . 15.1 t -50.27 -53.33 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 C-N-CA 125.173 1.389 . . . . 0.0 108.401 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -66.39 -51.4 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.8 m -59.16 -41.13 87.66 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.97 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -67.98 -52.77 32.07 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.019 1.328 . . . . 0.0 110.365 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -59.69 -39.78 85.67 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.401 -1.285 . . . . 0.0 110.129 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -64.28 -55.6 20.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.911 1.232 . . . . 0.0 110.058 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -56.42 -42.48 78.12 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.356 -0.84 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -67.83 -40.72 83.74 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.993 0.917 . . . . 0.0 110.828 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -61.23 -34.32 74.93 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 125.26 1.424 . . . . 0.0 110.567 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -57.73 -14.36 5.6 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.388 0.994 . . . . 0.0 113.128 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 tt -72.2 -20.54 61.56 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.814 1.188 . . . . 0.0 109.693 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -141.04 99.75 3.66 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 125.81 1.644 . . . . 0.0 108.976 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.811 0 C-N-CA 123.881 0.872 . . . . 0.0 108.683 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1001 ' ' SER . . . . . 0.404 ' C ' ' H ' ' C' 1003 ' ' ASP . 37.3 m . . . . . 0 N--CA 1.463 0.192 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -78.0 32.49 0.18 Allowed 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 121.001 1.728 . . . . 0.0 112.176 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1003 ' ' ASP . . . . . 0.404 ' H ' ' C ' ' C' 1001 ' ' SER . 2.6 p30 -90.43 12.0 19.86 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 129.106 2.962 . . . . 0.0 110.594 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -65.05 106.0 1.17 Allowed 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 1.9 tt -69.19 95.9 0.79 Allowed 'General case' 0 C--O 1.236 0.378 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.7 mt -90.28 168.77 11.66 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.784 1.633 . . . . 0.0 107.506 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -126.44 135.23 51.12 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 28.4 tp -111.72 91.97 16.11 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.8 106.65 2.24 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.261 2.641 . . . . 0.0 109.471 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 58.9 t -144.91 153.69 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 119.977 1.262 . . . . 0.0 110.769 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -128.52 102.97 6.85 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.3 110.59 0.39 Allowed Glycine 0 CA--C 1.522 0.469 0 CA-C-O 115.646 -2.752 . . . . 0.0 108.878 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -62.06 -53.15 59.53 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 123.099 3.449 . . . . 0.0 111.962 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 16.7 m -67.92 -45.48 74.26 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.28 -0.887 . . . . 0.0 109.469 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.54 -52.39 61.33 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 124.051 0.94 . . . . 0.0 108.614 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -54.47 -51.39 65.17 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.141 0.976 . . . . 0.0 110.69 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 52.1 ttm -61.49 -53.84 51.1 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.654 0.781 . . . . 0.0 111.377 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.3 -36.54 84.38 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.94 -55.8 15.0 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -57.69 -39.31 76.88 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.513 0.725 . . . . 0.0 111.687 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1022 ' ' ILE . . . . . 0.405 HG23 HD22 ' D' 1115 ' ' LEU . 22.6 mt -65.15 -52.25 55.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 118.483 -0.77 . . . . 0.0 109.865 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -34.61 75.66 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 118.375 -1.33 . . . . 0.0 110.794 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -61.66 -55.35 31.48 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 110.049 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.2 p -55.32 -49.09 73.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 118.094 0.407 . . . . 0.0 110.911 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.3 tt -62.24 -54.3 42.8 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.843 0.857 . . . . 0.0 111.164 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -53.95 -50.97 65.3 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.613 1.165 . . . . 0.0 110.152 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.35 -48.83 76.33 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 123.774 0.829 . . . . 0.0 110.005 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 2.2 tmt? -58.87 -22.65 59.66 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.45 1.1 . . . . 0.0 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -100.98 -12.77 18.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.058 1.743 . . . . 0.0 112.012 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.3 t80 -101.72 -13.41 17.76 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.003 1.321 . . . . 0.0 110.581 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 41.7 tp -130.91 103.16 15.81 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 126.838 2.055 . . . . 0.0 108.633 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -76.84 40.05 0.77 Allowed 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 124.485 3.457 . . . . 0.0 111.092 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -25.36 123.51 0.06 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 131.31 3.844 . . . . 0.0 113.112 -178.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 7.2 m170 -48.44 -46.53 37.8 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 124.7 1.2 . . . . 0.0 112.855 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 13.3 m -58.78 -51.24 70.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.716 0.807 . . . . 0.0 109.829 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.5 mt -57.03 -46.04 84.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.981 1.712 . . . . 0.0 110.206 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.4 -52.11 66.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 122.872 0.469 . . . . 0.0 111.619 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 27.7 m -63.26 -39.53 94.85 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.706 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 24.7 t80 -57.7 -52.97 63.25 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 178.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 48.0 ttt-85 -63.77 -31.81 73.11 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.665 0.666 . . . . 0.0 111.859 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -60.1 -57.85 11.07 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -67.98 -37.87 82.01 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.668 1.187 . . . . 0.0 111.633 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -60.24 -47.39 86.17 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.586 -1.197 . . . . 0.0 109.834 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -64.64 -40.43 95.44 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.196 1.362 . . . . 0.0 110.012 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -59.05 -54.1 50.92 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -68.79 -29.75 68.18 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.464 -0.773 . . . . 0.0 111.958 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.81 -24.05 61.33 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 120.844 -1.16 . . . . 0.0 111.058 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -42.71 82.13 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 30.4 p80 -92.4 -34.0 14.32 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 118.459 -0.782 . . . . 0.0 111.014 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 24.5 tp -59.2 -47.13 86.45 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.588 1.085 . . . . 0.0 111.282 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 85.0 mt -79.06 -37.4 39.02 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 3.3 tt0 53.6 -175.52 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.717 2.007 . . . . 0.0 111.794 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -87.55 99.91 12.39 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 104.186 -2.524 . . . . 0.0 104.186 178.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 16.0 pt20 177.66 -2.22 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 127.832 2.453 . . . . 0.0 112.148 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 10.1 t -142.84 145.91 33.63 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 50.3 m -78.16 127.03 31.66 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.669 0.788 . . . . 0.0 109.532 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 13.1 pt -106.3 152.83 7.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 C-N-CA 124.736 1.215 . . . . 0.0 107.927 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -68.59 158.53 33.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 C--O 1.249 1.034 0 O-C-N 121.231 -0.918 . . . . 0.0 110.708 179.619 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 15.0 m -150.28 95.75 2.31 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 19.6 t70 -142.45 -51.0 0.38 Allowed 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 118.733 0.697 . . . . 0.0 111.807 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1096 ' ' GLU . . . . . 0.471 ' H ' ' CD ' ' D' 1096 ' ' GLU . 2.2 mp0 -58.5 -38.1 76.96 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 122.802 0.441 . . . . 0.0 111.385 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -86.75 -6.49 58.81 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 122.944 0.497 . . . . 0.0 111.464 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.2 m -74.3 152.42 39.65 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 105.087 -2.19 . . . . 0.0 105.087 178.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -101.9 130.18 48.32 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.194 -0.942 . . . . 0.0 110.173 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -115.61 150.0 37.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.55 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 70.9 mt -142.53 142.27 32.19 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.82 98.56 3.07 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.281 1.033 . . . . 0.0 108.354 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.39 146.52 18.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 124.958 1.303 . . . . 0.0 110.81 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1104 ' ' ARG . . . . . 0.488 ' HB3' ' HA ' ' B' ' 98' ' ' THR . 0.0 OUTLIER -107.88 100.62 9.97 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.662 1.119 . . . . 0.0 113.284 -179.374 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.09 108.15 0.5 Allowed Glycine 0 C--O 1.226 -0.371 0 N-CA-C 106.385 -2.686 . . . . 0.0 106.385 177.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -51.08 -57.11 9.52 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 122.005 2.903 . . . . 0.0 113.728 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -67.84 -44.25 77.6 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.344 -0.848 . . . . 0.0 110.467 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 3.3 m120 -58.6 -30.05 66.92 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.296 1.439 . . . . 0.0 110.645 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1109 ' ' PHE . . . . . 0.513 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 45.7 t80 -74.82 -55.33 5.93 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 177.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.36 -53.93 38.27 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.497 1.044 . . . . 0.0 113.399 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -60.03 -54.47 34.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 C-N-CA 125.035 1.334 . . . . 0.0 109.119 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -35.8 81.68 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 117.442 -1.266 . . . . 0.0 110.877 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.96 -52.45 62.98 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 119.843 1.202 . . . . 0.0 108.282 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 58.0 tttp -54.96 -46.96 75.1 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.69 0.796 . . . . 0.0 109.81 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1115 ' ' LEU . . . . . 0.405 HD22 HG23 ' C' 1022 ' ' ILE . 33.0 mt -66.86 -52.0 48.85 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 117.907 0.321 . . . . 0.0 110.649 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -55.03 -44.65 74.82 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.399 1.079 . . . . 0.0 111.438 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.62 -57.5 11.78 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.152 1.781 . . . . 0.0 106.983 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.6 m -53.2 -43.72 67.39 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.506 0.722 . . . . 0.0 112.008 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.82 -31.08 64.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.348 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -65.16 -44.86 87.19 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.504 1.502 . . . . 0.0 107.468 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.74 -43.14 89.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.053 1.341 . . . . 0.0 107.783 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.21 -36.46 79.96 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.019 0.827 . . . . 0.0 110.752 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -45.37 52.79 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.807 0.843 . . . . 0.0 112.288 -179.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -78.42 -32.83 48.85 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -94.31 146.12 30.97 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -67.0 173.97 7.54 Favored 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 122.912 2.408 . . . . 0.0 112.799 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -115.23 50.85 0.67 Allowed Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 125.059 1.344 . . . . 0.0 113.858 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.09 -69.73 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.213 1.942 . . . . 0.0 112.245 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.87 -32.64 73.01 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.253 0.933 . . . . 0.0 110.007 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.0 t -53.99 -50.47 53.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 124.537 1.135 . . . . 0.0 110.074 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.89 -51.25 50.22 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.482 0.583 . . . . 0.0 111.253 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 49.5 m -54.59 -42.36 70.98 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.032 0.378 . . . . 0.0 110.841 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.03 -52.57 40.72 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 117.29 -1.338 . . . . 0.0 110.282 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.86 -43.4 94.7 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 120.121 1.328 . . . . 0.0 111.331 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -62.39 -54.96 32.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 118.875 0.761 . . . . 0.0 109.841 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -61.52 -27.89 68.93 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.8 tm0? -80.51 -49.71 11.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -55.37 -33.2 63.23 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.801 1.64 . . . . 0.0 109.971 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 9.6 mt -57.12 -13.97 3.49 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.038 0.935 . . . . 0.0 113.442 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.3 tt -75.02 -23.38 58.19 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.468 1.031 . . . . 0.0 110.731 178.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -140.86 100.01 3.74 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 126.364 1.866 . . . . 0.0 110.102 -178.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.952 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.9 p . . . . . 0 N--CA 1.463 0.216 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -104.38 3.77 32.7 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.964 0.905 . . . . 0.0 113.13 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -70.63 14.84 0.12 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.841 1.256 . . . . 0.0 114.078 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -53.97 107.28 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tp -62.85 94.57 0.07 Allowed 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.674 1.19 . . . . 0.0 113.123 -177.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.01 156.2 18.12 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -130.14 142.69 50.56 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.766 1.626 . . . . 0.0 106.738 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 tp -132.12 110.47 14.14 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 119.596 1.089 . . . . 0.0 111.885 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -88.18 113.31 0.78 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.766 3.644 . . . . 0.0 111.07 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.41 HG22 ' HE3' ' C' 1023 ' ' LYS . 24.2 t -140.83 148.45 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 119.788 -1.82 . . . . 0.0 107.965 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.58 102.8 5.23 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.466 -0.771 . . . . 0.0 109.924 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.26 118.12 0.79 Allowed Glycine 0 CA--C 1.521 0.424 0 N-CA-C 104.325 -3.51 . . . . 0.0 104.325 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.98 -51.46 64.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.965 1.883 . . . . 0.0 109.878 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.51 -45.74 82.38 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.842 0.857 . . . . 0.0 109.449 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.7 m -55.31 -51.81 65.51 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.794 1.638 . . . . 0.0 110.488 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -62.0 -42.56 99.28 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.424 -0.798 . . . . 0.0 110.278 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -60.46 -42.96 97.26 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.118 1.326 . . . . 0.0 111.697 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.5 ttm -69.98 -53.83 15.96 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.038 0.535 . . . . 0.0 110.911 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.18 -47.02 82.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.654 1.581 . . . . 0.0 111.422 -178.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.69 -49.09 78.93 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -57.81 -47.65 81.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.948 0.794 . . . . 0.0 111.814 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.531 HG23 HD22 ' B' ' 115' ' ' LEU . 96.6 mt -62.12 -42.12 93.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 123.419 0.688 . . . . 0.0 109.249 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.467 ' HE3' HG22 ' C' 1010 ' ' VAL . 14.0 tmtt? -63.38 -52.41 61.76 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 123.854 0.862 . . . . 0.0 108.756 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.35 -54.69 40.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.929 2.092 . . . . 0.0 110.949 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -53.82 -51.1 64.6 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.908 0.776 . . . . 0.0 109.721 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.14 -48.71 78.88 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -178.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -59.69 -51.83 68.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.145 1.378 . . . . 0.0 111.564 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.42 ' HG ' HG22 ' B' ' 130' ' ' VAL . 4.0 mm? -65.05 -42.48 94.23 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.072 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -37.18 67.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -89.66 -17.13 28.97 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.222 1.374 . . . . 0.0 112.91 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -87.56 -57.9 2.78 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 121.149 -0.969 . . . . 0.0 113.234 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.68 155.04 92.3 Favored Pre-proline 0 CA--C 1.54 0.579 0 O-C-N 121.919 -0.488 . . . . 0.0 110.826 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -60.14 112.54 1.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.83 2.353 . . . . 0.0 111.717 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -69.14 21.76 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.538 1.935 . . . . 0.0 114.376 -179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -47.23 -47.24 24.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 121.894 2.134 . . . . 0.0 114.681 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.2 m -66.72 -51.26 57.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.373 -0.83 . . . . 0.0 109.753 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.0 mt -58.3 -43.89 87.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 125.442 1.497 . . . . 0.0 110.939 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -55.95 -58.96 5.69 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.379 1.872 . . . . 0.0 109.677 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.9 m -62.73 -42.19 99.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.153 0.908 . . . . 0.0 110.071 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -55.3 -54.44 43.56 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.408 1.004 . . . . 0.0 111.223 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 43.3 ttt-85 -75.3 -29.87 60.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.308 -0.87 . . . . 0.0 112.209 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.73 -49.98 47.98 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.096 -1.002 . . . . 0.0 109.008 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -62.28 -44.14 97.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.658 1.183 . . . . 0.0 109.17 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -56.41 -51.9 66.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.369 0.986 . . . . 0.0 110.233 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -62.09 -34.97 77.32 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.984 -0.447 . . . . 0.0 111.241 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -69.43 -43.43 73.38 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.859 0.864 . . . . 0.0 110.4 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -57.36 -38.55 74.35 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.553 1.941 . . . . 0.0 110.763 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.59 -21.98 66.03 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.43 0.559 . . . . 0.0 111.793 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -70.07 -33.24 71.67 Favored 'General case' 0 C--O 1.226 -0.146 0 O-C-N 120.607 -1.308 . . . . 0.0 110.724 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -61.2 -32.75 72.51 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 117.919 0.327 . . . . 0.0 110.491 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.83 -20.82 66.01 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.24 0.616 . . . . 0.0 110.619 178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -100.47 -12.49 19.3 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.455 1.902 . . . . 0.0 110.955 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 35.32 65.18 0.41 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 129.261 3.025 . . . . 0.0 111.566 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -95.05 -20.4 19.35 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.887 1.275 . . . . 0.0 111.904 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -139.38 155.03 47.92 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.895 1.278 . . . . 0.0 108.45 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -115.83 139.92 49.72 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 125.68 1.592 . . . . 0.0 108.875 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.5 p -70.86 148.65 47.58 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 178.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.3 pt -147.78 179.41 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 127.441 2.296 . . . . 0.0 106.869 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -72.32 158.7 35.32 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.3 p . . . . . 0 C--O 1.256 1.401 0 CA-C-O 114.368 -2.729 . . . . 0.0 104.127 179.201 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.538 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 47.9 t -166.35 -179.13 4.84 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 127.062 2.145 . . . . 0.0 105.456 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -149.04 -19.06 0.3 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 124.004 0.922 . . . . 0.0 111.712 178.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -65.7 -39.22 91.01 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.685 0.675 . . . . 0.0 109.419 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -131.52 92.08 3.11 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.071 0.948 . . . . 0.0 110.589 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 92.3 m -120.99 164.05 17.33 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 125.749 1.62 . . . . 0.0 106.914 178.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' TYR . . . . . 0.487 ' HB3' ' CE2' ' D' 1109 ' ' PHE . 97.1 m-85 -118.59 131.32 56.2 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -113.1 158.19 20.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.383 1.473 . . . . 0.0 110.396 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 81.3 mt -144.06 135.82 26.12 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.42 98.87 4.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.515 1.526 . . . . 0.0 107.072 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 43.4 t -149.53 141.59 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.338 0.972 . . . . 0.0 109.627 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -92.83 103.98 16.27 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.22 108.44 0.49 Allowed Glycine 0 N--CA 1.465 0.627 0 CA-C-O 114.937 -3.146 . . . . 0.0 112.729 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -67.61 -58.21 5.08 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 123.55 3.675 . . . . 0.0 112.455 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -66.82 -43.08 84.71 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.294 -0.879 . . . . 0.0 110.012 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -57.63 -47.29 82.62 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.346 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -63.39 -41.73 98.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 120.302 1.41 . . . . 0.0 111.706 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -56.67 -52.39 65.11 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.718 1.144 . . . . 0.0 110.437 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.32 -52.6 53.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 C-N-CA 124.772 1.229 . . . . 0.0 110.788 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.94 -29.44 70.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 117.564 -1.208 . . . . 0.0 111.77 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 mtp -69.68 -52.33 26.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.69 1.586 . . . . 0.0 107.524 178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -51.7 -51.82 53.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.223 0.952 . . . . 0.0 108.706 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.531 HD22 HG23 ' A' ' 22' ' ' ILE . 65.0 mt -68.99 -35.87 77.19 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -61.51 -52.13 65.74 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 120.371 1.442 . . . . 0.0 107.488 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.13 -38.05 89.38 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 124.235 0.959 . . . . 0.0 109.891 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 5.4 t -52.8 -55.05 25.75 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.144 0.978 . . . . 0.0 110.52 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.47 -33.32 71.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.076 -0.964 . . . . 0.0 112.493 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -44.53 92.0 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.852 1.205 . . . . 0.0 108.409 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 54.9 mt -67.07 -48.23 68.86 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 9.6 tpt -58.67 -26.92 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.173 0.897 . . . . 0.0 110.83 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -79.63 -44.69 20.49 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.261 1.024 . . . . 0.0 111.052 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -79.41 -26.1 41.95 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.047 1.294 . . . . 0.0 114.279 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' VAL . . . . . 0.468 HG22 ' HD2' ' B' ' 126' ' ' PRO . 0.3 OUTLIER -94.95 148.52 34.85 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.953 1.701 . . . . 0.0 108.916 -179.344 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.468 ' HD2' HG22 ' B' ' 125' ' ' VAL . 42.0 Cg_endo -73.36 179.86 5.1 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.735 2.29 . . . . 0.0 110.746 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 16.6 mp0 -121.2 44.27 0.73 Allowed Pre-proline 0 CA--C 1.563 1.47 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -63.4 -48.67 5.59 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.217 2.611 . . . . 0.0 115.284 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 69.4 tp -62.93 -41.86 99.61 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.551 1.068 . . . . 0.0 108.973 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.42 HG22 ' HG ' ' A' ' 28' ' ' LEU . 1.8 t -51.76 -48.68 37.86 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 C-N-CA 125.452 1.501 . . . . 0.0 109.706 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -61.49 -51.11 70.03 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.684 1.193 . . . . 0.0 111.767 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.5 t -62.79 -50.17 72.07 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.946 -0.471 . . . . 0.0 110.595 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -61.91 -36.12 80.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.597 1.559 . . . . 0.0 110.182 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -59.98 -48.63 80.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.31 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -69.13 -49.8 53.76 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.822 0.737 . . . . 0.0 111.706 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -54.15 -46.05 72.16 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.692 1.197 . . . . 0.0 111.185 -178.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -80.25 -27.67 38.62 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.928 0.891 . . . . 0.0 110.843 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -57.64 -39.66 77.48 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.184 1.357 . . . . 0.0 108.625 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.3 mt -58.66 -17.28 21.1 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.123 0.969 . . . . 0.0 112.459 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.18 -15.78 61.0 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.579 1.081 . . . . 0.0 111.985 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -99.88 170.28 8.63 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.124 -0.985 . . . . 0.0 109.756 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 . . . . . 0 C--O 1.244 0.801 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 179.063 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.423 0 CA-C-O 122.173 0.987 . . . . 0.0 108.864 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.29 -6.65 41.43 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.249 1.02 . . . . 0.0 112.528 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 2.3 t70 -71.35 32.08 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.2 1.8 . . . . 0.0 115.805 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -70.59 106.59 3.54 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.01 95.06 0.11 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.56 1.544 . . . . 0.0 110.352 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.6 mt -94.44 135.73 35.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -104.98 152.65 22.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.28 1.032 . . . . 0.0 109.276 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 55.6 tp -146.68 102.75 3.94 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.999 1.32 . . . . 0.0 109.808 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -84.25 129.64 4.51 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.291 2.661 . . . . 0.0 110.979 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1010 ' ' VAL . . . . . 0.467 HG22 ' HE3' ' A' ' 23' ' ' LYS . 3.6 t -144.44 150.91 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.816 1.247 . . . . 0.0 107.65 178.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.66 99.04 3.95 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.771 1.623 . . . . 0.0 109.586 177.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -170.29 137.01 4.23 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 116.773 -2.126 . . . . 0.0 107.875 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -70.62 -52.03 24.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 121.429 2.614 . . . . 0.0 112.076 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.65 -41.41 88.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.893 0.77 . . . . 0.0 110.79 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -51.73 66.95 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 126.006 1.722 . . . . 0.0 108.742 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 36.4 t80 -68.38 -49.6 58.96 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.009 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.41 -56.8 13.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.809 1.244 . . . . 0.0 112.78 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.73 -48.44 81.68 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.236 1.015 . . . . 0.0 110.656 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.88 -39.41 91.83 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 119.09 -0.481 . . . . 0.0 111.058 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.28 -47.4 79.66 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.405 -0.807 . . . . 0.0 109.293 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.51 -49.21 73.19 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.416 0.553 . . . . 0.0 110.88 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 82.4 mt -65.41 -51.24 66.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 123.698 0.799 . . . . 0.0 110.027 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1023 ' ' LYS . . . . . 0.41 ' HE3' HG22 ' A' ' 10' ' ' VAL . 11.3 tmtt? -54.22 -55.55 26.97 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.609 1.164 . . . . 0.0 110.182 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.26 -42.71 95.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.329 -178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 8.3 t -58.09 -51.16 70.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.519 0.6 . . . . 0.0 109.532 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.28 -49.04 71.07 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.13 -53.12 60.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.977 0.911 . . . . 0.0 111.296 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.25 -42.47 93.27 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.015 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 16.0 tmm? -58.12 -47.25 83.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.383 0.673 . . . . 0.0 110.324 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -78.69 -18.97 53.52 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.114 0.87 . . . . 0.0 112.7 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 15.0 t80 -83.63 -53.41 5.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 119.422 1.01 . . . . 0.0 113.178 -177.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.67 157.51 74.43 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.85 90.99 0.72 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 124.445 3.43 . . . . 0.0 110.114 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -80.52 71.59 7.38 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.665 0.745 . . . . 0.0 110.724 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -58.94 -30.37 67.82 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.59 1.156 . . . . 0.0 109.069 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 14.1 m -67.1 -51.64 51.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.813 1.245 . . . . 0.0 109.767 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 69.9 mt -60.2 -41.93 88.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.599 0.76 . . . . 0.0 109.833 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.2 -58.33 8.41 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 87.4 m -66.15 -37.08 84.8 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.354 1.061 . . . . 0.0 112.225 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.89 -54.3 46.71 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.25 1.02 . . . . 0.0 109.162 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 54.7 ttt-85 -73.43 -31.95 64.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.118 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -63.57 -57.22 10.83 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 109.037 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -65.62 -34.37 78.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.15 -0.929 . . . . 0.0 111.335 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -61.26 -54.95 37.54 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.12 1.327 . . . . 0.0 108.73 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -63.72 -33.18 75.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.853 0.461 . . . . 0.0 111.347 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -68.52 -52.72 29.02 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 124.204 1.002 . . . . 0.0 109.74 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -52.78 -34.62 54.18 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.924 1.69 . . . . 0.0 110.965 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.48 -31.12 67.53 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 118.681 0.673 . . . . 0.0 110.721 178.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -69.93 -26.87 64.34 Favored 'General case' 0 C--N 1.342 0.269 0 O-C-N 121.074 -1.016 . . . . 0.0 111.816 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -60.26 -36.52 77.98 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.615 1.098 . . . . 0.0 110.395 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.24 -28.19 67.85 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.417 0.553 . . . . 0.0 110.788 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.24 -5.25 52.8 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.235 1.414 . . . . 0.0 112.499 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 33.38 39.46 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 129.675 3.19 . . . . 0.0 117.116 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 64.1 tttm -63.65 -22.77 67.07 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.154 -1.591 . . . . 0.0 111.573 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -142.71 178.26 7.76 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 125.963 1.705 . . . . 0.0 107.81 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 17.0 p -125.82 177.49 6.26 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.22 2.608 . . . . 0.0 107.498 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.28 138.9 50.92 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 40.5 pt -140.94 -178.51 1.53 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 126.391 1.876 . . . . 0.0 107.815 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -72.05 158.94 35.04 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 37.7 p . . . . . 0 C--O 1.256 1.437 0 CA-C-O 114.591 -2.623 . . . . 0.0 104.011 179.023 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.733 0 N-CA-C 110.736 -0.946 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 64.3 m -117.99 -177.19 3.21 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 125.108 1.363 . . . . 0.0 110.769 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -136.16 7.61 3.15 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -99.8 -47.74 4.95 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 120.417 1.462 . . . . 0.0 107.785 178.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -105.38 116.48 32.03 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 124.347 1.059 . . . . 0.0 109.573 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 3.9 m -146.67 153.76 40.65 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.563 1.145 . . . . 0.0 108.086 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -109.96 142.28 41.56 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -128.31 152.89 47.61 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.144 0.978 . . . . 0.0 111.033 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.3 mt -146.03 138.7 25.59 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.031 1.333 . . . . 0.0 107.538 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.24 105.59 5.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.816 1.247 . . . . 0.0 108.996 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 94.7 t -152.11 150.65 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 125.221 1.408 . . . . 0.0 108.925 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.15 101.78 10.79 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.743 1.156 . . . . 0.0 109.836 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.33 106.64 0.41 Allowed Glycine 0 N--CA 1.461 0.364 0 CA-C-O 114.922 -3.155 . . . . 0.0 107.034 177.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -59.0 -57.6 12.34 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 122.454 3.127 . . . . 0.0 114.92 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -65.02 -47.02 78.95 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.395 0.678 . . . . 0.0 109.897 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -62.11 -41.57 98.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.221 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1109 ' ' PHE . . . . . 0.487 ' CE2' ' HB3' ' B' ' 99' ' ' TYR . 80.2 t80 -66.41 -41.48 89.24 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 119.996 1.271 . . . . 0.0 111.188 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.18 -52.79 63.12 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.7 mt -58.07 -53.64 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 C-N-CA 124.417 1.087 . . . . 0.0 109.162 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 39.1 mt -56.36 -34.82 67.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 117.625 -1.179 . . . . 0.0 111.447 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.3 mtp -70.52 -43.85 68.75 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.815 1.643 . . . . 0.0 108.585 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -55.34 -51.37 66.97 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 54.0 mt -70.07 -33.28 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.335 1.054 . . . . 0.0 112.964 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -60.45 -60.15 4.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.246 1.385 . . . . 0.0 108.826 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.58 -38.07 89.72 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 117.402 -1.285 . . . . 0.0 109.116 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.4 t -52.41 -50.16 63.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 121.266 1.848 . . . . 0.0 111.757 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.88 -42.12 73.86 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.41 0.55 . . . . 0.0 111.322 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.47 87.7 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.344 0.658 . . . . 0.0 110.271 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.28 -48.42 34.77 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.826 1.65 . . . . 0.0 109.676 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.6 tpt -59.77 -30.54 68.94 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.938 1.245 . . . . 0.0 110.199 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -75.93 -41.63 51.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.325 1.05 . . . . 0.0 110.454 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.48 -32.45 54.31 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.391 0.996 . . . . 0.0 112.199 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -81.87 147.9 59.62 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.63 1.172 . . . . 0.0 108.723 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.24 172.13 13.68 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 N-CA-C 107.582 -1.738 . . . . 0.0 107.582 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -120.85 58.38 6.75 Favored Pre-proline 0 CA--C 1.546 0.812 0 O-C-N 120.676 -1.265 . . . . 0.0 111.43 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -73.29 -59.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.682 2.921 . . . . 0.0 113.749 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.8 -40.9 85.41 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -51.07 -48.03 30.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 0.0 109.53 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 10.8 t70 -65.32 -46.73 79.16 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -49.51 77.57 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.0 t80 -59.38 -44.18 92.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.346 1.458 . . . . 0.0 109.582 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -54.85 -48.82 72.42 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.269 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -68.84 -48.37 63.67 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 119.609 1.095 . . . . 0.0 111.958 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -57.26 -38.42 73.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.811 0.845 . . . . 0.0 110.283 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -81.34 -28.26 34.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.726 1.611 . . . . 0.0 110.963 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -60.36 -37.24 80.09 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.26 -9.92 5.92 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.54 -6.86 58.16 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.647 1.579 . . . . 0.0 109.926 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1141 ' ' GLN . . . . . 0.403 ' HG2' ' H ' ' D' 1142 ' ' ARG . 22.0 tt0 -112.77 176.61 4.94 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.548 1.539 . . . . 0.0 110.732 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D 1142 ' ' ARG . . . . . 0.403 ' H ' ' HG2' ' D' 1141 ' ' GLN . 39.5 mtm180 . . . . . 0 C--O 1.243 0.759 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 N--CA 1.47 0.553 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -76.71 33.27 0.14 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 128.549 2.74 . . . . 0.0 109.923 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -86.36 -10.89 53.48 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 127.65 2.38 . . . . 0.0 114.337 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 42.45 -147.71 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 129.123 2.969 . . . . 0.0 111.556 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 14.4 tp -134.29 108.44 8.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -115.07 168.62 9.76 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 120.226 1.375 . . . . 0.0 110.25 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -145.25 138.18 26.28 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.192 1.397 . . . . 0.0 107.417 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -112.0 97.97 40.38 Favored Pre-proline 0 C--O 1.232 0.165 0 CA-C-O 118.126 -0.94 . . . . 0.0 110.58 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.2 119.76 6.36 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.118 1.878 . . . . 0.0 107.316 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.6 t -143.59 148.57 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.282 1.033 . . . . 0.0 108.77 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.3 100.27 4.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.07 111.27 0.44 Allowed Glycine 0 C--O 1.226 -0.389 0 CA-C-O 116.463 -2.299 . . . . 0.0 108.036 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -59.8 -48.95 79.64 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 122.017 2.908 . . . . 0.0 112.564 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.7 -32.04 67.39 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.056 0.455 . . . . 0.0 109.907 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.6 m -65.26 -45.14 85.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.082 1.353 . . . . 0.0 109.272 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -61.35 -48.59 80.58 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.294 1.837 . . . . 0.0 109.437 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -53.7 -48.2 69.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.437 0.637 . . . . 0.0 110.416 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -67.8 -45.26 75.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.915 -0.491 . . . . 0.0 111.221 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.2 tp -62.65 -47.47 83.59 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 123.566 0.746 . . . . 0.0 112.876 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.44 -47.11 80.29 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.085 0.554 . . . . 0.0 109.987 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.69 -45.92 85.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.625 0.648 . . . . 0.0 111.287 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 65.2 mt -62.36 -52.61 57.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -57.15 -45.74 83.34 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 123.938 0.895 . . . . 0.0 111.47 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -58.9 -51.98 67.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.903 -0.57 . . . . 0.0 110.061 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.0 p -61.15 -40.39 93.67 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -67.25 -55.54 13.57 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.692 0.797 . . . . 0.0 109.481 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -56.94 -40.89 77.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.959 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.27 -47.49 85.77 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 119.903 1.229 . . . . 0.0 111.161 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.7 tmm? -57.69 -27.83 63.26 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.569 0.622 . . . . 0.0 110.164 178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -89.55 -27.11 20.48 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.255 -0.903 . . . . 0.0 110.921 178.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.59 -35.08 46.27 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 120.372 1.442 . . . . 0.0 110.35 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 72.9 mt -114.95 70.69 2.5 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.93 -24.92 45.36 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.7 1.6 . . . . 0.0 112.599 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -115.41 -35.46 4.61 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 117.923 -1.037 . . . . 0.0 112.491 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.45 -46.82 88.67 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.555 HG23 HG11 ' B' ' 125' ' ' VAL . 2.7 m -65.21 -46.83 79.08 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.116 1.325 . . . . 0.0 109.867 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.34 -34.75 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.932 1.293 . . . . 0.0 110.733 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -63.24 -51.49 66.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.32 1.048 . . . . 0.0 108.444 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.05 -37.98 84.55 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.35 0.523 . . . . 0.0 111.999 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -53.18 61.26 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -34.98 77.05 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.586 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -57.87 -57.1 14.26 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -54.64 -41.1 69.67 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.455 1.025 . . . . 0.0 110.102 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -57.99 -54.5 46.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.174 0.59 . . . . 0.0 111.519 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -71.94 -35.83 69.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.507 0.594 . . . . 0.0 111.497 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -59.41 -29.62 67.87 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.98 1.312 . . . . 0.0 111.031 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -57.38 -39.67 76.54 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.361 0.982 . . . . 0.0 109.508 179.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -66.58 -47.36 73.01 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -62.43 -28.9 70.12 Favored 'General case' 0 C--N 1.339 0.117 0 CA-C-O 118.715 -0.659 . . . . 0.0 111.865 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -65.0 -40.46 94.98 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.2 tp -70.37 -49.94 43.93 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.367 1.067 . . . . 0.0 109.6 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mp -58.61 -33.09 69.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.208 0.603 . . . . 0.0 110.5 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 50.09 -134.2 1.52 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.553 1.941 . . . . 0.0 111.099 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -138.19 -8.73 1.53 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -131.43 72.65 1.51 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 120.094 1.316 . . . . 0.0 107.533 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.6 p -132.04 -164.73 1.49 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.851 2.06 . . . . 0.0 107.977 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.0 p -137.75 -166.39 1.95 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.751 1.22 . . . . 0.0 108.301 179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.3 tt -49.94 118.82 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 124.194 0.998 . . . . 0.0 109.528 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.08 159.33 24.76 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.672 0.789 . . . . 0.0 109.867 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.6 t . . . . . 0 C--O 1.255 1.358 0 C-N-CA 127.895 2.478 . . . . 0.0 105.568 178.603 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.488 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 34.0 m -137.34 166.9 22.71 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 126.209 1.803 . . . . 0.0 107.811 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -119.69 140.01 51.34 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -69.42 -16.76 63.56 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 123.677 0.791 . . . . 0.0 111.732 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -82.77 46.13 1.06 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.316 1.055 . . . . 0.0 111.465 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.96 143.46 57.38 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 105.239 -2.134 . . . . 0.0 105.239 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -100.96 130.11 46.9 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -105.92 129.84 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.938 1.695 . . . . 0.0 107.128 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.561 HD23 ' H ' ' B' ' 102' ' ' GLN . 0.6 OUTLIER -126.08 150.18 48.36 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 179.6 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 102' ' ' GLN . . . . . 0.561 ' H ' HD23 ' B' ' 101' ' ' LEU . 48.9 tt0 -146.33 105.65 3.92 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.951 1.3 . . . . 0.0 113.508 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.4 t -150.48 149.76 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.272 1.396 . . . . 0.0 109.401 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.57 99.27 6.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 121.353 1.888 . . . . 0.0 109.241 178.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.16 133.43 5.29 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 108.125 -1.99 . . . . 0.0 108.125 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -67.93 -58.36 4.67 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 119.563 1.681 . . . . 0.0 112.55 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -67.86 -42.48 81.27 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -51.86 -50.37 61.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.973 1.709 . . . . 0.0 111.442 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -69.67 -51.39 35.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 117.774 -1.108 . . . . 0.0 112.0 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.09 -54.45 24.86 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.125 0.97 . . . . 0.0 112.651 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.21 -55.35 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 123.413 0.685 . . . . 0.0 110.804 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 89.6 mt -64.9 -28.49 69.57 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -52.02 20.62 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.86 1.209 . . . . 0.0 108.114 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -52.59 -50.53 62.85 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 19.3 mt -63.19 -36.12 82.58 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.032 -0.985 . . . . 0.0 112.14 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' LYS . . . . . 0.545 ' HE3' HD22 ' D' 1101 ' ' LEU . 11.1 tppt? -58.18 -56.59 20.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 120.404 1.456 . . . . 0.0 109.324 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.15 -33.74 76.48 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 119.232 -0.413 . . . . 0.0 110.618 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.3 t -63.69 -47.23 82.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.286 0.948 . . . . 0.0 109.501 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.44 -48.7 71.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.842 -1.075 . . . . 0.0 109.745 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -56.33 -39.37 72.69 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.364 0.984 . . . . 0.0 110.144 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.525 HD12 HG22 ' A' ' 36' ' ' THR . 2.2 mm? -67.35 -47.66 69.78 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.816 -0.552 . . . . 0.0 110.093 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -68.49 -19.42 64.54 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.308 0.504 . . . . 0.0 111.757 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.68 -43.64 20.05 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.088 -1.007 . . . . 0.0 108.692 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -76.38 -32.41 58.57 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' VAL . . . . . 0.555 HG11 HG23 ' A' ' 36' ' ' THR . 0.9 OUTLIER -94.87 147.57 33.33 Favored Pre-proline 0 N--CA 1.467 0.375 0 CA-C-N 119.45 1.023 . . . . 0.0 109.16 179.61 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.19 -178.41 3.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.197 1.931 . . . . 0.0 110.905 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.59 48.32 0.35 Allowed Pre-proline 0 CA--C 1.553 1.063 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 -178.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.31 -52.07 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.55 2.167 . . . . 0.0 112.593 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.53 -33.82 73.22 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.502 0.592 . . . . 0.0 109.624 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.14 -43.17 98.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -50.96 71.26 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.721 0.809 . . . . 0.0 111.202 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 74.0 m -66.85 -46.77 74.0 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -58.64 -43.9 89.88 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.733 0.813 . . . . 0.0 109.923 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -48.09 81.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 118.291 -0.861 . . . . 0.0 109.999 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.5 -54.85 40.48 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 118.766 0.712 . . . . 0.0 109.826 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -50.14 66.07 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.435 1.094 . . . . 0.0 111.632 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -65.13 -39.61 93.27 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.337 1.055 . . . . 0.0 110.62 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -56.67 -40.23 75.16 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.183 0.901 . . . . 0.0 109.936 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.4 mt -60.07 -24.39 64.54 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.528 0.731 . . . . 0.0 112.463 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.55 -17.2 64.56 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.854 0.862 . . . . 0.0 112.94 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.05 175.0 9.98 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.266 0.939 . . . . 0.0 109.657 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 31.6 mmm180 . . . . . 0 C--O 1.252 1.207 0 C-N-CA 125.449 1.499 . . . . 0.0 111.076 -179.494 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 21.8 p . . . . . 0 N--CA 1.475 0.819 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.09 33.21 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 130.536 3.534 . . . . 0.0 111.882 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -72.81 -43.51 62.63 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.465 1.906 . . . . 0.0 107.717 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.3 tt0 77.86 162.49 0.22 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 130.727 3.611 . . . . 0.0 109.906 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -90.2 101.72 14.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -105.02 167.26 9.82 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.71 137.66 38.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 94.25 23.41 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.16 122.38 9.22 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.735 2.29 . . . . 0.0 108.508 178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 84.4 t -144.67 148.04 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 125.0 1.32 . . . . 0.0 108.496 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.56 101.86 5.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -169.7 128.28 1.63 Allowed Glycine 0 CA--C 1.524 0.612 0 CA-C-O 115.404 -2.887 . . . . 0.0 109.714 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 36.0 mmm-85 -69.91 -50.3 43.51 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 123.25 3.525 . . . . 0.0 111.45 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -69.25 -36.96 77.7 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -58.19 -52.08 67.05 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 125.455 1.502 . . . . 0.0 110.112 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.2 t80 -63.39 -47.37 82.3 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.276 1.03 . . . . 0.0 110.244 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -53.19 -57.48 10.33 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -40.3 90.42 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.239 0.615 . . . . 0.0 111.566 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.55 -44.01 93.38 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.812 -0.613 . . . . 0.0 110.02 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.02 -48.0 72.57 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.89 0.876 . . . . 0.0 109.813 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.32 -48.63 73.87 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.951 0.5 . . . . 0.0 110.362 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 97.8 mt -65.08 -50.36 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -50.46 -46.55 56.81 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.37 1.068 . . . . 0.0 110.315 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.87 -49.65 67.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.322 -0.847 . . . . 0.0 111.402 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 87.2 p -56.0 -38.87 71.05 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.593 1.088 . . . . 0.0 113.073 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -73.02 -45.83 55.48 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -57.54 -39.15 75.97 Favored 'General case' 0 C--N 1.342 0.265 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -64.04 -45.1 90.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 116.741 -1.6 . . . . 0.0 110.938 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 26.5 ttm -58.49 -43.58 89.07 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.822 1.192 . . . . 0.0 108.381 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -65.67 -34.5 78.35 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.419 0.688 . . . . 0.0 112.251 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -81.09 -36.82 29.9 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.726 1.148 . . . . 0.0 111.806 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 50.1 mt -117.88 65.63 5.27 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 126.016 1.726 . . . . 0.0 111.115 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -74.9 -4.46 15.45 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.509 2.806 . . . . 0.0 113.643 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -138.74 -24.47 0.92 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.368 1.067 . . . . 0.0 111.764 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 1.9 t60 -68.59 -58.03 4.87 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.614 1.165 . . . . 0.0 108.887 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1036 ' ' THR . . . . . 0.576 HG23 HG21 ' D' 1125 ' ' VAL . 17.3 m -62.3 -40.53 96.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.391 1.077 . . . . 0.0 110.89 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.92 -43.8 93.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.11 -47.54 84.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.751 -1.118 . . . . 0.0 108.764 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -35.95 64.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.358 1.435 . . . . 0.0 111.929 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -53.91 32.13 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -36.63 84.64 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.727 -0.608 . . . . 0.0 111.06 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -59.31 -48.13 82.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.907 1.283 . . . . 0.0 108.75 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -63.09 -44.31 96.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.514 1.052 . . . . 0.0 109.173 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -55.03 -43.03 73.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.996 0.919 . . . . 0.0 110.623 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.56 -42.75 58.23 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.104 0.962 . . . . 0.0 110.326 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -61.87 -34.33 75.82 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 123.938 0.895 . . . . 0.0 110.777 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -59.07 -32.87 70.18 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.922 0.783 . . . . 0.0 109.618 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -75.38 -53.96 7.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 178.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 21.1 mm100 -59.78 -29.52 68.25 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -59.39 -36.79 76.47 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.085 0.954 . . . . 0.0 108.975 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 63.9 tp -75.28 -49.92 17.69 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.723 0.809 . . . . 0.0 109.545 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.3 -27.34 67.23 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.908 0.483 . . . . 0.0 110.64 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 47.16 -126.05 1.62 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.639 2.376 . . . . 0.0 111.566 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -142.37 -46.96 0.34 Allowed 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.403 1.081 . . . . 0.0 112.255 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.45 70.29 6.94 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.18 0.9 . . . . 0.0 108.758 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 12.2 p -133.01 -158.63 0.9 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.905 2.082 . . . . 0.0 108.594 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 60.0 p -143.78 -135.97 0.09 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 15.0 tt -67.3 161.23 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 119.208 0.913 . . . . 0.0 110.338 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.33 159.45 43.34 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.771 2.028 . . . . 0.0 106.663 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.255 1.344 0 C-N-CA 125.472 1.509 . . . . 0.0 107.2 179.658 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.78 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.63 178.63 9.65 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 125.084 1.353 . . . . 0.0 108.418 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 4.0 t0 -146.92 149.9 34.12 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -92.63 9.26 35.51 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.273 0.629 . . . . 0.0 110.655 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -89.62 25.23 2.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.604 1.962 . . . . 0.0 108.399 177.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 17.3 m -60.02 135.78 57.82 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 119.758 -1.839 . . . . 0.0 109.83 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -101.89 128.99 48.04 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -106.58 155.28 19.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1101 ' ' LEU . . . . . 0.545 HD22 ' HE3' ' B' ' 116' ' ' LYS . 0.8 OUTLIER -152.48 127.97 10.01 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 179.389 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -119.93 106.2 11.81 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.026 2.13 . . . . 0.0 112.058 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 21.2 t -155.35 150.1 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.962 1.305 . . . . 0.0 110.37 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.44 103.37 11.46 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.7 116.98 1.2 Allowed Glycine 0 CA--C 1.51 -0.23 0 N-CA-C 104.615 -3.394 . . . . 0.0 104.615 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -65.76 -57.7 7.38 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.092 1.946 . . . . 0.0 113.644 -177.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -71.99 -38.85 69.58 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 119.424 1.011 . . . . 0.0 108.414 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -54.73 -50.49 68.24 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.282 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 13.9 t80 -64.69 -42.63 95.2 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 119.562 1.073 . . . . 0.0 110.432 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.12 -54.28 38.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.055 0.843 . . . . 0.0 110.942 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.73 -57.5 10.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 126.668 1.987 . . . . 0.0 111.057 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 57.1 mt -58.89 -36.34 74.51 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.651 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.9 tmt? -70.25 -52.13 25.37 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.755 1.161 . . . . 0.0 108.778 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.1 ttmm -51.97 -51.88 54.19 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 65.7 mt -65.7 -32.34 73.84 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.152 -0.928 . . . . 0.0 112.146 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -63.33 -48.29 78.62 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.586 1.539 . . . . 0.0 108.719 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -66.67 -41.53 88.0 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.77 -42.2 75.15 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.513 0.725 . . . . 0.0 110.267 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.88 -52.45 50.07 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.093 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.01 -43.01 86.44 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.588 1.086 . . . . 0.0 110.355 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.5 mm? -61.42 -48.97 78.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.44 0.696 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.45 -28.0 67.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.063 -0.398 . . . . 0.0 111.585 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -80.31 -23.29 40.76 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 126.693 1.997 . . . . 0.0 113.129 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -94.64 -27.51 15.84 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.287 0.635 . . . . 0.0 110.41 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1125 ' ' VAL . . . . . 0.576 HG21 HG23 ' C' 1036 ' ' THR . 81.2 t -95.2 147.46 33.07 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 124.936 1.294 . . . . 0.0 109.111 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1126 ' ' PRO . . . . . 0.425 ' HD2' HG13 ' D' 1125 ' ' VAL . 67.3 Cg_endo -71.3 -173.11 0.86 Allowed 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.926 2.417 . . . . 0.0 110.432 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.27 35.71 0.11 Allowed Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 117.749 2.5 . . . . 0.0 117.749 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.73 -51.41 4.97 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 123.446 2.267 . . . . 0.0 114.281 -178.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.26 -40.14 92.97 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.0 t -57.56 -47.77 84.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.434 0 C-N-CA 123.668 0.787 . . . . 0.0 109.406 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 44.5 t0 -60.58 -52.01 66.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.509 1.124 . . . . 0.0 110.465 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 41.3 m -60.9 -42.36 97.88 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.905 -0.497 . . . . 0.0 111.743 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.69 -52.33 39.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.914 0.886 . . . . 0.0 109.517 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.5 69.15 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.262 1.425 . . . . 0.0 111.193 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -67.32 -47.98 68.95 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.492 1.042 . . . . 0.0 110.86 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -58.86 -42.53 89.64 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.224 0.92 . . . . 0.0 109.692 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -65.18 -32.68 74.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.312 1.445 . . . . 0.0 109.2 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -59.54 -44.3 93.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.7 mt -64.39 -11.22 30.58 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.482 1.113 . . . . 0.0 113.577 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 13.2 tp -79.65 -19.34 49.36 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.726 1.148 . . . . 0.0 110.167 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -126.51 177.58 6.41 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.537 1.935 . . . . 0.0 108.666 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 39.7 mmt180 . . . . . 0 C--O 1.248 1.001 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.575 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.0 m . . . . . 0 N--CA 1.472 0.664 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -62.48 -26.55 68.59 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 120.587 -1.32 . . . . 0.0 111.527 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -105.65 7.81 32.85 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.496 1.918 . . . . 0.0 113.837 -179.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -58.2 104.94 0.23 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.563 1.145 . . . . 0.0 111.176 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tp -73.12 106.18 4.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.48 161.08 15.38 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -136.32 116.41 13.37 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.425 2.29 . . . . 0.0 105.797 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.82 105.16 15.4 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -75.23 117.13 4.75 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.325 2.683 . . . . 0.0 110.272 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.7 t -145.11 150.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 123.563 0.745 . . . . 0.0 109.532 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -135.11 102.21 5.12 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.862 -1.149 . . . . 0.0 109.837 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.0 135.2 3.53 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 107.529 -2.229 . . . . 0.0 107.529 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -70.78 -52.25 21.85 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.561 2.181 . . . . 0.0 110.419 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -30.81 64.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.68 1.192 . . . . 0.0 108.888 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.4 m -60.89 -49.92 75.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.74 1.216 . . . . 0.0 107.739 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -62.86 -39.9 95.84 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.264 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.46 -57.41 11.31 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.013 0.824 . . . . 0.0 111.704 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 35.6 ttm -57.71 -44.7 86.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.597 0.635 . . . . 0.0 110.359 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.6 mt -59.54 -48.57 81.15 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.382 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.76 -40.95 88.46 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.576 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.18 -49.45 76.99 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.247 1.385 . . . . 0.0 109.56 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.47 HD11 ' CG2' ' D' 1111 ' ' ILE . 93.5 mt -67.15 -51.57 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.701 -0.625 . . . . 0.0 109.769 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HE3' HG22 ' C' 1010 ' ' VAL . 12.3 tmtt? -56.69 -48.56 77.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 117.814 -1.089 . . . . 0.0 112.146 -178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.19 -55.79 30.37 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.4 m -56.74 -36.36 69.66 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.49 -37.89 50.29 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.981 0.81 . . . . 0.0 111.925 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -63.8 -50.36 69.27 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.269 -0.895 . . . . 0.0 108.692 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.413 HD13 ' HB ' ' B' ' 130' ' ' VAL . 77.3 mt -61.08 -52.08 66.44 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.861 1.265 . . . . 0.0 111.376 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.3 ppp? -56.93 -45.9 82.42 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.267 0.939 . . . . 0.0 111.854 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -74.34 -29.37 61.56 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.254 0.934 . . . . 0.0 112.879 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -71.03 -47.15 60.25 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.955 0.798 . . . . 0.0 110.425 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.1 tp -120.51 75.52 25.31 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 124.855 1.262 . . . . 0.0 108.741 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -80.66 67.45 8.63 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.875 3.05 . . . . 0.0 112.764 -178.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -59.44 168.96 1.36 Allowed 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.327 0.651 . . . . 0.0 111.161 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -48.26 -46.59 35.89 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 123.714 0.806 . . . . 0.0 112.267 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -58.2 -51.26 70.5 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.485 1.039 . . . . 0.0 110.766 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.32 -42.26 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.904 1.682 . . . . 0.0 109.704 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.56 -42.82 67.35 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.417 0.687 . . . . 0.0 111.535 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.281 1.433 . . . . 0.0 109.912 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.67 -51.11 70.76 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -55.23 -48.51 73.81 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.412 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -56.91 -42.07 79.26 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.75 0.82 . . . . 0.0 110.818 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -55.04 -54.76 38.95 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.777 1.231 . . . . 0.0 111.497 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -78.23 -40.76 36.37 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.339 0.518 . . . . 0.0 111.709 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -55.61 -41.09 72.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.51 1.124 . . . . 0.0 111.713 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -54.22 -45.96 72.39 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -69.04 -53.68 19.13 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.168 0.587 . . . . 0.0 110.092 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -52.7 -38.69 61.05 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.193 1.797 . . . . 0.0 113.532 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -56.12 -26.53 50.37 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.108 0.963 . . . . 0.0 113.056 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -66.34 -27.82 68.18 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.772 -1.205 . . . . 0.0 110.134 178.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 mp -95.05 9.6 38.89 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.464 2.306 . . . . 0.0 112.039 178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.3 tp -64.68 -6.24 7.42 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -178.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -76.96 80.47 3.5 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 120.582 1.537 . . . . 0.0 108.884 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -61.01 -35.39 76.73 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 124.584 1.154 . . . . 0.0 111.508 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 26.9 96.89 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 130.262 3.425 . . . . 0.0 114.161 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.7 m 70.16 55.9 0.3 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.655 1.182 . . . . 0.0 111.476 178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -158.56 108.56 2.04 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 120.841 -1.162 . . . . 0.0 110.181 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.0 tt -156.53 141.62 9.06 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 C-N-CA 126.195 1.798 . . . . 0.0 108.588 179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.444 ' HB2' ' HE2' ' B' ' 107' ' ' LYS . 3.1 tt0 -147.0 159.05 44.04 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.668 1.987 . . . . 0.0 107.76 179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 p . . . . . 0 C--O 1.256 1.398 0 CA-C-O 117.275 -1.345 . . . . 0.0 108.745 179.742 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.628 0 N-CA-C 108.911 -1.676 . . . . 0.0 108.911 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 15.0 m 62.96 86.52 0.12 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.689 1.596 . . . . 0.0 113.913 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -144.46 96.36 2.86 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 177.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -139.86 -16.6 0.99 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.087 0.955 . . . . 0.0 113.086 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.94 165.43 17.78 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.049 0.94 . . . . 0.0 109.961 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.96 143.64 48.3 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.275 -0.891 . . . . 0.0 109.572 -178.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -102.4 130.28 49.11 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.59 116.94 27.06 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.567 1.147 . . . . 0.0 108.4 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.52 141.34 35.51 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -140.47 104.35 4.75 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.0 m -155.49 150.57 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 112.011 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -110.75 101.92 10.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.214 1.37 . . . . 0.0 108.187 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.66 116.13 0.91 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-O 116.763 -2.132 . . . . 0.0 108.916 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -66.88 -57.14 7.57 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 121.717 2.759 . . . . 0.0 113.425 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' LYS . . . . . 0.444 ' HE2' ' HB2' ' A' ' 59' ' ' GLN . 5.5 mptt -66.29 -44.63 82.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -52.12 -50.51 61.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 125.756 1.622 . . . . 0.0 110.908 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -63.97 -47.07 81.85 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.942 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -51.21 -53.87 30.97 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 124.063 0.852 . . . . 0.0 110.427 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.7 mt -60.17 -58.22 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 125.251 1.42 . . . . 0.0 110.494 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mp -55.62 -44.24 76.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 117.824 -1.084 . . . . 0.0 113.232 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 22.4 ttp -62.73 -48.07 80.84 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 119.907 1.231 . . . . 0.0 109.961 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -55.76 -50.94 69.06 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 118.428 0.558 . . . . 0.0 110.274 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 mt -65.51 -30.73 71.53 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 24.8 tptt -64.51 -60.0 3.66 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.65 -44.6 81.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.194 0.998 . . . . 0.0 110.896 -179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 31.0 t -52.55 -46.45 66.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.041 0.937 . . . . 0.0 110.33 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.67 -45.88 56.66 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.984 0.514 . . . . 0.0 111.204 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -56.34 -39.88 73.56 Favored 'General case' 0 C--O 1.238 0.473 0 O-C-N 121.672 -0.642 . . . . 0.0 110.343 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.75 -53.88 23.75 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.137 0.975 . . . . 0.0 108.523 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.31 -39.69 67.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.833 0.742 . . . . 0.0 112.401 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -73.3 -29.27 62.6 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.372 1.069 . . . . 0.0 110.4 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 20.8 tp -86.31 -33.23 20.67 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.853 -1.154 . . . . 0.0 113.643 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 12.4 m -94.97 148.27 34.43 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 120.019 1.281 . . . . 0.0 110.883 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.62 -174.93 1.19 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.187 1.925 . . . . 0.0 109.066 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -113.58 82.13 6.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 O-C-N 121.614 -0.678 . . . . 0.0 112.244 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -80.86 -102.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.494 0 C-N-CA 124.181 3.254 . . . . 0.0 111.873 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.27 -35.7 65.31 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.541 -1.35 . . . . 0.0 109.99 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.413 ' HB ' HD13 ' A' ' 28' ' ' LEU . 3.7 m -56.39 -37.03 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 C-N-CA 124.351 1.06 . . . . 0.0 112.581 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.29 -46.67 22.27 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 6.1 m -56.23 -42.46 77.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 123.385 0.428 . . . . 0.0 110.329 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -67.78 -50.53 56.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 126.168 1.787 . . . . 0.0 108.315 178.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -52.85 -47.74 67.55 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.601 1.091 . . . . 0.0 111.134 -178.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.85 -42.2 86.12 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.172 0.897 . . . . 0.0 112.559 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.84 -38.28 82.97 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.525 -0.734 . . . . 0.0 110.517 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -46.81 78.0 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.53 -35.11 65.31 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.55 1.54 . . . . 0.0 110.975 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.32 -24.47 29.07 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.356 1.434 . . . . 0.0 111.832 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.4 tt -65.6 -36.7 84.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 110.265 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.29 102.96 4.62 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.68 1.592 . . . . 0.0 111.74 -179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 54.1 ttt-85 . . . . . 0 C--O 1.245 0.841 0 C-N-CA 125.016 1.327 . . . . 0.0 108.69 179.922 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 N--CA 1.467 0.416 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -62.82 -29.95 71.12 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 120.512 -1.368 . . . . 0.0 111.503 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -79.96 2.42 23.61 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.809 2.044 . . . . 0.0 113.909 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.73 99.61 0.16 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 120.142 1.337 . . . . 0.0 110.139 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.1 tp -69.19 95.53 0.76 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.85 0.86 . . . . 0.0 109.247 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.21 170.97 9.02 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.739 1.216 . . . . 0.0 109.519 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -146.12 154.62 42.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.973 1.309 . . . . 0.0 108.532 179.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -125.36 91.97 47.91 Favored Pre-proline 0 N--CA 1.45 -0.439 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.94 112.4 3.28 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.592 2.194 . . . . 0.0 107.033 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1010 ' ' VAL . . . . . 0.5 HG22 ' HE3' ' A' ' 23' ' ' LYS . 46.7 t -144.83 155.7 14.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -135.44 103.76 5.59 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.67 112.69 0.51 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 105.62 -2.992 . . . . 0.0 105.62 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -59.49 -51.91 67.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 122.172 2.986 . . . . 0.0 108.615 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -71.04 -39.95 72.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.221 1.009 . . . . 0.0 111.145 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -63.51 -42.16 98.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.45 0.7 . . . . 0.0 110.261 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 71.2 t80 -61.68 -45.14 95.29 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.769 1.228 . . . . 0.0 108.89 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -56.64 -50.43 72.08 Favored 'General case' 0 N--CA 1.462 0.161 0 O-C-N 123.28 0.363 . . . . 0.0 110.857 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.3 ttm -64.79 -46.08 83.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.117 0.567 . . . . 0.0 111.293 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 46.9 mt -60.46 -46.48 89.91 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.403 -178.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.69 -49.04 70.0 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.265 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.91 -49.7 70.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.388 0.675 . . . . 0.0 111.468 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 79.2 mt -70.17 -39.27 76.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.647 -0.658 . . . . 0.0 110.372 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -61.26 -45.47 94.37 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.56 0.744 . . . . 0.0 110.752 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -52.26 65.89 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.0 0.92 . . . . 0.0 108.654 -179.112 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 26.7 m -58.1 -45.87 86.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 123.479 0.712 . . . . 0.0 112.33 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.43 -36.39 81.14 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.869 0.758 . . . . 0.0 111.099 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.59 -48.49 66.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 121.638 -0.664 . . . . 0.0 111.421 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.47 -40.66 70.13 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.071 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 5.2 ppp? -62.49 -40.22 95.99 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.316 0.962 . . . . 0.0 109.928 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -76.21 -34.89 59.27 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 118.961 0.8 . . . . 0.0 111.438 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 59.9 t80 -69.56 -40.06 77.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.088 0.858 . . . . 0.0 112.626 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 28.4 tp -126.57 75.2 74.59 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -76.71 79.91 2.94 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.888 3.059 . . . . 0.0 112.179 -178.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -63.38 163.56 10.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.724 1.209 . . . . 0.0 108.631 178.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -55.74 -35.69 66.44 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.041 0.837 . . . . 0.0 110.618 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.0 m -56.31 -52.23 65.28 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.697 1.135 . . . . 0.0 110.22 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.96 -46.21 92.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 128.243 2.617 . . . . 0.0 111.424 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -69.87 -47.5 62.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.809 -0.615 . . . . 0.0 111.642 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.7 m -55.12 -39.28 69.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.81 0.844 . . . . 0.0 109.062 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -53.58 49.23 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.272 0.629 . . . . 0.0 110.695 178.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -57.49 -44.27 84.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 118.795 -0.621 . . . . 0.0 110.046 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -54.61 -44.09 72.77 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.147 0.579 . . . . 0.0 110.208 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -61.83 -55.29 31.41 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.0 -44.06 73.55 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.86 0.755 . . . . 0.0 112.602 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -55.99 -36.36 67.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.521 1.529 . . . . 0.0 112.308 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -57.37 -36.59 71.42 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.635 0.652 . . . . 0.0 110.862 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -70.29 -53.0 18.66 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.879 0.763 . . . . 0.0 109.487 178.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -53.79 -33.28 55.47 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 124.877 1.271 . . . . 0.0 112.555 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -57.13 -33.45 67.39 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.983 0.81 . . . . 0.0 112.664 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 36.4 m80 -65.52 -32.63 74.33 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.346 0.976 . . . . 0.0 109.935 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 3.8 mp -93.19 7.95 42.18 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.642 1.577 . . . . 0.0 111.768 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 15.8 tp -62.05 -8.2 5.02 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.887 1.222 . . . . 0.0 113.994 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -68.25 72.36 0.19 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.477 2.311 . . . . 0.0 109.157 178.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 2.3 mtpp -65.64 -31.39 72.38 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.11 -0.994 . . . . 0.0 112.219 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 40.5 tt0 24.92 92.89 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.554 3.142 . . . . 0.0 113.393 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 15.2 m 68.03 69.58 0.33 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.375 1.07 . . . . 0.0 110.059 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 4.2 t -168.12 113.68 0.66 Allowed 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.318 1.447 . . . . 0.0 107.101 179.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 19.0 tt -161.8 151.19 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 124.258 1.023 . . . . 0.0 109.837 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -146.6 159.62 43.21 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.344 2.258 . . . . 0.0 105.863 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 85.9 p . . . . . 0 C--O 1.253 1.259 0 CA-C-O 116.62 -1.657 . . . . 0.0 109.886 -179.219 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.853 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 73.79 89.03 0.09 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 126.442 1.897 . . . . 0.0 109.304 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 11.7 t70 -130.65 85.37 2.27 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.583 2.353 . . . . 0.0 106.042 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -138.95 -46.76 0.48 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.898 1.279 . . . . 0.0 109.077 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 27.9 t0 -55.44 117.3 3.45 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 125.29 1.436 . . . . 0.0 109.192 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.64 149.21 38.24 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.555 1.542 . . . . 0.0 110.035 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -102.38 157.23 17.06 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -137.27 158.02 45.35 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.96 0.504 . . . . 0.0 109.728 -179.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 1.3 mt -152.51 108.68 3.39 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -102.08 98.74 8.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.13 2.572 . . . . 0.0 105.874 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.3 m -151.86 151.43 12.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 C-N-CA 124.783 1.233 . . . . 0.0 110.046 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -122.26 102.35 8.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 118.994 0.815 . . . . 0.0 112.056 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.42 113.37 0.79 Allowed Glycine 0 CA--C 1.504 -0.621 0 N-CA-C 105.179 -3.168 . . . . 0.0 105.179 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.39 -56.85 16.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 119.667 1.734 . . . . 0.0 110.623 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 37.9 mttp -62.62 -49.31 75.69 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.289 1.036 . . . . 0.0 108.624 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -52.46 -49.54 64.44 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.89 1.276 . . . . 0.0 111.251 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.5 t80 -65.12 -39.92 93.76 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 119.412 1.005 . . . . 0.0 111.77 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -54.57 -53.56 52.91 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.209 0.913 . . . . 0.0 108.805 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1111 ' ' ILE . . . . . 0.47 ' CG2' HD11 ' A' ' 22' ' ' ILE . 37.8 mt -62.38 -57.79 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.998 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.66 -45.38 81.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 116.953 -1.499 . . . . 0.0 113.81 -178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 2.0 ttt -61.79 -49.0 78.09 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 120.851 1.66 . . . . 0.0 109.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -57.31 -52.06 66.87 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.47 -25.89 66.93 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.778 -0.576 . . . . 0.0 112.122 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.4 tptt -63.06 -60.54 3.3 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 118.901 0.773 . . . . 0.0 109.303 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.98 -31.95 73.44 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 124.679 1.237 . . . . 0.0 111.459 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 33.4 t -55.16 -51.99 64.72 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.016 0.826 . . . . 0.0 109.173 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.22 -42.89 79.12 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 122.197 0.199 . . . . 0.0 110.878 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -59.19 -45.0 92.22 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.531 -0.73 . . . . 0.0 110.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 30.6 mt -65.78 -53.82 35.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.189 0.995 . . . . 0.0 109.773 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.66 -34.24 69.17 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.885 0.766 . . . . 0.0 110.834 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -79.04 -22.21 45.74 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.712 1.142 . . . . 0.0 110.369 178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 48.9 tp -90.48 -34.3 15.63 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 120.688 -1.257 . . . . 0.0 113.124 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 13.8 m -95.28 147.45 33.04 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 119.763 1.165 . . . . 0.0 110.832 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.0 178.04 5.78 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.075 1.85 . . . . 0.0 108.721 178.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -108.89 87.85 4.93 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -84.98 -100.45 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.327 0 C-N-CA 124.048 3.165 . . . . 0.0 108.884 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.8 -32.99 64.0 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 126.545 1.938 . . . . 0.0 111.269 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.1 m -56.9 -41.33 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 118.869 0.758 . . . . 0.0 110.755 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -74.68 -45.45 44.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.416 1.086 . . . . 0.0 109.425 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 43.5 m -61.31 -38.47 86.98 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 20.2 t80 -67.28 -52.58 38.97 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.911 1.285 . . . . 0.0 107.699 178.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -48.24 69.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.394 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -61.71 -53.9 49.79 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.819 0.736 . . . . 0.0 111.42 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -58.14 -40.51 81.52 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.806 -0.558 . . . . 0.0 111.425 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 12.8 tm0? -70.69 -33.61 71.1 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.852 0.861 . . . . 0.0 110.144 178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.64 -32.86 73.97 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.912 1.285 . . . . 0.0 108.912 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 77.3 mt -54.75 -25.31 26.95 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.112 0.869 . . . . 0.0 112.387 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.3 tt -74.1 -30.27 62.26 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.219 1.408 . . . . 0.0 111.054 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.39 96.0 2.88 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.952 -1.092 . . . . 0.0 112.01 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 0.997 0 CA-C-O 116.185 -1.864 . . . . 0.0 109.643 179.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.465 0.287 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.21 -9.14 19.85 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.227 -0.92 . . . . 0.0 112.283 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -79.49 -12.46 59.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.866 1.266 . . . . 0.0 113.646 -179.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.72 106.13 1.13 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.877 1.271 . . . . 0.0 111.008 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 47.6 tp -72.0 118.01 14.34 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.832 0.853 . . . . 0.0 108.777 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.2 mp -113.92 162.45 16.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.369 1.867 . . . . 0.0 107.388 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -135.23 124.25 24.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.13 96.05 1.13 Allowed Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.49 1.516 . . . . 0.0 108.782 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.31 103.51 1.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.489 2.793 . . . . 0.0 112.021 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -138.61 156.16 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.514 -1.366 . . . . 0.0 109.14 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -135.31 103.11 5.39 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 104.743 -2.317 . . . . 0.0 104.743 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 114.53 0.59 Allowed Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 106.716 -2.554 . . . . 0.0 106.716 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.0 tpt85 -64.52 -51.04 64.95 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 120.519 2.16 . . . . 0.0 110.535 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.46 -32.47 71.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.805 0.73 . . . . 0.0 110.684 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -66.64 -50.93 61.35 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 110.28 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -56.87 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.877 0.871 . . . . 0.0 109.015 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -55.65 -49.5 72.74 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.418 0.287 . . . . 0.0 110.587 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.6 ttm -61.17 -47.25 87.04 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.67 0.668 . . . . 0.0 111.281 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.64 -32.07 73.44 Favored 'General case' 0 C--O 1.227 -0.099 0 CA-C-O 118.53 -0.748 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -71.23 -53.97 12.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.468 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.05 -48.83 77.59 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.121 0.968 . . . . 0.0 111.181 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.0 mt -71.98 -36.96 59.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 O-C-N 121.527 -0.733 . . . . 0.0 111.574 -178.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -66.31 -52.44 47.21 Favored 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 121.063 -1.023 . . . . 0.0 109.228 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.64 -37.31 87.14 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.938 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -56.13 -52.11 65.5 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.289 0.95 . . . . 0.0 109.459 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -65.98 -48.43 71.27 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.11 0.564 . . . . 0.0 111.666 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -50.59 73.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-N 118.416 0.553 . . . . 0.0 111.149 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.11 -38.86 92.6 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 117.692 -1.147 . . . . 0.0 109.786 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.43 -28.94 67.41 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.22 1.008 . . . . 0.0 110.208 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -90.98 -30.79 16.62 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.468 -0.77 . . . . 0.0 111.018 178.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -78.67 -25.32 44.87 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 118.149 -0.929 . . . . 0.0 113.206 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -77.45 163.39 64.42 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -85.32 152.32 10.65 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 121.581 1.521 . . . . 0.0 108.786 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.46 -2.97 0.14 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.315 2.246 . . . . 0.0 115.544 -179.174 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -47.89 -58.66 4.1 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.323 1.449 . . . . 0.0 113.351 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.2 m -66.6 -32.58 74.01 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.55 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.0 mm -62.27 -47.42 93.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.99 -53.94 51.86 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.661 0.785 . . . . 0.0 110.909 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.6 m -58.08 -50.17 74.38 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.384 1.874 . . . . 0.0 110.51 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.97 -49.41 77.96 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.507 0.723 . . . . 0.0 110.014 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.0 mtp85 -58.92 -43.19 91.05 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -61.32 -55.06 36.02 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.317 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -53.19 -54.31 37.76 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.924 0.89 . . . . 0.0 110.381 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -53.6 -47.92 69.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.037 1.335 . . . . 0.0 111.153 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -67.42 -46.09 74.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.71 0.804 . . . . 0.0 111.484 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -59.4 -42.37 91.61 Favored 'General case' 0 CA--C 1.528 0.1 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -59.81 -29.48 68.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 118.033 -0.984 . . . . 0.0 111.746 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -65.42 -54.41 29.06 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 106.146 -1.798 . . . . 0.0 106.146 177.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.31 -49.28 67.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.865 0.866 . . . . 0.0 109.084 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -58.5 -30.04 66.72 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.2 1.0 . . . . 0.0 113.551 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.08 -34.49 29.35 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.743 1.156 . . . . 0.0 109.376 179.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 mp -67.98 -45.61 73.64 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -69.46 167.03 17.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.014 1.726 . . . . 0.0 108.814 179.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -131.34 53.51 1.98 Allowed 'General case' 0 N--CA 1.462 0.142 0 O-C-N 121.374 -0.829 . . . . 0.0 109.426 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -148.98 161.08 42.63 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 125.724 1.61 . . . . 0.0 107.659 179.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.8 p -79.17 163.41 25.05 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.953 0.901 . . . . 0.0 110.616 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.9 t -68.72 139.08 55.37 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.3 tt -161.11 136.63 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 179.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -146.4 158.68 43.92 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.259 1.566 0 C-N-CA 128.596 2.758 . . . . 0.0 105.905 178.581 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.908 0 N-CA-C 110.744 -0.942 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 37.2 m -135.9 -179.23 5.53 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.528 1.931 . . . . 0.0 109.64 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -63.86 70.42 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 127.599 2.36 . . . . 0.0 114.364 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -139.66 -34.66 0.56 Allowed 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 129.148 2.979 . . . . 0.0 107.997 178.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . 0.252 2.7 t70 55.56 -138.45 1.05 Allowed 'General case' 0 C--O 1.236 0.39 0 C-N-CA 126.794 2.037 . . . . 0.0 110.738 -179.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.2 m -153.39 158.33 41.31 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 120.983 1.72 . . . . 0.0 107.977 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -111.0 139.57 46.24 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -124.75 144.1 50.42 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.874 1.67 . . . . 0.0 110.691 -177.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.6 mp -131.17 145.77 52.08 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.487 1.515 . . . . 0.0 108.872 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -145.64 107.4 4.28 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.133 1.773 . . . . 0.0 108.357 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 70.7 t -155.63 151.16 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 127.306 2.242 . . . . 0.0 108.498 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -107.51 101.71 11.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 177.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.73 114.54 0.87 Allowed Glycine 0 CA--C 1.523 0.563 0 CA-C-O 116.851 -2.083 . . . . 0.0 108.092 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -68.17 -58.48 4.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.854 2.827 . . . . 0.0 113.963 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -62.74 -46.44 88.07 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -54.97 -44.53 74.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 124.302 1.001 . . . . 0.0 112.031 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -65.21 -48.58 72.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 120.078 1.308 . . . . 0.0 110.789 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -58.7 -49.44 77.58 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.645 1.111 . . . . 0.0 110.816 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 68.8 mt -61.51 -53.68 45.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.312 1.445 . . . . 0.0 111.311 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 8.8 mt -63.58 -35.83 81.79 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 117.476 -1.25 . . . . 0.0 110.573 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 30.5 mtp -62.13 -46.66 88.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 120.491 1.496 . . . . 0.0 110.87 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -64.21 -51.83 61.78 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.924 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 85.3 mt -60.68 -34.82 74.91 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.5 tppt? -63.73 -53.83 44.91 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -62.51 -45.75 91.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.7 0.625 . . . . 0.0 111.95 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 22.5 m -57.09 -38.53 73.5 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.524 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -45.28 72.59 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.851 0.751 . . . . 0.0 109.77 179.473 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -58.84 -44.54 90.97 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.85 -32.82 69.96 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.535 -0.728 . . . . 0.0 110.086 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 27.0 ttt -66.97 -40.99 87.6 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.73 -31.37 72.33 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 118.46 0.573 . . . . 0.0 110.638 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 tp -71.53 -34.28 69.91 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.341 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.2 m -94.51 148.95 35.82 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 119.424 1.011 . . . . 0.0 112.636 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.5 -91.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.918 0 N-CA-C 107.395 -1.809 . . . . 0.0 107.395 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -160.96 57.82 0.91 Allowed Pre-proline 0 CA--C 1.546 0.793 0 CA-C-N 120.99 1.723 . . . . 0.0 111.341 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.37 -88.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.868 2.379 . . . . 0.0 112.365 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.91 -25.77 67.3 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.365 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.6 t -56.83 -55.0 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.521 1.129 . . . . 0.0 108.712 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.16 -42.1 84.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.405 1.002 . . . . 0.0 110.53 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.6 -49.76 69.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.889 0.476 . . . . 0.0 111.256 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -70.36 -48.62 55.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.681 1.592 . . . . 0.0 110.344 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -56.54 -41.44 76.83 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.289 0.95 . . . . 0.0 110.47 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -63.58 -51.74 64.03 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.275 0.943 . . . . 0.0 108.823 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -55.3 -41.92 72.98 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.492 0.717 . . . . 0.0 109.602 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.54 -28.12 63.65 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.386 -0.821 . . . . 0.0 110.475 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -63.05 -36.36 83.32 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 34.1 mt -66.48 -2.74 4.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.798 0.839 . . . . 0.0 111.861 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -99.8 -9.82 22.52 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.726 2.01 . . . . 0.0 110.11 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -114.95 116.8 29.08 Favored 'General case' 0 CA--C 1.517 -0.318 0 O-C-N 120.823 -1.173 . . . . 0.0 108.246 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 12.8 mtp85 . . . . . 0 C--O 1.247 0.941 0 N-CA-C 105.908 -1.886 . . . . 0.0 105.908 -179.799 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 121.565 0.698 . . . . 0.0 111.61 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 1.1 t70 -103.39 19.79 19.05 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.935 1.294 . . . . 0.0 110.815 179.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 65.5 t0 -130.92 40.34 3.49 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.367 2.267 . . . . 0.0 109.547 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -102.0 105.67 16.47 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 103.083 -2.932 . . . . 0.0 103.083 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.59 106.9 0.72 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.64 165.58 12.64 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 125.145 1.378 . . . . 0.0 108.973 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -135.06 149.66 50.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.251 1.421 . . . . 0.0 107.481 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.6 89.73 45.0 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.05 111.28 3.24 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.6 2.867 . . . . 0.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 50.2 t -145.61 162.28 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 124.123 0.969 . . . . 0.0 109.03 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1011 ' ' ARG . . . . . 0.413 ' HG2' HH11 ' C' 1011 ' ' ARG . 8.7 ptt-85 -134.91 104.76 6.1 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 103.438 -2.801 . . . . 0.0 103.438 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.04 108.94 0.33 Allowed Glycine 0 C--O 1.227 -0.292 0 CA-C-O 117.206 -1.886 . . . . 0.0 109.15 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 26.8 tpt85 -61.03 -52.76 63.61 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.818 2.309 . . . . 0.0 112.565 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.52 -30.83 53.06 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.348 -0.845 . . . . 0.0 112.192 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -40.29 76.82 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 41.3 t80 -62.33 -51.33 68.05 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -49.84 -57.36 7.56 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.011 0.924 . . . . 0.0 110.952 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 7.9 tmm? -60.39 -49.06 79.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.7 -34.42 78.26 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 119.15 0.886 . . . . 0.0 111.267 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.0 mm? -68.14 -48.28 65.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.542 1.065 . . . . 0.0 109.613 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -58.8 -48.78 80.08 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.317 0.647 . . . . 0.0 110.447 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.4 mt -67.79 -44.33 85.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 118.191 0.45 . . . . 0.0 111.292 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -63.08 -46.07 89.13 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 119.003 0.82 . . . . 0.0 109.028 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -60.37 -48.74 80.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.893 0.877 . . . . 0.0 108.773 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 20.4 t -53.45 -52.07 60.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.718 0.807 . . . . 0.0 111.247 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.44 -58.06 6.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.289 1.435 . . . . 0.0 112.831 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -46.67 88.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -177.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.29 -39.59 92.74 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 117.69 -1.148 . . . . 0.0 109.684 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -59.12 -31.75 69.22 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.034 0.833 . . . . 0.0 109.322 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -80.68 -30.56 36.48 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.846 0.748 . . . . 0.0 110.842 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -75.88 -45.63 34.49 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.318 1.047 . . . . 0.0 113.135 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 4.6 pp -64.23 149.89 93.56 Favored Pre-proline 0 C--O 1.24 0.558 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -70.45 150.03 63.38 Favored 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 122.181 1.921 . . . . 0.0 108.835 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -3.65 0.31 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.582 2.353 . . . . 0.0 116.85 -178.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 11.5 m170 -47.72 -57.75 5.16 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.778 1.631 . . . . 0.0 114.346 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 1.9 m -65.41 -36.2 83.21 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.52 -1.362 . . . . 0.0 110.948 -179.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.4 mm -59.47 -44.26 92.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 119.613 1.097 . . . . 0.0 108.209 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.29 -58.32 9.14 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.455 1.102 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 53.1 m -61.33 -31.34 71.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.609 0.764 . . . . 0.0 111.924 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.11 -53.72 18.75 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.73 -41.25 81.44 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 122.993 0.517 . . . . 0.0 110.46 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -55.67 -57.54 11.54 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.253 1.021 . . . . 0.0 110.557 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -68.2 -35.78 78.52 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.887 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -57.79 -48.6 79.23 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.391 0.996 . . . . 0.0 109.545 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -68.27 -29.81 68.69 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.492 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -72.05 -50.48 28.03 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 120.248 1.386 . . . . 0.0 109.494 177.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -52.15 -43.6 64.16 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 127.178 2.191 . . . . 0.0 114.207 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 64.3 m80 -59.08 -45.25 91.32 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.031 0.832 . . . . 0.0 109.535 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.69 -40.13 80.19 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.634 -0.698 . . . . 0.0 109.62 179.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 36.4 m170 -58.73 -39.85 82.07 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.407 1.003 . . . . 0.0 110.37 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 36.1 mt -73.6 -30.67 63.14 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 118.652 -0.689 . . . . 0.0 110.662 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 8.1 mt -70.66 -45.05 65.84 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -72.47 177.37 4.67 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.637 1.975 . . . . 0.0 109.774 179.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 67.3 mttm -133.19 44.76 2.79 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 126.176 1.79 . . . . 0.0 109.008 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -142.65 154.77 44.66 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.097 0.959 . . . . 0.0 108.567 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 15.5 p -76.16 166.75 23.02 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 122.005 0.907 . . . . 0.0 110.061 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 40.2 t -74.8 153.56 38.7 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 18.1 tt -155.18 157.24 4.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -146.45 158.52 43.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 C--O 1.258 1.551 0 C-N-CA 129.991 3.316 . . . . 0.0 105.021 178.589 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.524 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 2.8 t -157.88 -156.55 0.58 Allowed 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 126.686 1.994 . . . . 0.0 106.488 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.84 72.79 2.76 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.536 0.684 . . . . 0.0 110.379 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -139.65 -22.23 0.89 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.775 2.43 . . . . 0.0 110.729 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 3.7 t70 43.89 -129.79 0.84 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 128.515 2.726 . . . . 0.0 113.518 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 79.6 m -158.35 158.72 34.83 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.865 1.666 . . . . 0.0 108.778 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.09 144.46 49.3 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.56 161.12 32.22 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.822 1.249 . . . . 0.0 112.248 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.0 mp -145.36 133.07 21.01 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.34 106.75 9.73 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 104.351 -2.463 . . . . 0.0 104.351 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 40.1 t -152.49 142.25 14.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 118.52 0.6 . . . . 0.0 109.601 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.8 100.62 9.82 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.39 115.06 0.84 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.365 -2.694 . . . . 0.0 106.365 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -57.77 10.68 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.682 2.741 . . . . 0.0 111.823 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 22.0 mmtt -63.31 -48.55 77.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -52.16 -44.17 64.48 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 123.929 0.892 . . . . 0.0 111.71 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 27.8 t80 -67.08 -50.08 62.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.061 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.33 -49.28 74.8 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.169 0.895 . . . . 0.0 110.945 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.79 -53.43 48.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 124.79 1.236 . . . . 0.0 109.61 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.75 -28.03 68.74 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.162 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 7.7 mtp -64.89 -51.8 60.0 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 120.401 1.455 . . . . 0.0 109.834 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -48.22 82.58 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 123.412 0.445 . . . . 0.0 110.245 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.211 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -55.78 -54.93 38.41 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.733 0.813 . . . . 0.0 108.896 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -58.74 -53.83 53.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.764 1.226 . . . . 0.0 110.425 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 38.2 m -56.78 -42.71 79.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.323 -0.846 . . . . 0.0 112.575 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.81 -34.8 78.98 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.761 1.164 . . . . 0.0 110.367 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -68.2 -40.35 82.21 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1121 ' ' LEU . . . . . 0.401 HD13 ' HA ' ' D' 1121 ' ' LEU . 3.7 mm? -69.85 -35.34 74.64 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.28 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.2 ttt -61.27 -49.98 74.87 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.2 -28.84 68.41 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.011 0.823 . . . . 0.0 111.301 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.8 tm? -68.97 -32.91 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.387 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 32.3 m -91.08 147.04 34.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 119.897 1.226 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -72.32 -79.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.927 2.418 . . . . 0.0 111.058 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -165.44 64.24 0.98 Allowed Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.003 1.321 . . . . 0.0 109.834 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -80.78 -106.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 123.664 2.909 . . . . 0.0 113.264 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.62 -32.12 68.73 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.757 1.223 . . . . 0.0 110.145 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 14.1 t -54.24 -53.79 26.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.124 1.37 . . . . 0.0 109.277 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.32 -40.41 95.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.795 1.638 . . . . 0.0 110.981 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -61.91 -50.6 71.54 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.67 -33.39 74.83 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.197 0.599 . . . . 0.0 109.945 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -59.17 -47.23 86.06 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -60.58 -51.99 67.05 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -53.75 -44.71 70.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.794 1.238 . . . . 0.0 112.509 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.23 -29.16 57.45 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.245 -0.909 . . . . 0.0 111.055 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 30.7 tp60 -63.89 -35.3 80.2 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.258 -0.901 . . . . 0.0 109.312 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.14 -31.94 61.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.446 0.699 . . . . 0.0 111.357 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.15 -16.36 63.62 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.405 0.682 . . . . 0.0 112.49 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -104.46 83.59 2.07 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 120.587 -1.321 . . . . 0.0 109.623 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 . . . . . 0 C--O 1.255 1.36 0 C-N-CA 126.875 2.07 . . . . 0.0 110.714 179.306 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.482 1.164 0 CA-C-O 122.964 1.364 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -59.41 11.19 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 1 C-N-CA 132.725 4.41 . . . . 0.0 114.841 179.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -72.71 5.28 3.24 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.707 -1.246 . . . . 0.0 110.441 178.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -61.66 108.72 1.03 Allowed 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 127.749 2.42 . . . . 0.0 106.58 178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.6 tp -76.7 101.58 5.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 124.206 1.002 . . . . 0.0 108.771 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.6 mt -94.53 158.67 15.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 106.76 -1.571 . . . . 0.0 106.76 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -129.69 123.04 30.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -98.07 99.34 6.81 Favored Pre-proline 0 N--CA 1.447 -0.586 0 C-N-CA 124.033 0.933 . . . . 0.0 109.346 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.06 126.85 10.19 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.383 2.056 . . . . 0.0 107.259 177.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.3 t -146.05 146.27 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 119.203 0.911 . . . . 0.0 109.825 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.6 ptt85 -135.97 101.17 4.64 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.44 130.96 2.22 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 105.209 -3.156 . . . . 0.0 105.209 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.6 tpp85 -70.18 -52.07 26.23 Favored 'General case' 0 CA--C 1.524 -0.047 0 CA-C-N 120.869 2.334 . . . . 0.0 111.08 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -70.37 -34.72 72.93 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -57.28 -42.66 82.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.825 0.85 . . . . 0.0 108.717 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -67.0 -53.13 34.27 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 118.521 -0.752 . . . . 0.0 109.115 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -52.84 -57.23 10.91 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.162 0.985 . . . . 0.0 111.798 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -57.76 -53.6 56.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.594 0.758 . . . . 0.0 111.683 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -46.81 83.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.946 0.899 . . . . 0.0 112.119 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tt -67.79 -55.5 12.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.809 1.643 . . . . 0.0 111.275 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.26 -48.44 74.0 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 118.505 -0.76 . . . . 0.0 111.548 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.9 mt -61.37 -46.32 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 119.289 0.95 . . . . 0.0 108.913 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.3 tmtt? -55.9 -39.24 71.31 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-O 116.889 -1.529 . . . . 0.0 110.087 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -64.98 -39.5 93.58 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.71 1.141 . . . . 0.0 111.316 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.64 -52.03 66.88 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.787 0.722 . . . . 0.0 110.996 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -70.09 -37.74 75.49 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.183 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -61.77 -54.14 46.47 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-O 117.879 -1.057 . . . . 0.0 109.136 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.43 -38.98 91.52 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.577 1.08 . . . . 0.0 110.566 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.3 ttt -58.05 -32.93 68.48 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.387 0.54 . . . . 0.0 109.8 178.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -88.91 -39.37 13.83 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.296 1.038 . . . . 0.0 111.468 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.438 1.095 . . . . 0.0 111.402 -179.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -136.84 75.96 47.87 Favored Pre-proline 0 CA--C 1.535 0.377 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -81.06 48.02 2.76 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 124.378 3.385 . . . . 0.0 112.16 -178.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -145.17 -58.85 0.35 Allowed 'General case' 0 C--O 1.221 -0.44 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.255 -179.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -47.82 -57.21 5.91 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.086 1.354 . . . . 0.0 112.984 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.72 -44.18 77.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 119.19 0.904 . . . . 0.0 112.747 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.8 mm -66.37 -43.62 91.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 124.831 1.252 . . . . 0.0 110.337 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.01 -52.81 63.97 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.208 2.203 . . . . 0.0 108.488 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.9 m -65.18 -39.47 92.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.947 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.08 -46.78 87.4 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 119.974 1.261 . . . . 0.0 108.977 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -48.35 69.26 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.165 0.986 . . . . 0.0 109.258 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -64.04 -55.68 20.5 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.201 1.4 . . . . 0.0 111.531 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -58.33 -38.19 76.64 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.919 1.236 . . . . 0.0 112.346 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -63.37 -51.2 66.86 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.01 -41.24 97.85 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.276 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -50.83 -39.86 54.34 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.919 1.288 . . . . 0.0 112.491 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -57.8 -43.21 85.52 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.586 0.63 . . . . 0.0 110.177 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -75.15 -44.78 44.88 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.93 0.892 . . . . 0.0 109.126 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -51.99 -41.62 62.32 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 126.728 2.011 . . . . 0.0 110.744 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -57.88 -31.16 66.45 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.183 0.993 . . . . 0.0 111.847 179.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.0 mt -93.51 -34.23 13.46 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.597 1.159 . . . . 0.0 111.364 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 25.2 tp -71.79 -54.77 9.12 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.421 1.089 . . . . 0.0 111.052 -179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.5 38.0 0.14 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.061 2.144 . . . . 0.0 112.217 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -61.02 107.04 0.66 Allowed 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -45.88 141.41 3.08 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.348 1.459 . . . . 0.0 111.678 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.3 m -140.89 159.7 41.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.681 1.992 . . . . 0.0 106.09 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 t -83.65 172.65 12.09 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.183 0.447 . . . . 0.0 109.884 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.6 tt -155.74 167.64 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 127.688 2.395 . . . . 0.0 106.424 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -145.06 159.13 43.44 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 125.578 1.551 . . . . 0.0 108.032 179.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--O 1.257 1.489 0 C-N-CA 129.252 3.021 . . . . 0.0 105.46 179.007 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.388 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 72.3 m -144.29 116.01 8.21 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.069 1.348 . . . . 0.0 109.449 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -119.87 13.5 12.3 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 127.091 2.156 . . . . 0.0 111.59 179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -51.78 -47.05 64.34 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.517 1.527 . . . . 0.0 114.312 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -151.5 146.6 26.02 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.206 1.002 . . . . 0.0 109.53 -178.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 5.1 m -156.99 159.52 38.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.688 1.995 . . . . 0.0 106.631 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -101.37 144.84 29.7 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -126.16 159.03 34.02 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.52 0.728 . . . . 0.0 109.802 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.0 mp -139.69 152.28 46.57 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -142.89 98.49 3.29 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.167 1.787 . . . . 0.0 107.968 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.53 150.81 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.496 0.719 . . . . 0.0 111.074 -178.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -116.66 102.77 9.73 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.81 124.36 2.35 Favored Glycine 0 C--N 1.331 0.257 0 N-CA-C 107.564 -2.214 . . . . 0.0 107.564 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -67.62 -58.08 5.3 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 120.481 2.14 . . . . 0.0 110.424 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.9 -40.92 91.96 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 121.533 -0.729 . . . . 0.0 109.579 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 28.0 m120 -55.27 -50.55 69.22 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.437 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.62 -47.39 86.41 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.671 -178.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -53.86 49.82 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.764 0.793 . . . . 0.0 111.092 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 89.9 mt -61.01 -56.06 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.104 1.761 . . . . 0.0 111.506 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -61.6 -39.53 91.55 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 118.469 -0.777 . . . . 0.0 111.219 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 15.3 ttt -66.96 -52.33 44.2 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.168 0.895 . . . . 0.0 108.873 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -52.32 -52.05 55.26 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.183 0.593 . . . . 0.0 110.466 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.85 -38.38 79.74 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.207 -0.901 . . . . 0.0 112.859 -178.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.3 tptp -66.36 -41.84 88.91 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 120.525 1.511 . . . . 0.0 110.232 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.43 -44.36 97.26 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.803 1.241 . . . . 0.0 107.831 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 24.7 t -61.12 -44.9 96.63 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.999 1.32 . . . . 0.0 109.799 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -68.42 -31.83 71.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 117.223 -1.37 . . . . 0.0 110.319 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -60.91 -43.13 99.0 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 121.222 1.828 . . . . 0.0 107.723 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.24 -53.95 41.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.823 0.849 . . . . 0.0 110.373 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 17.2 tpt -62.36 -30.25 71.04 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -77.38 -29.19 53.13 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.921 -1.112 . . . . 0.0 110.032 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.94 -33.45 22.68 Favored 'General case' 0 C--N 1.344 0.349 0 O-C-N 121.241 -0.912 . . . . 0.0 113.34 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -95.83 148.83 35.17 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 126.59 1.956 . . . . 0.0 112.184 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -70.49 -179.54 3.32 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.423 2.082 . . . . 0.0 111.037 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -113.21 46.91 0.35 Allowed Pre-proline 0 CA--C 1.557 1.232 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -64.4 -65.99 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.879 2.386 . . . . 0.0 113.036 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.48 -26.69 68.04 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.298 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.25 -56.74 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.595 1.089 . . . . 0.0 109.092 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -65.91 -31.95 73.17 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.805 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -51.15 43.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.589 -0.72 . . . . 0.0 111.479 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.63 -34.09 77.11 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.744 1.156 . . . . 0.0 109.811 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -60.32 -48.65 80.85 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.745 0.818 . . . . 0.0 109.225 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.44 -41.6 65.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 123.048 0.539 . . . . 0.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -58.13 -46.08 86.24 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.928 0.891 . . . . 0.0 109.471 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -76.1 -28.59 57.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.59 0.756 . . . . 0.0 110.084 179.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -61.74 -31.6 71.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.259 0.936 . . . . 0.0 109.12 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -6.52 0.98 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.982 1.313 . . . . 0.0 113.272 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 18.2 tp -88.56 -0.73 57.55 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.018 1.327 . . . . 0.0 109.963 177.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -68.68 172.36 6.44 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 124.963 1.305 . . . . 0.0 112.095 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 . . . . . 0 C--O 1.25 1.096 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 178.452 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.467 0.396 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -55.95 -8.53 0.45 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 128.868 2.867 . . . . 0.0 114.918 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -72.33 0.8 9.07 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.377 1.071 . . . . 0.0 111.17 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -58.17 111.83 1.33 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.997 1.319 . . . . 0.0 108.888 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 24.6 tp -72.42 102.53 3.21 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.123 0.969 . . . . 0.0 109.384 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 59.4 mt -109.42 170.85 7.8 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 124.293 1.037 . . . . 0.0 109.436 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -138.05 152.73 49.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.37 100.04 17.0 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -79.6 115.66 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.567 2.845 . . . . 0.0 110.138 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 78.1 t -144.74 152.11 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 119.649 1.113 . . . . 0.0 110.194 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.15 102.51 5.21 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.17 113.66 0.55 Allowed Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 104.107 -3.597 . . . . 0.0 104.107 179.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -51.13 69.08 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 120.057 1.928 . . . . 0.0 113.048 -177.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -75.34 -34.14 61.16 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.299 1.039 . . . . 0.0 109.358 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 5.5 m -59.28 -50.21 74.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.962 1.305 . . . . 0.0 107.963 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.0 t80 -58.7 -51.21 70.91 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.857 1.663 . . . . 0.0 109.404 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.4 -42.33 99.35 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.49 1.041 . . . . 0.0 112.752 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.0 ttm -60.64 -50.59 72.89 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.76 -44.69 93.74 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.215 1.406 . . . . 0.0 111.569 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.42 -55.75 30.73 Favored 'General case' 0 CA--C 1.512 -0.486 0 C-N-CA 124.322 1.049 . . . . 0.0 111.482 -179.05 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -41.38 79.29 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.982 0.356 . . . . 0.0 111.543 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1022 ' ' ILE . . . . . 0.479 HG23 HD22 ' D' 1115 ' ' LEU . 81.2 mt -66.99 -43.18 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 121.655 0.74 . . . . 0.0 110.3 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -66.51 -44.83 81.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 120.794 -1.191 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -62.97 -39.61 95.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 117.997 -1.002 . . . . 0.0 111.169 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 55.4 p -61.18 -50.44 73.13 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.08 0.855 . . . . 0.0 110.409 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -68.82 -42.47 77.2 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.911 -178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.62 -51.0 71.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1028 ' ' LEU . . . . . 0.657 HD22 HG23 ' D' 1130 ' ' VAL . 42.7 tp -62.25 -43.78 98.05 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.786 0.721 . . . . 0.0 109.744 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 22.3 ttt -57.89 -35.26 70.77 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.642 0.777 . . . . 0.0 111.137 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -79.28 -49.14 12.93 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.311 1.444 . . . . 0.0 111.14 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 24.2 t80 -71.63 -23.87 61.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.749 2.02 . . . . 0.0 113.862 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 8.4 tp -142.12 73.61 21.92 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -76.25 -4.89 15.65 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 124.11 3.206 . . . . 0.0 112.513 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -82.95 -69.73 0.61 Allowed 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 121.361 -0.837 . . . . 0.0 111.308 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -48.16 -52.75 19.35 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 -176.287 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -50.07 74.3 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 120.978 1.717 . . . . 0.0 111.552 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.8 mm -63.82 -34.99 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -61.19 -53.4 57.43 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.861 0.755 . . . . 0.0 109.005 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 13.2 m -67.33 -35.48 79.5 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.864 -0.522 . . . . 0.0 110.793 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.3 t80 -58.77 -52.68 64.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -37.31 81.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 123.979 0.912 . . . . 0.0 109.728 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -53.5 57.15 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.078 0.951 . . . . 0.0 109.472 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -67.02 -46.08 75.57 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.19 0.996 . . . . 0.0 111.032 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -42.23 85.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.317 1.047 . . . . 0.0 109.21 179.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -65.7 -51.47 59.1 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -52.42 -39.27 60.78 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.338 1.055 . . . . 0.0 113.429 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -55.22 -46.82 75.97 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.362 0.983 . . . . 0.0 109.103 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 73.7 m80 -75.42 -39.36 59.02 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.341 1.056 . . . . 0.0 110.917 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -57.02 -41.75 79.11 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 125.414 1.486 . . . . 0.0 110.319 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 6.8 m170 -58.8 -20.59 51.48 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.198 0.908 . . . . 0.0 111.929 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 3.9 mt -93.91 -48.91 6.06 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 125.127 1.371 . . . . 0.0 109.813 178.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 66.3 tp -65.75 -63.21 1.14 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.018 1.327 . . . . 0.0 111.493 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.51 130.49 39.69 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.543 1.537 . . . . 0.0 107.347 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 12.4 ttpp -151.55 131.05 12.99 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -54.0 140.91 29.83 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 30.6 m -144.24 155.5 43.89 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 105.172 -2.159 . . . . 0.0 105.172 179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.67 169.89 16.45 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.343 0.52 . . . . 0.0 110.832 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 17.0 tt -158.19 166.53 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 128.29 2.636 . . . . 0.0 106.062 179.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -145.27 159.18 43.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.479 1.511 . . . . 0.0 108.174 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 54.2 m . . . . . 0 C--O 1.258 1.505 0 C-N-CA 129.326 3.051 . . . . 0.0 105.496 179.094 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.691 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 3.5 m -144.57 107.68 4.54 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -135.47 92.98 2.9 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 129.996 3.318 . . . . 0.0 104.023 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -138.93 -47.15 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.472 1.109 . . . . 0.0 109.88 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 3.5 t70 -140.46 125.24 18.16 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.04 1.736 . . . . 0.0 106.423 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 8.3 m -146.13 142.06 28.12 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -102.23 142.12 33.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -122.94 151.17 42.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 7.3 mp -128.33 150.06 50.24 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 105.62 -1.992 . . . . 0.0 105.62 178.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tm0? -145.33 98.37 3.14 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 125.897 1.679 . . . . 0.0 106.975 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.83 140.66 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 119.074 0.852 . . . . 0.0 111.573 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -103.91 103.95 13.87 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 105.165 -2.161 . . . . 0.0 105.165 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.16 114.08 0.86 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 104.301 -3.52 . . . . 0.0 104.301 178.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -61.95 -57.52 11.4 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.491 2.145 . . . . 0.0 111.901 -178.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mttp -72.22 -35.52 68.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.494 -0.754 . . . . 0.0 109.081 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.16 -51.32 69.79 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.013 -0.994 . . . . 0.0 111.035 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.8 t80 -66.71 -43.24 84.82 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.429 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.76 -54.0 40.09 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.407 1.003 . . . . 0.0 111.817 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.06 -54.07 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 125.614 1.565 . . . . 0.0 111.657 -178.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -37.54 87.68 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 117.719 -1.134 . . . . 0.0 111.873 -178.084 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 15.1 ttt -65.3 -51.26 61.83 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -52.32 -51.74 57.01 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 123.454 0.702 . . . . 0.0 109.664 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1115 ' ' LEU . . . . . 0.479 HD22 HG23 ' C' 1022 ' ' ILE . 68.1 mt -65.23 -36.54 84.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.397 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.6 tptp -64.98 -48.4 74.16 Favored 'General case' 0 C--O 1.228 -0.079 0 CA-C-N 120.123 1.328 . . . . 0.0 109.449 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -59.02 -46.6 87.8 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.96 1.304 . . . . 0.0 108.047 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 40.7 t -57.09 -45.95 82.96 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.53 1.132 . . . . 0.0 109.97 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 2.6 mm? -70.89 -30.52 66.9 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.578 -1.201 . . . . 0.0 111.059 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -62.88 -42.6 99.83 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 121.529 1.968 . . . . 0.0 107.982 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -54.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.105 0.962 . . . . 0.0 109.567 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 13.7 tpt -60.12 -30.09 69.05 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.307 0.643 . . . . 0.0 112.711 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -76.38 -35.45 58.64 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 119.084 0.856 . . . . 0.0 110.207 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.21 -31.71 33.81 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.801 1.038 . . . . 0.0 113.801 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.2 t -94.61 147.93 34.04 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 125.378 1.471 . . . . 0.0 112.934 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -67.31 -173.09 0.4 Allowed 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 123.674 2.916 . . . . 0.0 110.818 178.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -122.92 43.48 0.76 Allowed Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -65.62 -47.16 4.31 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.106 1.871 . . . . 0.0 113.09 -178.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 26.0 tp -68.89 -39.7 79.59 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 119.372 0.987 . . . . 0.0 109.217 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1130 ' ' VAL . . . . . 0.657 HG23 HD22 ' C' 1028 ' ' LEU . 2.8 t -59.26 -50.41 79.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.39 0 CA-C-O 117.377 -1.296 . . . . 0.0 109.722 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -55.09 -51.56 65.99 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.343 1.429 . . . . 0.0 109.758 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 5.3 t -57.26 -49.88 74.66 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.161 1.384 . . . . 0.0 111.549 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.6 t80 -68.95 -41.95 77.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.336 1.455 . . . . 0.0 112.041 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 10.1 tmm_? -53.3 -47.5 69.19 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.087 1.355 . . . . 0.0 109.885 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -70.82 -53.93 13.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.125 0.97 . . . . 0.0 110.125 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -51.48 -47.27 63.26 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.656 0.782 . . . . 0.0 112.658 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -73.57 -31.62 63.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.313 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -61.81 -34.02 75.17 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.674 1.124 . . . . 0.0 109.687 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.13 -14.68 1.74 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 48.7 tp -73.17 -7.33 50.93 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.8 1.64 . . . . 0.0 111.14 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -63.49 166.71 6.31 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.654 1.581 . . . . 0.0 111.069 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 90.6 mtt-85 . . . . . 0 C--O 1.241 0.647 0 N-CA-C 102.408 -3.182 . . . . 0.0 102.408 178.859 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 66.5 m . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 120.779 0.323 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -74.61 -18.99 60.47 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 126.422 1.889 . . . . 0.0 112.265 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -70.17 10.31 0.45 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.892 2.077 . . . . 0.0 115.85 -177.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -87.56 96.49 10.42 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 178.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.01 108.65 1.26 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.589 0.631 . . . . 0.0 110.272 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.78 168.33 10.56 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.43 1.109 . . . . 0.0 109.643 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -135.99 142.3 44.49 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.384 1.873 . . . . 0.0 106.999 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 39.3 tp -130.5 96.04 25.2 Favored Pre-proline 0 CA--C 1.539 0.527 0 C-N-CA 123.989 0.916 . . . . 0.0 108.747 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.46 116.76 3.62 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.537 2.825 . . . . 0.0 108.799 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.9 t -145.48 160.83 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.885 1.674 . . . . 0.0 109.804 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -134.4 105.02 6.37 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.9 104.88 0.23 Allowed Glycine 0 C--O 1.227 -0.334 0 N-CA-C 106.403 -2.679 . . . . 0.0 106.403 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -64.24 -52.96 56.18 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 121.196 2.498 . . . . 0.0 113.021 -177.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.91 -30.71 69.24 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.47 -0.769 . . . . 0.0 110.864 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -43.34 81.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 126.115 1.766 . . . . 0.0 109.299 -179.001 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -61.85 -49.05 77.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.138 0.975 . . . . 0.0 108.533 178.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -60.61 -43.14 97.78 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.744 0.247 . . . . 0.0 111.423 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 8.8 tmm? -63.73 -49.95 71.05 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.841 0.857 . . . . 0.0 110.359 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 mp -61.65 -52.24 65.15 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.191 -0.909 . . . . 0.0 112.179 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -42.14 94.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.463 1.029 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -59.94 -48.61 81.0 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.205 0.526 . . . . 0.0 110.48 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.3 mt -73.62 -32.15 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.021 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' C' 1010 ' ' VAL . 19.0 ttmm -59.23 -57.54 12.57 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -36.54 73.05 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 117.054 -1.45 . . . . 0.0 109.309 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 p -55.8 -48.0 76.15 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.285 1.402 . . . . 0.0 111.327 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -42.37 62.48 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.306 1.842 . . . . 0.0 113.716 -178.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -68.88 -52.47 29.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.609 -0.682 . . . . 0.0 109.988 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.94 -39.57 92.53 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.607 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.25 66.37 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.083 0.856 . . . . 0.0 109.703 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.02 -23.99 66.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.66 -23.46 29.45 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.446 1.099 . . . . 0.0 111.523 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp -132.93 67.42 77.81 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 127.776 2.431 . . . . 0.0 105.909 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -76.71 46.4 1.87 Allowed 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 124.603 3.536 . . . . 0.0 112.151 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -48.7 154.14 0.72 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.97 1.308 . . . . 0.0 112.577 -179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -50.99 -28.08 9.15 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.97 0.908 . . . . 0.0 113.296 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.7 m -56.91 -50.03 73.79 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.555 1.07 . . . . 0.0 108.952 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.8 mt -65.78 -53.64 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 126.108 1.763 . . . . 0.0 108.826 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -52.43 -53.3 47.13 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.202 1.001 . . . . 0.0 111.721 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.1 m -64.83 -47.06 79.36 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.887 0.875 . . . . 0.0 110.494 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -61.35 -41.39 96.98 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 118.965 0.802 . . . . 0.0 111.28 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -60.37 -48.55 81.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.441 1.019 . . . . 0.0 110.171 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.79 -46.04 89.84 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 123.176 0.59 . . . . 0.0 110.083 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -62.02 -47.65 83.81 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 124.451 1.1 . . . . 0.0 110.821 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -54.88 -44.52 74.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.556 1.142 . . . . 0.0 110.512 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -57.4 -50.78 71.91 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.43 -45.52 92.71 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 117.86 0.3 . . . . 0.0 111.268 179.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -55.26 -32.03 62.03 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.295 1.438 . . . . 0.0 111.919 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -60.12 -27.92 67.43 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.788 1.176 . . . . 0.0 110.826 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -70.39 -41.92 72.41 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 120.173 -1.579 . . . . 0.0 109.208 177.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -85.24 13.39 6.48 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.543 1.937 . . . . 0.0 112.615 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.3 tt -52.67 -32.1 40.66 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.016 1.327 . . . . 0.0 113.287 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.43 -67.11 0.45 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.629 0.772 . . . . 0.0 110.795 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 57.34 -171.05 0.1 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.028 1.331 . . . . 0.0 109.555 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.2 tptp -139.93 74.34 1.46 Allowed 'General case' 0 C--N 1.338 0.105 0 O-C-N 120.406 -1.434 . . . . 0.0 109.412 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -95.76 174.3 7.04 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 124.262 1.025 . . . . 0.0 110.118 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.8 t -163.88 110.6 1.1 Allowed 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 177.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.6 m -135.27 159.91 40.06 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.671 0.788 . . . . 0.0 110.025 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.3 tt -152.95 -5.66 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.8 mp0 -83.69 159.61 21.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.814 1.188 . . . . 0.0 110.646 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 C--O 1.256 1.398 0 C-N-CA 128.496 2.718 . . . . 0.0 106.189 178.131 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.525 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 12.6 m -74.25 166.95 22.58 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.716 0.77 . . . . 0.0 110.091 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -157.21 101.6 1.91 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.977 1.311 . . . . 0.0 108.438 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -139.05 -11.38 1.27 Allowed 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.877 1.271 . . . . 0.0 112.079 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -88.23 147.22 24.95 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 7.1 m -139.94 145.1 37.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.03 129.91 48.46 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -104.31 159.41 15.73 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.841 1.656 . . . . 0.0 109.466 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.9 mt -149.12 142.51 25.23 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.871 1.668 . . . . 0.0 107.831 179.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -146.03 108.21 4.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.5 m -154.51 150.18 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.106 1.362 . . . . 0.0 109.488 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.87 101.57 8.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.225 1.375 . . . . 0.0 108.916 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.0 115.85 0.88 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-O 115.887 -2.618 . . . . 0.0 109.918 178.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -65.24 -56.91 10.09 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 122.364 3.082 . . . . 0.0 111.023 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -63.55 -47.75 80.3 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 -52.64 -48.81 66.17 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.326 -0.845 . . . . 0.0 111.349 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.94 -43.74 94.93 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.954 1.252 . . . . 0.0 112.074 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.48 -48.82 79.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.863 1.21 . . . . 0.0 110.332 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 85.0 mt -61.23 -53.71 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 124.43 1.092 . . . . 0.0 110.757 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.66 -31.69 73.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 117.911 -1.042 . . . . 0.0 111.601 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 16.2 mtp -64.41 -52.38 58.42 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.265 1.393 . . . . 0.0 109.468 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -58.14 -43.23 87.18 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.6 mt -63.2 -50.67 69.38 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.419 0.688 . . . . 0.0 111.941 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 116' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -69.69 -50.84 39.96 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 119.447 1.021 . . . . 0.0 112.669 -178.52 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -56.64 -46.78 80.81 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 118.909 0.777 . . . . 0.0 110.443 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.8 t -64.21 -36.17 83.18 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.721 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.696 HD12 HD21 ' D' 1108 ' ' ASN . 1.6 tm? -69.83 -43.31 72.26 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -60.25 -33.98 73.06 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.898 1.226 . . . . 0.0 109.784 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -73.15 -44.05 60.62 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.2 tpt -63.98 -25.77 68.28 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.465 1.106 . . . . 0.0 109.7 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.5 -46.32 17.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.665 1.986 . . . . 0.0 109.606 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -75.4 -32.33 60.72 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.098 0.863 . . . . 0.0 113.118 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -91.63 147.85 36.06 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.46 -176.8 1.52 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.367 2.045 . . . . 0.0 110.429 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.96 56.58 0.37 Allowed Pre-proline 0 CA--C 1.551 1.006 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.36 -74.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.263 2.642 . . . . 0.0 113.109 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.8 tt -56.12 -44.35 79.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 25.5 t -50.97 -53.79 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 126.959 2.104 . . . . 0.0 112.103 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.52 -42.66 91.75 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.307 0.958 . . . . 0.0 111.421 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 29.5 m -64.39 -44.34 91.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.464 0.575 . . . . 0.0 109.727 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -56.92 -51.93 67.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.829 1.652 . . . . 0.0 108.78 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -54.18 -46.96 72.51 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 117.48 -1.248 . . . . 0.0 111.245 -178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -68.56 -49.83 56.46 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 120.997 1.726 . . . . 0.0 112.086 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -56.98 -37.67 71.95 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.837 0.455 . . . . 0.0 110.975 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -77.57 -41.98 36.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 110.051 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -54.23 -32.52 56.14 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.912 1.233 . . . . 0.0 110.442 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.28 -19.64 55.74 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.854 -0.529 . . . . 0.0 111.828 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.3 tt -70.05 -29.05 65.98 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 120.727 -1.233 . . . . 0.0 110.308 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.45 91.85 6.01 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.787 1.635 . . . . 0.0 107.916 -179.097 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? . . . . . 0 C--O 1.247 0.936 0 C-N-CA 127.908 2.483 . . . . 0.0 109.493 -179.099 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 16.9 m . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 120.787 0.327 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 8.5 t0 -103.33 -2.52 26.95 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.209 1.404 . . . . 0.0 112.561 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.44 -12.13 60.18 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.539 0.736 . . . . 0.0 112.224 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.94 98.78 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.725 1.61 . . . . 0.0 112.508 -178.385 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.0 tt -68.05 120.08 13.69 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.34 167.55 10.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 123.373 1.558 . . . . 0.0 109.702 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -136.12 148.01 48.04 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 126.905 2.082 . . . . 0.0 106.287 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 9.0 tp -137.11 94.57 12.43 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.38 111.17 3.22 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.209 3.273 . . . . 0.0 109.035 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1010 ' ' VAL . . . . . 0.419 HG21 ' HE3' ' A' ' 23' ' ' LYS . 54.0 t -145.35 156.01 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -135.65 105.04 6.01 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.132 -0.98 . . . . 0.0 109.869 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.7 114.96 0.6 Allowed Glycine 0 CA--C 1.529 0.919 0 N-CA-C 106.503 -2.639 . . . . 0.0 106.503 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -67.86 -50.68 55.16 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 122.73 3.265 . . . . 0.0 111.086 -179.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -41.49 85.86 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -48.72 79.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 124.518 1.127 . . . . 0.0 110.055 -179.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 55.0 t80 -57.26 -54.74 43.38 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.921 0.889 . . . . 0.0 110.864 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -62.57 -37.52 86.5 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 12.0 tmm? -66.14 -49.8 66.19 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.627 -0.671 . . . . 0.0 109.444 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.21 -45.2 93.99 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.494 0.717 . . . . 0.0 110.308 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -61.69 -54.37 43.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.022 0.929 . . . . 0.0 111.327 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -54.97 -48.37 73.33 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.809 0.844 . . . . 0.0 111.238 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 96.7 mt -71.46 -40.59 72.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 119.113 -0.47 . . . . 0.0 111.011 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -47.4 85.83 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 119.532 1.06 . . . . 0.0 108.16 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.03 -46.39 85.41 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.517 1.136 . . . . 0.0 108.754 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 34.1 p -54.39 -50.06 68.41 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 118.398 0.544 . . . . 0.0 111.656 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -46.47 89.14 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 122.114 0.959 . . . . 0.0 111.57 -178.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -52.64 64.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.834 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.86 -48.56 71.17 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.154 1.781 . . . . 0.0 112.937 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -41.38 63.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.845 1.658 . . . . 0.0 109.185 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -87.72 -25.09 23.63 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 118.16 -0.924 . . . . 0.0 111.671 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -75.69 -23.04 56.15 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.89 1.677 . . . . 0.0 111.15 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 39.5 tp -126.8 70.87 73.73 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 125.837 1.655 . . . . 0.0 106.907 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -75.97 73.83 4.72 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 123.117 2.545 . . . . 0.0 111.25 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -77.69 163.72 25.93 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 124.39 1.076 . . . . 0.0 109.957 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 50.7 m170 -64.07 -26.57 68.61 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.699 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 3.0 m -56.63 -47.44 79.67 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.2 mt -69.58 -49.94 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 C-N-CA 126.534 1.933 . . . . 0.0 109.783 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -55.02 -54.45 42.87 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.809 0.844 . . . . 0.0 111.252 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.9 m -59.92 -46.09 90.48 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.336 0.655 . . . . 0.0 109.741 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 23.0 t80 -59.1 -45.3 91.21 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.632 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -48.82 80.1 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.654 0.782 . . . . 0.0 110.435 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -44.03 91.54 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 121.876 -0.515 . . . . 0.0 110.541 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -64.44 -42.44 95.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.539 -0.743 . . . . 0.0 110.727 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 43.6 mm-40 -60.74 -35.19 75.74 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.644 1.178 . . . . 0.0 110.744 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -64.95 -54.42 30.92 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.25 -41.45 99.06 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.4 -0.188 . . . . 0.0 110.629 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -52.72 -35.15 55.35 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.172 1.389 . . . . 0.0 111.66 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 1.3 t60 -58.25 -33.77 69.73 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 120.131 1.332 . . . . 0.0 110.354 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -70.72 -34.85 72.34 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 120.931 -1.106 . . . . 0.0 111.215 178.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -93.02 -0.86 57.07 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.498 1.919 . . . . 0.0 114.378 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 7.9 tt -44.98 -29.64 0.87 Allowed 'General case' 0 C--O 1.234 0.245 0 C-N-CA 130.021 3.328 . . . . 0.0 116.303 -177.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 6.6 mp -59.37 -54.1 50.57 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 118.835 0.743 . . . . 0.0 112.003 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 6.2 tt0 58.43 -173.41 0.09 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.32 1.048 . . . . 0.0 109.066 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 6.2 tptt -136.64 35.77 2.67 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.064 -1.648 . . . . 0.0 109.404 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -58.36 158.33 7.49 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 126.243 1.817 . . . . 0.0 113.632 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 2.7 t -158.42 94.51 1.28 Allowed 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 105.888 -1.893 . . . . 0.0 105.888 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 68.8 m -134.92 135.42 41.54 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 14.2 tt -142.68 15.5 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 124.397 1.079 . . . . 0.0 111.572 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -114.81 159.65 20.37 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.865 1.266 . . . . 0.0 110.368 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 55.0 m . . . . . 0 C--O 1.255 1.374 0 C-N-CA 127.791 2.436 . . . . 0.0 106.322 179.029 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.105 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 18.3 m -75.96 163.23 27.38 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 126.146 1.778 . . . . 0.0 111.161 -178.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 31.8 t70 -151.32 94.74 2.06 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.683 0.793 . . . . 0.0 110.456 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -139.15 25.82 2.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 127.542 2.337 . . . . 0.0 109.143 -179.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 15.6 t70 -139.66 139.99 36.79 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.868 1.667 . . . . 0.0 107.402 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 65.6 m -139.98 156.56 46.58 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.201 1.4 . . . . 0.0 107.727 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -111.09 140.69 45.43 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.845 0.831 . . . . 0.0 108.78 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.56 159.71 31.39 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.474 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.9 mt -146.23 146.95 30.97 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 177.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.63 112.84 6.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 17.4 m -155.47 151.33 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 C-N-CA 125.806 1.642 . . . . 0.0 109.258 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 102.19 11.73 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.71 108.97 0.53 Allowed Glycine 0 C--N 1.335 0.499 0 CA-C-O 117.043 -1.976 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -58.02 9.01 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 121.425 2.613 . . . . 0.0 112.573 -179.018 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -71.16 -42.77 68.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.575 -0.703 . . . . 0.0 109.144 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1108 ' ' ASN . . . . . 0.696 HD21 HD12 ' B' ' 119' ' ' LEU . 33.6 m-80 -54.05 -49.29 69.32 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.596 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 78.1 t80 -62.31 -44.65 96.01 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.335 0.97 . . . . 0.0 110.901 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.7 -45.31 94.67 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.836 0.744 . . . . 0.0 112.4 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.9 mt -66.97 -50.9 60.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.768 1.627 . . . . 0.0 109.457 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.59 -36.94 82.11 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 118.257 -0.878 . . . . 0.0 109.985 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 22.7 mtp -60.59 -52.55 64.7 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 119.464 1.029 . . . . 0.0 109.162 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -60.77 -42.01 96.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.486 -0.769 . . . . 0.0 111.229 -179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.1 mt -66.25 -46.61 76.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.601 0.637 . . . . 0.0 111.911 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.8 tptt -69.3 -54.04 16.63 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 117.122 -1.418 . . . . 0.0 111.328 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -53.17 -47.59 68.69 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 108.376 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 30.9 t -55.15 -54.28 45.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.334 0.654 . . . . 0.0 110.43 179.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -30.76 71.79 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 118.86 -0.591 . . . . 0.0 110.741 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.27 -49.07 79.07 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 120.075 1.307 . . . . 0.0 108.093 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.59 -41.18 80.0 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.124 -0.941 . . . . 0.0 108.525 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.8 tpt -64.37 -20.9 66.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.702 1.137 . . . . 0.0 111.402 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -83.12 -37.36 23.87 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.151 0.98 . . . . 0.0 108.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.22 -32.82 17.24 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 67.1 t -89.84 141.16 28.03 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 126.16 1.784 . . . . 0.0 109.35 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.78 177.25 5.07 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 123.332 2.688 . . . . 0.0 112.28 179.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -111.31 53.2 0.36 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.81 -70.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.482 2.121 . . . . 0.0 112.666 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.39 -39.07 82.21 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.5 t -52.16 -56.34 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.033 1.733 . . . . 0.0 110.654 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.43 -44.02 75.87 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.516 1.053 . . . . 0.0 111.84 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 36.8 m -57.13 -42.15 80.37 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 47.7 t80 -69.82 -44.37 70.11 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.651 1.581 . . . . 0.0 109.012 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -54.5 -48.83 71.4 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 117.911 -1.043 . . . . 0.0 110.362 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -66.48 -53.9 29.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.952 0.796 . . . . 0.0 110.992 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -54.86 -38.83 67.96 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.779 0.832 . . . . 0.0 113.203 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.47 -37.39 31.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.422 0.689 . . . . 0.0 109.966 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -57.74 -38.05 74.65 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.667 0.667 . . . . 0.0 110.049 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.4 mt -59.48 -15.23 16.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.895 0.878 . . . . 0.0 113.194 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -78.45 -16.93 57.03 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.171 0.988 . . . . 0.0 110.365 178.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.54 106.17 13.96 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.773 1.629 . . . . 0.0 108.194 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? . . . . . 0 C--O 1.246 0.896 0 CA-C-O 115.639 -2.124 . . . . 0.0 109.228 -179.263 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.466 0.357 0 CA-C-O 120.805 0.336 . . . . 0.0 111.449 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.79 -60.6 2.15 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 178.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -138.28 -51.63 0.59 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -174.25 112.97 0.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 103.768 -2.678 . . . . 0.0 103.768 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.12 101.08 0.26 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.188 0.995 . . . . 0.0 109.895 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mp -92.74 173.73 7.62 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -133.35 120.31 20.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.11 0.964 . . . . 0.0 108.902 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.6 tp -104.22 101.21 25.2 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 124.178 0.991 . . . . 0.0 109.442 179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -80.8 118.92 3.52 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.312 2.675 . . . . 0.0 110.248 178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -144.64 156.49 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 125.483 1.513 . . . . 0.0 107.03 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.6 103.67 5.53 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.082 -1.011 . . . . 0.0 109.497 178.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.11 125.19 1.29 Allowed Glycine 0 C--O 1.226 -0.349 0 N-CA-C 106.013 -2.835 . . . . 0.0 106.013 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -51.26 59.79 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 121.129 2.465 . . . . 0.0 109.642 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -72.63 -30.77 64.6 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.211 1.004 . . . . 0.0 110.559 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 m -66.83 -51.56 54.14 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.297 1.439 . . . . 0.0 109.277 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -63.69 -50.37 69.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.478 0.711 . . . . 0.0 109.774 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -57.99 -57.54 12.38 Favored 'General case' 0 C--O 1.231 0.1 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -63.16 -39.29 94.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.697 0.681 . . . . 0.0 112.751 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.2 mt -72.85 -35.1 67.16 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 118.134 -0.936 . . . . 0.0 111.125 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -69.71 -41.47 75.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.095 1.316 . . . . 0.0 107.765 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -56.38 -48.75 76.22 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.473 1.109 . . . . 0.0 109.713 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.69 -46.76 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.482 0.713 . . . . 0.0 109.983 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -53.94 -50.18 67.02 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 124.003 0.921 . . . . 0.0 110.103 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -71.57 -42.89 67.25 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.77 -1.11 . . . . 0.0 111.623 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.8 t -53.7 -51.48 63.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.573 1.078 . . . . 0.0 108.79 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.47 -56.91 14.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 124.695 1.247 . . . . 0.0 110.553 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -56.24 -43.24 78.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.972 0.806 . . . . 0.0 112.58 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.62 -43.91 75.34 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.85 1.204 . . . . 0.0 110.454 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.54 -38.5 84.69 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.029 0.932 . . . . 0.0 109.258 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.99 -37.72 84.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.689 1.196 . . . . 0.0 110.214 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -79.72 -24.04 41.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.556 1.142 . . . . 0.0 112.92 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 27.6 tp -122.09 65.85 21.74 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 120.297 1.408 . . . . 0.0 112.439 -178.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.97 144.55 34.43 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.246 1.964 . . . . 0.0 109.167 178.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.32 172.12 19.18 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.308 1.843 . . . . 0.0 107.184 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -48.35 -47.89 36.83 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 125.123 1.369 . . . . 0.0 114.159 -178.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.0 m -55.83 -43.84 77.35 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.104 1.32 . . . . 0.0 110.808 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.07 -55.03 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.039 1.335 . . . . 0.0 109.594 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.3 -42.85 99.36 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 m -65.72 -31.9 73.16 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -49.98 70.43 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 178.034 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -55.87 -48.5 75.44 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.003 0.921 . . . . 0.0 109.862 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -64.07 -41.81 97.21 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.63 0.772 . . . . 0.0 111.24 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.332 -0.162 0 O-C-N 121.137 -0.977 . . . . 0.0 110.66 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -66.5 -35.53 80.48 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -69.76 -31.22 69.05 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.532 1.133 . . . . 0.0 111.525 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -56.2 -37.36 69.53 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 111.979 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -54.12 -29.74 46.06 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.325 0.65 . . . . 0.0 111.297 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -54.61 -26.19 31.19 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.957 1.703 . . . . 0.0 111.678 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -70.57 -59.8 2.63 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -58.97 -36.41 74.8 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.26 1.024 . . . . 0.0 110.469 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -55.73 -24.41 34.73 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.954 2.102 . . . . 0.0 112.322 178.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 tp -62.25 -34.96 77.52 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.978 0.511 . . . . 0.0 111.494 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -55.06 114.85 1.92 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 124.257 1.023 . . . . 0.0 109.535 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -70.8 -26.24 63.22 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.119 0.968 . . . . 0.0 112.708 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -70.45 -165.37 0.1 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.887 0.875 . . . . 0.0 109.61 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 m 71.68 -22.68 0.2 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.041 1.736 . . . . 0.0 114.255 178.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.5 t -97.6 112.37 24.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.708 1.14 . . . . 0.0 111.231 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.4 tt -161.62 -15.3 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 126.451 1.901 . . . . 0.0 111.526 178.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 44.2 mm-40 -146.66 151.52 37.37 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 128.441 2.696 . . . . 0.0 105.985 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.0 m . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.484 -1.246 . . . . 0.0 107.69 179.022 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.091 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.5 t -81.59 -95.93 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -125.36 -11.95 6.84 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.834 0.854 . . . . 0.0 111.642 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -92.01 -18.82 23.1 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 125.252 1.421 . . . . 0.0 110.409 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 39.91 67.85 0.44 Allowed 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 128.718 2.807 . . . . 0.0 111.397 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m -57.51 138.43 55.15 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.401 1.08 . . . . 0.0 109.116 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -102.02 137.02 40.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.626 1.171 . . . . 0.0 108.901 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -114.15 149.83 35.08 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.931 1.693 . . . . 0.0 108.466 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mt -144.91 145.87 31.76 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.126 1.37 . . . . 0.0 108.041 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -151.73 110.76 3.88 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.413 0.685 . . . . 0.0 111.514 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -154.02 150.87 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.246 1.818 . . . . 0.0 107.704 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 24.2 ptt85 -99.18 101.86 13.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.79 1.177 . . . . 0.0 110.092 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.35 114.55 0.81 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 116.128 -2.484 . . . . 0.0 113.323 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 tpp85 -67.35 -56.77 8.37 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 122.751 3.275 . . . . 0.0 111.052 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -64.99 -50.62 65.61 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.996 1.718 . . . . 0.0 108.503 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -47.35 64.73 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.743 2.817 . . . . 0.0 109.393 -178.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -66.64 -47.39 72.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.157 0.89 . . . . 0.0 111.187 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -57.04 -43.08 81.61 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.342 0.973 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 60.2 mt -61.25 -54.69 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.813 1.245 . . . . 0.0 107.727 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.81 -37.36 76.21 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 117.871 -1.061 . . . . 0.0 112.524 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 60.0 mtp -65.44 -54.23 31.52 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 119.921 1.237 . . . . 0.0 111.298 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 13.9 ptpt -61.85 -43.0 99.72 Favored 'General case' 0 C--N 1.34 0.175 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.74 -51.48 58.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.427 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 116' ' ' LYS . . . . . 0.405 ' HE3' HG11 ' D' 1103 ' ' VAL . 41.4 tptt -54.84 -58.86 5.87 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.466 0.707 . . . . 0.0 110.672 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -52.68 -49.22 65.73 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.659 1.984 . . . . 0.0 111.432 -179.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 12.4 t -62.07 -43.58 98.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.086 0.403 . . . . 0.0 110.987 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' B' ' 119' ' ' LEU . 11.7 tp -62.98 -40.15 96.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.587 -0.721 . . . . 0.0 109.149 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -47.06 86.91 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -59.35 -52.3 66.22 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.717 0.807 . . . . 0.0 111.692 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 8.0 tmm? -62.73 -28.22 69.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.678 0.791 . . . . 0.0 111.349 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.78 -22.18 22.27 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.302 1.441 . . . . 0.0 113.214 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.93 -33.73 17.16 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.39 1.45 . . . . 0.0 111.145 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 3.7 t -94.94 147.5 33.17 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -65.79 -170.83 0.19 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.604 2.869 . . . . 0.0 111.182 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -112.19 78.0 2.32 Favored Pre-proline 0 CA--C 1.544 0.738 0 O-C-N 120.214 -1.554 . . . . 0.0 113.226 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -77.97 -97.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.73 2.953 . . . . 0.0 112.483 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.1 tt -55.76 -40.73 72.98 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.744 1.218 . . . . 0.0 109.881 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -53.37 -46.11 57.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.48 1.112 . . . . 0.0 111.238 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.15 -42.05 73.03 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 121.1 -1.0 . . . . 0.0 110.36 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.5 t -57.83 -46.62 84.47 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -67.29 -39.48 85.98 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.623 1.569 . . . . 0.0 111.11 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -47.8 70.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 119.311 0.96 . . . . 0.0 109.024 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.44 -50.96 61.61 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -51.22 -44.15 61.59 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.309 1.043 . . . . 0.0 112.422 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.1 tm0? -76.59 -40.68 48.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.85 0.86 . . . . 0.0 110.666 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -53.64 -34.84 59.96 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.885 0.874 . . . . 0.0 111.435 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.02 -10.21 3.98 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.1 tt -93.14 -22.25 19.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.439 1.895 . . . . 0.0 109.94 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -83.82 177.04 8.51 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 120.261 -1.525 . . . . 0.0 110.006 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 127.362 2.265 . . . . 0.0 105.909 179.483 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.463 0.214 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 4.0 t70 -69.9 -59.09 3.14 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 178.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 10.6 t70 -142.17 -53.25 0.42 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.824 0.675 . . . . 0.0 112.824 177.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -176.86 124.47 0.15 Allowed 'General case' 0 CA--C 1.523 -0.08 0 C-N-CA 126.525 1.93 . . . . 0.0 106.868 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 5.0 tp -61.49 105.08 0.48 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.0 1.32 . . . . 0.0 111.366 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 14.4 mt -93.36 133.73 36.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -103.45 103.34 13.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.937 1.295 . . . . 0.0 107.824 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.6 tp -97.79 111.8 59.89 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 117.609 -1.186 . . . . 0.0 110.586 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -81.89 115.74 2.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.504 2.803 . . . . 0.0 111.686 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 37.6 t -143.88 148.97 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 120.039 1.291 . . . . 0.0 109.357 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.42 102.74 5.05 Favored 'General case' 0 C--N 1.346 0.428 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 179.464 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.06 136.36 4.06 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-O 115.104 -3.053 . . . . 0.0 105.475 176.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -53.46 14.69 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 122.991 3.396 . . . . 0.0 106.96 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.62 -30.23 66.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 2.4 m -66.58 -52.23 47.73 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.14 0.882 . . . . 0.0 108.947 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.48 -52.65 62.65 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -57.27 -56.54 20.53 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 124.025 0.93 . . . . 0.0 112.829 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ttm -60.53 -34.8 74.64 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.165 1.348 . . . . 0.0 112.045 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.1 mt -68.66 -53.06 24.73 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -50.09 74.85 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 124.131 0.972 . . . . 0.0 111.523 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -55.59 -48.45 74.82 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.885 1.274 . . . . 0.0 110.243 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1022 ' ' ILE . . . . . 0.442 ' CG2' HD22 ' D' 1115 ' ' LEU . 54.7 mt -70.09 -37.25 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 121.695 -0.628 . . . . 0.0 109.963 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -62.64 -51.64 66.47 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.247 1.019 . . . . 0.0 110.791 179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.63 -36.99 76.63 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.368 1.067 . . . . 0.0 108.617 -178.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 42.4 t -56.5 -48.6 76.83 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.829 1.195 . . . . 0.0 107.854 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tm? -67.55 -54.05 23.18 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.479 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.26 -52.26 63.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.692 0.678 . . . . 0.0 112.644 -178.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 85.3 mt -64.9 -47.7 76.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.233 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -57.59 -41.7 81.69 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.38 -33.46 74.3 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.085 -1.01 . . . . 0.0 110.004 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -72.16 -18.61 61.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.072 0.949 . . . . 0.0 109.766 178.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 45.6 tp -128.3 70.46 79.15 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.842 1.257 . . . . 0.0 109.11 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -80.18 142.04 14.96 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.384 2.056 . . . . 0.0 108.371 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -162.01 172.62 15.64 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.031 1.732 . . . . 0.0 108.078 -179.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -50.16 -34.54 22.75 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 116.087 -1.911 . . . . 0.0 114.171 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 85.5 m -57.64 -45.2 85.76 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 122.29 2.314 . . . . 0.0 109.534 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.86 -54.59 32.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 C-N-CA 125.297 1.439 . . . . 0.0 108.623 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.31 -33.88 73.0 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 51.5 m -69.92 -52.56 23.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -47.3 76.9 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.699 0.682 . . . . 0.0 110.397 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -61.42 -49.36 77.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.626 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -68.97 -29.28 67.47 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 118.943 0.792 . . . . 0.0 112.939 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -66.97 -35.69 80.52 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.324 0.965 . . . . 0.0 108.584 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -78.61 -40.93 33.07 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -54.81 -40.93 70.01 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.803 1.241 . . . . 0.0 110.357 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -53.51 -35.3 60.51 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.047 1.339 . . . . 0.0 112.193 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -55.09 -28.65 54.04 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.79 1.236 . . . . 0.0 111.178 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -50.67 -29.91 12.34 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.76 1.224 . . . . 0.0 111.414 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -64.13 -56.73 12.78 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.013 0.925 . . . . 0.0 109.014 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 30.6 m170 -64.9 -34.9 79.49 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.263 0.625 . . . . 0.0 109.681 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.4 -28.34 69.18 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.18 0.992 . . . . 0.0 111.218 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 11.2 tp -57.39 -31.8 66.18 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.498 0.719 . . . . 0.0 110.747 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -59.96 154.01 19.89 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.771 1.629 . . . . 0.0 110.529 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -114.87 -25.04 8.37 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.52 1.128 . . . . 0.0 111.983 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -68.54 174.79 3.87 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.652 0.739 . . . . 0.0 110.822 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 27.7 m 67.51 -13.56 0.23 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.631 1.972 . . . . 0.0 115.149 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 8.0 t -87.3 85.26 7.16 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 120.46 1.482 . . . . 0.0 108.427 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 17.9 tt -141.93 -19.71 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -125.61 158.98 33.32 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 125.372 1.469 . . . . 0.0 108.993 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 3.8 t . . . . . 0 C--O 1.247 0.973 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 -179.447 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.244 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 3.8 t -69.44 -51.12 39.25 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 14.6 t70 -154.75 -40.02 0.09 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.512 0.725 . . . . 0.0 111.876 -179.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -68.92 -16.07 63.65 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 117.251 -1.356 . . . . 0.0 114.479 -178.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 7.2 m-20 38.54 77.93 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 128.622 2.769 . . . . 0.0 111.966 -179.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 30.1 m -62.05 152.27 33.07 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 125.414 1.486 . . . . 0.0 110.805 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -107.83 130.28 55.0 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.127 0.971 . . . . 0.0 110.913 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -109.96 144.02 39.08 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 127.584 2.354 . . . . 0.0 107.636 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 12.5 mt -140.98 143.48 34.51 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.267 1.427 . . . . 0.0 109.211 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -145.37 110.32 5.16 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.773 1.229 . . . . 0.0 110.21 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1103 ' ' VAL . . . . . 0.405 HG11 ' HE3' ' B' ' 116' ' ' LYS . 26.2 t -151.11 151.27 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.492 1.517 . . . . 0.0 110.316 -179.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -110.9 101.89 10.43 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 120.346 1.43 . . . . 0.0 107.312 176.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.55 108.93 0.51 Allowed Glycine 0 CA--C 1.521 0.451 0 CA-C-O 116.607 -2.219 . . . . 0.0 109.649 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -59.91 -58.2 9.58 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 121.697 2.749 . . . . 0.0 115.434 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.76 -47.47 66.15 Favored 'General case' 0 CA--C 1.508 -0.649 0 O-C-N 121.124 -0.985 . . . . 0.0 108.927 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -53.96 -43.4 69.87 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.998 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.6 t80 -66.12 -49.22 68.26 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.377 0.99 . . . . 0.0 110.886 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -52.76 -49.64 65.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.877 0.846 . . . . 0.0 110.625 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 64.4 mt -57.8 -53.78 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 126.058 1.743 . . . . 0.0 107.994 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.1 mp -59.0 -40.5 85.08 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.659 -1.162 . . . . 0.0 112.279 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 58.2 mtp -58.68 -53.22 60.79 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 120.442 1.474 . . . . 0.0 110.577 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -64.15 -40.57 96.43 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 119.981 -0.688 . . . . 0.0 112.313 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1115 ' ' LEU . . . . . 0.442 HD22 ' CG2' ' C' 1022 ' ' ILE . 55.3 mt -70.95 -33.39 70.43 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.705 -0.622 . . . . 0.0 112.518 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 23.9 tptt -64.88 -58.6 5.74 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -49.74 -48.76 49.97 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 127.693 2.397 . . . . 0.0 110.93 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 20.7 t -56.3 -54.05 50.02 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.474 1.11 . . . . 0.0 111.695 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1119 ' ' LEU . . . . . 0.4 HD12 ' HA ' ' D' 1119 ' ' LEU . 5.7 tp -59.19 -42.61 91.27 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.862 0.465 . . . . 0.0 110.842 -178.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.05 -41.24 91.89 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.223 1.009 . . . . 0.0 110.988 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 1.1 mm? -65.24 -53.63 41.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.854 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 55.8 mmm -57.8 -27.62 63.29 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -85.12 -36.71 20.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.67 -32.14 28.29 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.275 0.943 . . . . 0.0 113.19 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.37 149.22 40.69 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 126.446 1.898 . . . . 0.0 108.134 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -65.44 174.09 5.65 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.993 2.462 . . . . 0.0 111.036 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1127 ' ' GLN . . . . . 0.413 ' HA ' HG22 ' D' 1130 ' ' VAL . 16.4 mp0 -112.51 61.89 0.65 Allowed Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.359 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.68 -86.87 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.1 3.2 . . . . 0.0 111.408 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.1 -43.53 82.32 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.131 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1130 ' ' VAL . . . . . 0.413 HG22 ' HA ' ' D' 1127 ' ' GLN . 3.0 m -51.24 -40.86 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-O 118.213 -0.898 . . . . 0.0 112.124 -177.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.45 -41.84 45.99 Favored 'General case' 0 C--N 1.338 0.102 0 CA-C-N 118.748 0.704 . . . . 0.0 110.165 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -49.91 73.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.464 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 77.3 t80 -64.91 -40.01 94.4 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 127.028 2.131 . . . . 0.0 108.813 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -43.51 67.84 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.599 1.091 . . . . 0.0 108.238 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -77.62 -44.92 26.69 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.86 0.864 . . . . 0.0 111.867 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -56.79 -49.85 74.09 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.53 1.132 . . . . 0.0 110.441 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -64.02 -46.58 83.82 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.425 2.29 . . . . 0.0 108.787 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -55.32 -32.02 62.15 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.22 1.008 . . . . 0.0 111.57 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -2.42 1.37 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.98 -14.38 16.51 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.044 1.738 . . . . 0.0 108.854 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1141 ' ' GLN . . . . . 0.412 ' HG2' ' H ' ' D' 1142 ' ' ARG . 8.8 tt0 -95.35 175.8 6.44 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 119.783 -1.823 . . . . 0.0 108.015 178.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D 1142 ' ' ARG . . . . . 0.412 ' H ' ' HG2' ' D' 1141 ' ' GLN . 36.1 ptt-85 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 125.613 1.565 . . . . 0.0 107.991 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 N--CA 1.471 0.584 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.93 32.8 0.32 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.35 1.06 . . . . 0.0 110.735 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -115.75 11.04 15.55 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.156 1.782 . . . . 0.0 114.257 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.67 108.53 5.73 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.39 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.2 tp -65.68 94.88 0.21 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.935 1.694 . . . . 0.0 108.847 -179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.76 137.25 36.91 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.754 1.221 . . . . 0.0 112.182 -178.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -104.19 159.23 15.87 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -142.08 101.04 5.82 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.36 125.88 10.55 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.256 1.971 . . . . 0.0 110.105 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.2 t -144.99 134.95 18.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 123.237 0.615 . . . . 0.0 110.179 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 ptt85 -136.91 102.85 4.99 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.92 117.63 0.75 Allowed Glycine 0 N--CA 1.45 -0.427 1 N-CA-C 102.786 -4.126 . . . . 0.0 102.786 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmm-85 -57.89 -51.37 69.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 121.359 2.58 . . . . 0.0 111.457 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -66.48 -40.82 89.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.906 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.86 -45.64 92.92 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.46 -0.775 . . . . 0.0 111.361 -179.034 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -58.93 -47.49 84.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.71 1.204 . . . . 0.0 109.814 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.67 -57.16 12.58 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.933 0.77 . . . . 0.0 110.736 179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.0 ptm -65.16 -42.84 93.36 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.26 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.01 -45.29 87.09 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.21 0.913 . . . . 0.0 111.175 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.5 -53.39 58.12 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 123.611 0.764 . . . . 0.0 109.496 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -40.91 97.17 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -178.39 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.439 HD11 ' CG2' ' D' 1111 ' ' ILE . 91.5 mt -67.91 -45.33 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -63.96 -44.35 93.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.281 -0.636 . . . . 0.0 109.281 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -61.03 -50.87 71.56 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.146 -0.93 . . . . 0.0 109.428 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.3 p -53.19 -40.0 64.09 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.84 1.2 . . . . 0.0 111.177 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.09 -49.96 25.56 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.475 0.58 . . . . 0.0 111.664 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.44 -53.76 53.62 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.889 1.676 . . . . 0.0 110.61 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.96 -43.33 95.11 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.499 1.519 . . . . 0.0 109.718 -179.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.8 ttt -63.47 -35.82 81.73 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.413 0.685 . . . . 0.0 110.55 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -78.29 -31.14 48.77 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.347 -0.845 . . . . 0.0 111.57 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -76.46 -35.04 58.66 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.424 0.69 . . . . 0.0 111.252 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 tp -128.73 76.45 78.8 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.65 -50.38 0.37 Allowed 'Trans proline' 0 N--CA 1.447 -1.218 0 N-CA-C 107.095 -1.925 . . . . 0.0 107.095 178.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 59.78 176.66 0.09 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 122.284 1.04 . . . . 0.0 109.186 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -70.08 -22.79 63.01 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 120.172 -1.58 . . . . 0.0 109.927 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.2 m -63.91 -52.4 60.06 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 117.988 -1.006 . . . . 0.0 111.065 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 35.7 mm -71.68 -42.04 71.1 Favored 'Isoleucine or valine' 0 C--N 1.346 0.413 0 CA-C-N 120.134 1.334 . . . . 0.0 108.934 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -57.1 -42.26 80.44 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.347 0.522 . . . . 0.0 111.071 -178.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.3 m -64.28 -52.44 58.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 109.667 178.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -50.75 71.25 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 123.628 0.771 . . . . 0.0 111.738 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 18.4 ttp85 -62.6 -38.6 90.81 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 118.2 -0.905 . . . . 0.0 109.777 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -56.62 -52.81 63.45 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 119.63 1.104 . . . . 0.0 110.564 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -65.28 -41.73 93.87 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 123.339 0.399 . . . . 0.0 110.635 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -61.77 -41.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.989 0.813 . . . . 0.0 110.254 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -66.0 -29.96 70.42 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.099 0.96 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -47.51 61.22 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.0 tm0? -60.68 -41.11 94.45 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.168 0.987 . . . . 0.0 109.155 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 14.0 t-160 -55.91 -34.7 65.82 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.77 1.628 . . . . 0.0 111.43 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -66.06 -45.16 82.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.805 1.184 . . . . 0.0 109.242 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -64.48 -38.71 91.98 Favored 'General case' 0 N--CA 1.458 -0.042 0 C-N-CA 122.963 0.505 . . . . 0.0 110.937 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.22 -28.86 70.03 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.474 1.11 . . . . 0.0 110.528 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.43 7.36 42.6 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.56 1.544 . . . . 0.0 111.61 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -75.68 91.53 2.9 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -160.03 134.48 7.57 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 105.525 -2.028 . . . . 0.0 105.525 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -53.23 -55.99 20.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.313 0.645 . . . . 0.0 112.043 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 63.32 -164.11 0.26 Allowed 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.5 p -77.23 2.86 14.28 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.6 tt -135.5 167.44 25.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-N 120.855 1.661 . . . . 0.0 110.946 -178.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -68.98 98.68 0.98 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.256 -0.902 . . . . 0.0 111.808 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 71.4 m . . . . . 0 C--O 1.257 1.461 0 C-N-CA 130.539 3.535 . . . . 0.0 106.145 178.67 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 CA-C-O 119.675 -0.514 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 23.7 t -129.25 -162.16 1.18 Allowed 'General case' 0 C--O 1.241 0.617 0 C-N-CA 127.189 2.196 . . . . 0.0 106.157 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -65.64 120.07 12.27 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 177.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -77.61 15.03 0.88 Allowed 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -178.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -128.98 165.48 21.04 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 126.012 1.725 . . . . 0.0 108.536 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.09 173.01 17.08 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 126.239 1.816 . . . . 0.0 108.843 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -129.56 129.64 44.71 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -114.38 167.81 10.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.339 1.055 . . . . 0.0 109.567 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 20.1 tp -149.22 154.71 39.51 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.882 178.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -150.41 98.81 2.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.957 1.703 . . . . 0.0 110.342 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.9 t -146.74 150.05 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 119.899 -1.751 . . . . 0.0 108.62 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -116.34 100.24 7.75 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 122.284 1.04 . . . . 0.0 108.701 177.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.38 107.79 0.46 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 106.819 -2.513 . . . . 0.0 106.819 177.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -56.78 15.16 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 121.512 2.656 . . . . 0.0 111.932 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -67.01 -47.0 72.79 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -52.06 -45.51 64.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.017 1.327 . . . . 0.0 112.269 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -69.96 -43.44 71.52 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.238 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -56.74 -48.18 78.37 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.948 0.88 . . . . 0.0 110.42 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 63.9 mt -65.12 -52.35 54.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 125.29 1.436 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -36.02 82.29 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.392 -1.766 . . . . 0.0 112.269 -178.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 9.5 mtm -64.12 -52.29 59.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.86 1.664 . . . . 0.0 108.55 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -48.24 -52.13 22.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.039 0.936 . . . . 0.0 109.423 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.401 HD22 HG23 ' A' ' 22' ' ' ILE . 80.6 mt -68.33 -32.8 73.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 116' ' ' LYS . . . . . 0.451 ' HE3' HG11 ' D' 1103 ' ' VAL . 30.3 tptt -70.35 -52.08 25.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.32 -1.487 . . . . 0.0 109.451 -178.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -54.45 -52.34 62.15 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 127.783 2.433 . . . . 0.0 106.165 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 29.3 t -52.76 -48.11 66.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.733 1.213 . . . . 0.0 112.595 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -52.47 57.73 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.66 -37.96 83.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.332 0.969 . . . . 0.0 111.263 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.49 -40.82 93.53 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 117.983 -1.008 . . . . 0.0 109.486 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 54.3 ttp -66.46 -28.94 68.98 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.868 0.758 . . . . 0.0 109.546 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.18 -32.75 65.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.462 1.028 . . . . 0.0 112.075 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 -32.76 26.08 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 125' ' ' VAL . . . . . 0.458 HG22 ' HD2' ' B' ' 126' ' ' PRO . 4.0 p -85.26 148.1 49.1 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.08 0.952 . . . . 0.0 109.664 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.458 ' HD2' HG22 ' B' ' 125' ' ' VAL . 60.5 Cg_endo -63.31 173.6 4.07 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.939 1.371 . . . . 0.0 110.133 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.43 55.16 1.71 Allowed Pre-proline 0 CA--C 1.548 0.877 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.73 -49.61 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 123.116 2.544 . . . . 0.0 114.35 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -28.51 69.55 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.118 -0.989 . . . . 0.0 108.46 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 11.4 t -61.4 -49.84 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -55.2 -51.36 66.78 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.602 1.561 . . . . 0.0 111.152 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 m -67.91 -46.31 71.91 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -57.98 -49.22 77.57 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.244 0.617 . . . . 0.0 109.409 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -43.26 67.87 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.903 1.681 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.09 -57.08 5.37 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.122 0.487 . . . . 0.0 111.844 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -61.09 -29.72 69.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.309 0.643 . . . . 0.0 112.094 -178.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.22 -37.73 52.73 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 178.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -58.55 -33.07 69.5 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.741 1.155 . . . . 0.0 109.395 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.43 -21.02 49.48 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 119.11 -0.471 . . . . 0.0 111.243 178.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.73 -10.7 59.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.144 1.378 . . . . 0.0 112.075 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -121.49 173.93 7.08 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.321 -1.487 . . . . 0.0 107.728 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.179 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.464 0.253 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -88.29 2.97 51.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.899 0.772 . . . . 0.0 111.524 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 4.3 p30 -79.9 5.22 14.4 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 126.143 1.777 . . . . 0.0 113.508 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -80.58 91.13 5.76 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.946 -1.096 . . . . 0.0 112.838 -178.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 18.9 tp -67.37 108.99 2.97 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.838 0.855 . . . . 0.0 109.283 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.4 mt -104.42 153.3 21.27 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -126.08 101.4 6.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.43 1.092 . . . . 0.0 109.175 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.03 113.0 40.05 Favored Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -91.49 122.44 0.71 Allowed 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 123.21 2.607 . . . . 0.0 109.751 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.1 t -142.27 154.59 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 125.834 1.653 . . . . 0.0 109.398 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 26.0 ptt180 -136.73 101.81 4.72 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 121.399 1.909 . . . . 0.0 111.034 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.18 138.28 5.05 Favored Glycine 0 N--CA 1.46 0.235 0 CA-C-O 116.326 -2.374 . . . . 0.0 107.645 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -52.1 27.62 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 121.008 2.404 . . . . 0.0 111.294 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.46 -41.9 92.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.364 0.529 . . . . 0.0 109.796 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -47.63 84.87 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.415 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 52.8 t80 -65.11 -40.81 95.04 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.439 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -55.11 -57.68 10.73 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.986 0.812 . . . . 0.0 108.994 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 24.6 ptm -67.65 -35.42 78.86 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.8 -41.63 91.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.533 1.061 . . . . 0.0 110.844 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.33 -47.93 58.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 178.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -56.6 -48.61 77.05 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.128 0.971 . . . . 0.0 112.888 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 93.3 mt -70.33 -35.89 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 119.304 0.956 . . . . 0.0 110.242 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -36.34 83.46 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.6 -54.84 10.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 117.871 -1.062 . . . . 0.0 110.607 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.5 p -53.51 -43.59 68.43 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.363 1.438 . . . . 0.0 113.856 -178.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.98 -47.52 51.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.812 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -64.35 -46.09 84.94 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 67.5 mt -62.16 -44.9 95.6 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.963 0.905 . . . . 0.0 109.909 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -59.25 -41.68 89.34 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.755 0.822 . . . . 0.0 109.079 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -75.08 -25.28 58.47 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.784 0.434 . . . . 0.0 111.169 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.56 -39.17 58.57 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.373 0.988 . . . . 0.0 110.849 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 59.0 tp -127.62 71.48 77.58 Favored Pre-proline 0 C--O 1.236 0.347 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.98 -57.76 0.12 Allowed 'Trans proline' 0 N--CA 1.444 -1.401 0 N-CA-C 108.491 -1.388 . . . . 0.0 108.491 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 1.5 tt0 61.31 -176.58 0.12 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.496 1.118 . . . . 0.0 108.36 -178.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -29.29 70.63 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 120.427 -1.421 . . . . 0.0 112.828 -179.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.41 58.25 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.448 1.022 . . . . 0.0 111.883 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 47.6 mm -73.25 -40.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-O 118.548 -0.739 . . . . 0.0 110.51 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -58.98 -49.2 78.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.874 0.761 . . . . 0.0 110.474 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.0 m -61.45 -40.16 93.46 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.972 0.509 . . . . 0.0 110.965 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -53.83 26.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.825 0.45 . . . . 0.0 111.196 -179.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 16.7 ttp85 -62.26 -40.71 97.09 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.212 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -59.05 -47.87 83.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.646 0.657 . . . . 0.0 109.334 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -65.09 -45.54 84.79 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.612 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -56.37 -48.32 77.07 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.71 0.804 . . . . 0.0 110.0 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -58.49 -40.36 82.55 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.978 0.911 . . . . 0.0 110.22 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -69.1 -46.1 68.57 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.976 0.91 . . . . 0.0 110.771 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 14.7 tm0? -56.93 -46.96 81.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.354 1.062 . . . . 0.0 108.611 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 78.6 t60 -58.34 -26.06 62.67 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.488 1.515 . . . . 0.0 112.3 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -58.7 -45.24 89.94 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 119.735 1.152 . . . . 0.0 108.047 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -67.51 -29.67 69.14 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.954 0.502 . . . . 0.0 111.58 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 2.4 tt -67.52 -48.74 66.17 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.1 -8.35 58.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.187 0.595 . . . . 0.0 112.563 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -61.64 97.57 0.08 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.401 1.48 . . . . 0.0 110.762 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -169.61 149.1 3.82 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 125.638 1.575 . . . . 0.0 107.252 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -61.47 -66.63 0.51 Allowed 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.707 1.203 . . . . 0.0 110.641 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1056 ' ' THR . . . . . 0.452 HG22 ' H ' ' C' 1057 ' ' SER . 1.2 m 65.71 -167.06 0.22 Allowed 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 -178.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C 1057 ' ' SER . . . . . 0.452 ' H ' HG22 ' C' 1056 ' ' THR . 0.1 OUTLIER -73.82 20.15 0.1 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.982 1.713 . . . . 0.0 113.001 -179.953 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 15.0 tt -141.73 171.03 12.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 O-C-N 120.689 -1.257 . . . . 0.0 109.644 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -82.51 98.59 9.01 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 4.1 m . . . . . 0 C--O 1.246 0.91 0 C-N-CA 126.487 1.915 . . . . 0.0 110.068 -179.841 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.694 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 43.8 m -148.84 -167.72 2.9 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.965 2.106 . . . . 0.0 106.552 178.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.46 127.51 32.52 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.689 1.196 . . . . 0.0 109.285 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -83.08 2.19 36.45 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.091 -1.006 . . . . 0.0 110.259 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.46 160.42 21.22 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.813 1.645 . . . . 0.0 111.016 -178.411 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.52 167.07 31.58 Favored 'General case' 0 C--O 1.242 0.658 0 C-N-CA 127.068 2.147 . . . . 0.0 106.383 178.344 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -131.74 129.74 41.02 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -112.43 174.11 6.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.258 0.623 . . . . 0.0 112.317 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 17.4 tp -150.32 153.35 35.95 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.713 178.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.15 98.82 2.74 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.88 2.072 . . . . 0.0 109.065 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1103 ' ' VAL . . . . . 0.451 HG11 ' HE3' ' B' ' 116' ' ' LYS . 60.9 t -153.18 147.03 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.384 -0.823 . . . . 0.0 108.861 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -103.98 102.84 12.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.659 -1.276 . . . . 0.0 108.406 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.13 110.53 0.63 Allowed Glycine 0 C--O 1.223 -0.586 0 CA-C-O 117.289 -1.839 . . . . 0.0 111.695 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -67.42 -57.17 7.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 121.225 2.512 . . . . 0.0 110.189 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -69.79 -42.57 73.59 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 122.143 0.973 . . . . 0.0 109.538 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.05 -43.06 99.45 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.764 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 10.2 t80 -69.99 -37.96 75.88 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 120.086 1.312 . . . . 0.0 110.829 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -56.17 -47.49 78.16 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.425 1.011 . . . . 0.0 109.493 178.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1111 ' ' ILE . . . . . 0.439 ' CG2' HD11 ' A' ' 22' ' ' ILE . 22.5 mt -62.42 -50.16 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.826 1.25 . . . . 0.0 109.15 178.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -49.04 77.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 125.457 1.503 . . . . 0.0 112.082 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.31 -52.16 63.09 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 120.957 1.708 . . . . 0.0 109.114 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -48.79 -51.82 27.23 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.157 0.583 . . . . 0.0 111.12 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 41.8 mt -71.25 -39.67 71.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 33.6 tptt -65.27 -46.1 81.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 120.121 1.328 . . . . 0.0 110.161 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -57.18 -54.92 41.36 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.856 1.662 . . . . 0.0 106.691 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 5.5 t -52.74 -43.93 66.07 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.081 0.952 . . . . 0.0 111.765 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.81 -49.01 62.06 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -63.07 -42.05 99.57 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 5.3 mp -65.42 -45.66 83.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.846 -1.074 . . . . 0.0 108.852 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 22.7 ttp -64.35 -22.57 67.0 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.749 1.613 . . . . 0.0 111.362 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -72.25 -40.36 67.75 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.71 -33.08 35.56 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.53 147.98 68.89 Favored Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 124.752 1.221 . . . . 0.0 109.867 -179.204 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.92 -174.16 1.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.543 2.162 . . . . 0.0 110.162 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.253 13.3 pt20 -126.63 54.04 10.84 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.48 -52.51 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.935 2.423 . . . . 0.0 112.51 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.45 -41.78 85.9 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1130 ' ' VAL . . . . . 0.426 HG23 ' H ' ' D' 1130 ' ' VAL . 3.4 t -53.74 -50.27 52.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 C-N-CA 124.401 1.08 . . . . 0.0 110.529 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.29 70.22 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.491 0.662 . . . . 0.0 111.606 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 27.8 t -60.46 -46.28 90.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.792 0.837 . . . . 0.0 110.786 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.25 -45.24 81.29 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 124.716 1.206 . . . . 0.0 110.926 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.74 -45.26 66.92 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 124.5 1.12 . . . . 0.0 108.747 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -65.75 -55.96 14.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.229 0.468 . . . . 0.0 111.02 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.74 -30.88 64.0 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.579 -0.701 . . . . 0.0 112.408 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 -35.58 34.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.103 0.961 . . . . 0.0 108.772 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -58.12 -33.17 68.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.45 1.023 . . . . 0.0 108.935 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.42 -17.68 59.86 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.191 0.451 . . . . 0.0 112.135 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tt -80.82 -35.3 33.09 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.411 1.484 . . . . 0.0 108.912 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -89.69 163.86 14.94 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.571 0.7 . . . . 0.0 110.192 179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? . . . . . 0 C--O 1.251 1.164 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 178.022 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.6 p . . . . . 0 CA--C 1.541 0.631 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -92.83 -7.98 44.81 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.461 -1.399 . . . . 0.0 112.916 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.9 m-20 -134.07 39.33 3.12 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -78.85 85.5 4.83 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.355 1.062 . . . . 0.0 108.699 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.5 tp -64.13 102.74 0.53 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.6 mt -112.77 167.71 10.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.833 2.053 . . . . 0.0 107.709 -179.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -130.26 159.43 36.92 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.808 0.843 . . . . 0.0 109.799 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.4 tp -140.39 94.72 8.41 Favored Pre-proline 0 CA--C 1.538 0.482 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.115 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.85 110.3 3.0 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 124.303 3.336 . . . . 0.0 111.653 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -139.32 151.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.535 1.134 . . . . 0.0 109.215 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -135.98 101.81 4.84 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.3 115.79 0.64 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 106.269 -2.732 . . . . 0.0 106.269 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.55 -52.01 66.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 121.315 2.558 . . . . 0.0 109.828 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -68.96 -30.72 69.2 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.4 m -63.39 -53.13 57.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.068 0.947 . . . . 0.0 109.182 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -64.87 -47.6 77.28 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.73 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -53.41 -44.87 69.07 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.422 0.556 . . . . 0.0 111.722 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.5 mtp -73.79 -43.78 57.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.554 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mp -55.24 -50.88 68.33 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.058 0.845 . . . . 0.0 109.186 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -52.71 63.2 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 126.759 2.023 . . . . 0.0 111.289 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -55.5 -49.38 72.71 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.005 0.821 . . . . 0.0 112.225 -178.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.438 HG23 HD22 ' B' ' 115' ' ' LEU . 80.9 mt -66.12 -48.84 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -55.13 -47.21 75.36 Favored 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.06 0.944 . . . . 0.0 111.0 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -59.03 -50.14 75.2 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.047 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.8 p -53.81 -51.44 63.5 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.937 1.244 . . . . 0.0 112.936 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -62.57 -49.74 74.06 Favored 'General case' 0 C--N 1.345 0.41 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.47 -43.31 94.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.638 -178.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.87 -36.71 85.22 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.634 -0.666 . . . . 0.0 109.778 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -60.26 -44.39 95.34 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -78.69 -17.33 56.08 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.987 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -81.46 -24.13 37.0 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.003 1.274 . . . . 0.0 109.735 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.8 tp -127.36 71.69 76.87 Favored Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.14 0.976 . . . . 0.0 109.006 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.3 150.92 81.4 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.166 1.911 . . . . 0.0 110.049 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -159.5 165.73 32.39 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.302 1.041 . . . . 0.0 110.607 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -58.23 -40.6 82.15 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.52 1.128 . . . . 0.0 111.098 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.3 m -57.08 -51.13 70.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.234 1.414 . . . . 0.0 109.905 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 66.8 mt -59.1 -45.19 92.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 124.99 1.316 . . . . 0.0 108.92 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -60.23 -45.46 93.14 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.4 m -61.26 -48.19 82.58 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.109 0.963 . . . . 0.0 108.525 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.4 -50.42 71.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.784 0.833 . . . . 0.0 109.179 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttt-85 -56.09 -47.04 78.8 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 119.221 -0.419 . . . . 0.0 110.985 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -56.93 15.03 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.429 1.092 . . . . 0.0 110.423 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.76 -35.86 66.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.357 1.063 . . . . 0.0 111.352 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -69.51 -48.74 59.52 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -60.26 -38.8 84.65 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.59 1.156 . . . . 0.0 111.183 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -26.13 66.6 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.037 0.935 . . . . 0.0 110.715 178.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.71 -39.12 76.5 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 120.129 1.331 . . . . 0.0 110.743 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -64.54 -42.28 95.82 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.4 1.455 . . . . 0.0 109.757 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -62.55 -42.46 99.55 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -65.65 -37.35 86.3 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.095 0.558 . . . . 0.0 111.063 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.1 mt -68.09 -26.37 65.79 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.827 1.251 . . . . 0.0 110.611 178.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.6 tp -101.73 16.73 24.91 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.407 1.483 . . . . 0.0 110.366 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 45.7 56.84 5.5 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.954 3.302 . . . . 0.0 113.821 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -105.37 153.04 22.2 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -49.82 98.85 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.125 1.37 . . . . 0.0 111.727 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.8 p -148.03 -62.58 0.26 Allowed 'General case' 0 CA--C 1.527 0.078 0 C-N-CA 124.793 1.237 . . . . 0.0 110.416 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m 56.09 79.2 0.18 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.598 1.559 . . . . 0.0 110.214 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.4 tt -116.93 136.88 52.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 O-C-N 121.856 -0.528 . . . . 0.0 110.962 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -72.43 158.98 34.74 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 124.101 0.96 . . . . 0.0 110.825 179.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.15 1.78 . . . . 0.0 107.457 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.518 0 N-CA-C 108.264 -1.934 . . . . 0.0 108.264 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 48.4 m -136.29 -179.59 5.77 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -108.36 146.75 32.54 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -17.31 56.37 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -72.73 168.81 17.99 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.612 0.72 . . . . 0.0 111.272 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 51.7 m -100.96 155.06 18.18 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.945 2.098 . . . . 0.0 107.868 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 99' ' ' TYR . . . . . 0.43 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 37.7 m-85 -120.68 130.58 54.15 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 121.675 0.75 . . . . 0.0 109.445 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -112.26 159.12 18.93 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 127.529 2.332 . . . . 0.0 109.846 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.445 ' HB3' ' HE2' ' D' 1116 ' ' LYS . 28.5 mt -150.65 142.27 23.59 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 179.082 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -147.69 106.92 3.87 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.117 1.767 . . . . 0.0 112.068 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.433 ' CG2' ' HE3' ' D' 1116 ' ' LYS . 53.2 t -155.22 149.75 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 120.39 1.45 . . . . 0.0 110.425 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.1 102.42 14.95 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 102.575 -3.12 . . . . 0.0 102.575 176.234 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.65 109.78 0.56 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 115.671 -2.738 . . . . 0.0 106.44 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -68.32 -56.98 6.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 121.873 2.837 . . . . 0.0 112.002 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -64.31 -46.55 83.06 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.29 -51.19 60.0 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 125.062 1.345 . . . . 0.0 110.781 -178.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 109' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' D' 1099 ' ' TYR . 57.4 t80 -65.78 -45.74 81.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 119.753 1.161 . . . . 0.0 112.497 -178.538 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -55.55 -53.65 53.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.964 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.0 -57.17 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 124.902 1.281 . . . . 0.0 109.452 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 49.6 mt -57.08 -27.99 62.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.823 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.5 mmm -72.39 -52.16 17.25 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.35 -45.44 69.13 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.438 HD22 HG23 ' A' ' 22' ' ' ILE . 42.6 mt -67.03 -31.47 72.02 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -68.01 -56.55 8.51 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -52.89 -57.0 11.72 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 128.64 2.776 . . . . 0.0 110.319 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 11.6 t -54.47 -52.12 62.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.083 1.353 . . . . 0.0 111.6 -179.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.441 ' HB3' HD21 ' D' 1108 ' ' ASN . 4.3 mm? -66.99 -30.75 70.95 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.485 1.039 . . . . 0.0 111.161 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -65.8 -45.43 82.41 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 120.998 1.726 . . . . 0.0 108.347 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 30.1 mt -63.14 -49.86 72.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.13 0.972 . . . . 0.0 109.582 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 ttt -56.86 -35.49 68.95 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.654 0.782 . . . . 0.0 110.605 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -72.43 -33.03 66.8 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.383 1.073 . . . . 0.0 112.458 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.1 pp -93.15 -31.37 14.81 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 66.3 t -84.32 145.68 46.03 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 125.476 1.51 . . . . 0.0 108.392 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.74 -176.7 1.01 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.549 2.833 . . . . 0.0 111.959 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.78 34.76 0.21 Allowed Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.1 -44.87 21.85 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 122.857 2.056 . . . . 0.0 112.766 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.5 -26.17 67.04 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 13.9 t -72.23 -47.76 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -59.24 -51.7 68.84 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.785 1.234 . . . . 0.0 111.319 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 19.4 m -62.08 -49.15 77.09 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 122.358 -0.214 . . . . 0.0 110.822 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -63.09 -38.37 90.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.306 -0.246 . . . . 0.0 110.996 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -44.69 87.57 Favored 'General case' 0 C--N 1.337 0.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -66.18 -44.44 83.98 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.244 0.618 . . . . 0.0 109.996 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -59.66 -55.29 36.29 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.172 0.989 . . . . 0.0 111.233 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -37.49 84.8 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.279 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -58.21 -34.84 70.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.719 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.86 -25.33 68.23 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 120.314 1.415 . . . . 0.0 111.457 178.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.3 -25.29 51.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.461 1.028 . . . . 0.0 112.911 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -127.83 105.65 8.58 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 119.622 1.101 . . . . 0.0 109.267 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 126.161 1.784 . . . . 0.0 107.762 -179.882 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 97.9 p . . . . . 0 C--O 1.224 -0.244 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -73.07 0.17 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 121.247 1.839 . . . . 0.0 110.436 -178.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -76.59 40.25 0.23 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.483 1.513 . . . . 0.0 111.669 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.43 77.38 1.91 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 126.03 1.732 . . . . 0.0 107.986 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.73 109.32 0.9 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.14 151.36 34.5 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 105.709 -1.96 . . . . 0.0 105.709 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -117.83 101.28 8.18 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.36 0.982 . . . . 0.0 109.461 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 10.3 tp -75.52 112.04 17.22 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 117.154 -1.403 . . . . 0.0 109.845 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -88.84 117.46 0.88 Allowed 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 124.46 3.44 . . . . 0.0 111.514 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.8 t -145.75 149.24 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.129 0.877 . . . . 0.0 112.981 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -133.64 100.41 4.78 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 175.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.57 104.19 0.22 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 105.633 -2.987 . . . . 0.0 105.633 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 24.2 tpt180 -57.27 -51.43 69.41 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 121.122 2.461 . . . . 0.0 111.8 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.7 -41.5 87.92 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 118.593 0.633 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -62.53 -35.98 81.14 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.131 0.972 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 35.0 t80 -69.45 -50.45 45.47 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.825 -1.172 . . . . 0.0 109.298 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -56.33 -54.51 44.65 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.502 1.121 . . . . 0.0 110.297 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 45.9 mtp -63.45 -38.05 89.64 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.506 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.88 -46.15 86.18 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.106 1.321 . . . . 0.0 110.021 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.33 -48.21 76.42 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 123.924 0.89 . . . . 0.0 111.431 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -55.65 -49.09 73.82 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.612 0.765 . . . . 0.0 110.783 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 95.6 mt -66.54 -49.62 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -53.38 -44.43 68.61 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 124.132 0.973 . . . . 0.0 111.164 -179.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -62.65 -48.67 78.32 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.42 -179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 86.4 p -53.64 -46.85 70.66 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.822 1.192 . . . . 0.0 112.781 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.93 -58.08 5.14 Favored 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 123.331 0.652 . . . . 0.0 112.552 -179.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.94 -52.47 62.89 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.372 1.069 . . . . 0.0 111.398 -178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.9 -43.33 94.88 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.496 -0.752 . . . . 0.0 111.757 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 17.0 tmm? -62.95 -43.76 97.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 118.72 0.691 . . . . 0.0 110.956 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -67.51 -23.45 65.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.684 0.675 . . . . 0.0 111.02 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.93 -23.01 39.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.282 0.633 . . . . 0.0 110.407 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 24.5 tp -116.55 66.46 3.48 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 124.687 1.195 . . . . 0.0 110.609 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -68.22 142.43 55.42 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 121.249 1.3 . . . . 0.0 109.162 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.2 163.27 38.68 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.376 1.47 . . . . 0.0 107.903 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -72.19 -24.74 61.46 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.387 0.994 . . . . 0.0 111.345 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 57.0 m -61.63 -50.62 71.81 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 72.1 mt -59.79 -47.12 92.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 126.341 1.856 . . . . 0.0 108.726 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -54.51 -48.22 72.17 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.779 1.632 . . . . 0.0 111.033 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.0 m -66.3 -46.13 78.02 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.122 0.969 . . . . 0.0 108.87 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -42.72 81.11 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 124.011 0.925 . . . . 0.0 110.192 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -58.54 -46.76 86.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.51 -41.81 96.2 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.643 -1.17 . . . . 0.0 111.0 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.34 -49.46 72.16 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.951 1.25 . . . . 0.0 109.111 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -60.33 -47.25 86.82 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.072 0.949 . . . . 0.0 110.28 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -64.65 -29.73 70.73 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.73 0.812 . . . . 0.0 111.977 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -43.66 92.24 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.685 1.194 . . . . 0.0 110.764 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -55.93 -40.81 73.65 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.238 0.615 . . . . 0.0 111.653 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -59.94 -44.08 94.59 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.493 0.717 . . . . 0.0 109.27 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -70.59 -35.69 73.17 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.684 -0.635 . . . . 0.0 111.956 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 1.3 t60 -57.4 -33.25 67.65 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.127 1.371 . . . . 0.0 110.406 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 52.5 mt -55.96 -47.41 77.66 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 9.7 mp -79.39 16.18 1.08 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.034 1.334 . . . . 0.0 111.821 179.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 56.11 23.08 6.54 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.835 2.454 . . . . 0.0 113.813 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -66.66 153.06 44.12 Favored 'General case' 0 CA--C 1.519 -0.225 0 O-C-N 121.186 -0.947 . . . . 0.0 108.676 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 7.5 pm0 -55.48 108.62 0.45 Allowed 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 178.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 4.9 p -144.08 -40.62 0.28 Allowed 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 124.275 1.03 . . . . 0.0 110.991 -178.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 3.9 m 28.03 68.26 0.07 Allowed 'General case' 0 C--O 1.238 0.454 0 C-N-CA 129.651 3.18 . . . . 0.0 111.586 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 20.6 tt -114.98 131.73 66.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 125.67 1.588 . . . . 0.0 110.75 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.71 158.53 35.21 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 5.3 p . . . . . 0 C--O 1.257 1.487 0 C-N-CA 124.127 0.971 . . . . 0.0 109.492 179.312 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.455 0 N-CA-C 108.764 -1.734 . . . . 0.0 108.764 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 19.3 m -152.99 158.53 42.17 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -71.37 167.76 18.87 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.36 0.22 24.77 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -177.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 35.7 t0 -81.54 159.51 24.12 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.278 0.944 . . . . 0.0 113.317 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 29.0 m -82.56 149.13 27.65 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.862 1.265 . . . . 0.0 109.426 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1099 ' ' TYR . . . . . 0.426 ' HB3' ' CD2' ' B' ' 109' ' ' PHE . 43.8 m-85 -107.16 134.8 49.73 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.59 144.67 47.99 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 128.206 2.602 . . . . 0.0 112.437 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 62.2 mt -147.57 155.16 41.55 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.353 1.461 . . . . 0.0 110.145 178.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -152.16 108.84 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.565 1.546 . . . . 0.0 111.927 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 95.0 t -153.19 150.15 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-N 120.344 1.429 . . . . 0.0 109.757 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.54 102.92 12.82 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.2 113.68 0.79 Allowed Glycine 0 N--CA 1.454 -0.141 0 N-CA-C 106.65 -2.58 . . . . 0.0 106.65 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -64.92 -57.03 9.86 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 121.265 2.533 . . . . 0.0 110.538 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 19.8 mttp -63.18 -42.5 99.37 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.965 0.802 . . . . 0.0 108.98 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1108 ' ' ASN . . . . . 0.441 HD21 ' HB3' ' B' ' 119' ' ' LEU . 88.7 m-20 -60.03 -40.75 90.42 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.296 -178.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1109 ' ' PHE . . . . . 0.43 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 28.8 t80 -65.25 -43.7 90.51 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 120.372 1.442 . . . . 0.0 109.23 178.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -58.37 -53.75 54.82 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.113 0.87 . . . . 0.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.75 -57.91 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.197 1.399 . . . . 0.0 110.132 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 66.8 mt -59.47 -35.85 74.87 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 117.15 -1.405 . . . . 0.0 111.309 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -49.46 74.42 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 120.557 1.526 . . . . 0.0 108.602 178.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 51.8 mttm -53.57 -50.94 64.47 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.29 -33.01 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1116 ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' B' ' 101' ' ' LEU . 27.8 tptt -64.79 -57.96 7.52 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -52.28 -49.39 64.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.487 1.915 . . . . 0.0 108.319 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 28.7 t -52.96 -55.02 26.54 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.238 1.815 . . . . 0.0 114.281 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.56 -36.47 82.73 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.473 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -68.81 -38.1 79.68 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.738 1.154 . . . . 0.0 110.222 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 46.7 mt -65.33 -44.93 86.24 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.923 -0.486 . . . . 0.0 109.882 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttt -61.86 -38.32 87.8 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.244 1.018 . . . . 0.0 110.693 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.47 -44.08 79.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.749 -0.594 . . . . 0.0 110.643 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.3 pp -75.65 -31.78 59.95 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.42 147.37 34.28 Favored Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 120.105 1.32 . . . . 0.0 110.064 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -73.2 177.48 7.78 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.057 1.838 . . . . 0.0 108.95 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.61 47.12 0.28 Allowed Pre-proline 0 CA--C 1.556 1.178 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -178.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.45 -48.03 0.64 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.091 1.861 . . . . 0.0 112.981 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.92 -25.89 68.35 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 17.2 t -72.12 -48.15 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 126.22 1.808 . . . . 0.0 108.755 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.67 -41.41 81.48 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.505 0.722 . . . . 0.0 110.145 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 50.8 m -70.84 -50.23 37.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.352 1.061 . . . . 0.0 110.877 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.53 -35.59 78.16 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.323 0.965 . . . . 0.0 110.368 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.61 -47.16 86.68 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -60.84 -48.12 83.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.499 1.045 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -56.57 -57.86 10.56 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.312 1.045 . . . . 0.0 111.448 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -34.86 78.95 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.859 -0.526 . . . . 0.0 111.976 -178.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.87 -27.53 68.29 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.42 -38.75 85.05 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.92 3.16 7.14 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.581 1.952 . . . . 0.0 112.338 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -140.64 124.12 16.89 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 121.332 1.878 . . . . 0.0 112.776 -178.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 . . . . . 0 C--O 1.252 1.227 1 C-N-CA 132.323 4.249 . . . . 0.0 106.422 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.3 p . . . . . 0 N--CA 1.466 0.361 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -59.9 -63.43 1.3 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.859 1.264 . . . . 0.0 109.305 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.85 -49.82 19.22 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 76.36 168.11 0.26 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.903 2.081 . . . . 0.0 111.574 179.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 13.0 tp -73.16 94.7 1.98 Allowed 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mt -93.32 161.24 14.48 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.029 0.931 . . . . 0.0 110.761 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -134.16 118.61 17.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.627 1.571 . . . . 0.0 108.756 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 43.6 tp -108.96 100.2 38.87 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 123.796 0.838 . . . . 0.0 110.532 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.74 125.42 7.45 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.202 2.601 . . . . 0.0 111.16 178.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.2 t -145.15 146.18 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.788 1.635 . . . . 0.0 107.919 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -126.01 100.19 6.25 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.4 126.14 1.37 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -66.99 -52.68 39.75 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 120.781 2.291 . . . . 0.0 109.712 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.95 -33.72 75.2 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 122.4 0.28 . . . . 0.0 110.751 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -45.87 92.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -67.03 -40.05 87.11 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.089 0.404 . . . . 0.0 111.435 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -60.48 -57.36 13.07 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.588 0.755 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.4 ppp? -62.87 -38.94 92.88 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.822 -0.608 . . . . 0.0 110.591 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.38 -50.6 72.24 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mt -59.51 -47.31 86.03 Favored 'General case' 0 C--O 1.23 0.066 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.298 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -62.59 -47.37 84.11 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.489 1.04 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.5 mt -65.03 -41.03 90.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 123.707 0.803 . . . . 0.0 110.371 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -62.47 -60.07 4.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.569 1.148 . . . . 0.0 108.726 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.19 -47.14 84.35 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.192 0.932 . . . . 0.0 110.557 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.7 t -52.46 -51.61 58.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.287 0.949 . . . . 0.0 112.631 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.46 -47.67 69.44 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.462 0.574 . . . . 0.0 109.484 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -55.25 -49.44 72.03 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 118.203 0.456 . . . . 0.0 111.665 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.26 -46.23 67.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 117.541 -1.219 . . . . 0.0 110.112 -178.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -36.02 72.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 120.134 1.334 . . . . 0.0 110.596 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -69.64 -35.59 75.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.104 1.362 . . . . 0.0 110.678 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -83.72 -36.86 23.36 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.673 0.789 . . . . 0.0 113.016 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.62 149.85 96.81 Favored Pre-proline 0 CA--C 1.536 0.406 0 CA-C-N 119.228 0.922 . . . . 0.0 108.55 179.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -67.74 165.58 27.2 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.63 1.553 . . . . 0.0 109.404 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -82.01 4.72 21.72 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.941 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -48.68 -57.86 5.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.672 1.123 . . . . 0.0 113.219 -178.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.9 m -59.84 -38.24 81.51 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.751 0.705 . . . . 0.0 110.963 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.58 -42.45 96.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.95 0.9 . . . . 0.0 109.16 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -62.82 -50.08 72.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.557 0.743 . . . . 0.0 109.132 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.46 -37.52 83.87 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.265 0.555 . . . . 0.0 110.191 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -66.73 -54.08 26.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.318 1.047 . . . . 0.0 111.362 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -63.94 -33.23 75.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.845 1.202 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -61.32 -57.99 10.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.678 -1.231 . . . . 0.0 107.678 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -65.17 -30.71 71.64 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.205 0.911 . . . . 0.0 113.206 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -58.17 -46.72 85.24 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -76.11 -51.34 12.43 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 111.593 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -49.42 -37.32 25.12 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 116.698 -1.62 . . . . 0.0 113.649 -177.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -54.48 -47.79 72.57 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 121.486 1.948 . . . . 0.0 112.565 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -61.29 -39.04 88.98 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.833 0.742 . . . . 0.0 109.64 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -68.84 -34.43 75.48 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.704 0.802 . . . . 0.0 110.912 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -63.0 -41.58 99.62 Favored 'General case' 0 C--N 1.338 0.08 0 CA-C-N 119.417 1.008 . . . . 0.0 109.138 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.6 mp -60.59 -32.01 71.13 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.263 0.483 . . . . 0.0 109.98 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 69.7 mt -76.18 2.21 13.73 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 117.162 -1.399 . . . . 0.0 113.368 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 14.31 82.14 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 129.79 3.236 . . . . 0.0 114.268 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -80.0 48.49 0.98 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.279 -0.888 . . . . 0.0 110.806 179.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 41.35 54.56 3.51 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.357 2.263 . . . . 0.0 111.091 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.22 47.87 0.39 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.067 1.347 . . . . 0.0 111.708 -179.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.3 95.92 1.75 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.3 tt -160.21 156.44 3.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 127.186 2.194 . . . . 0.0 105.791 179.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -146.32 158.5 43.89 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.1 p . . . . . 0 C--O 1.257 1.46 0 C-N-CA 128.584 2.754 . . . . 0.0 103.622 179.368 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.462 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 20.0 m -94.86 -166.19 1.43 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.938 2.095 . . . . 0.0 109.011 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -67.15 167.22 12.48 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -55.91 -28.44 56.74 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.542 1.537 . . . . 0.0 111.449 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 44.55 77.09 0.08 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 126.709 2.004 . . . . 0.0 111.207 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.9 142.05 26.09 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.051 0.453 . . . . 0.0 110.491 179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -122.65 148.75 44.91 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.094 0.957 . . . . 0.0 109.425 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -134.3 160.18 38.69 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 124.603 1.161 . . . . 0.0 109.292 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 79.1 mt -144.3 161.19 39.57 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -150.57 110.11 4.02 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.287 1.835 . . . . 0.0 106.954 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 1.9 m -155.89 151.32 9.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.115 0.966 . . . . 0.0 111.473 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.443 ' HB3' ' HA ' ' D' 1098 ' ' THR . 3.7 ptt180 -117.6 100.62 7.75 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 119.744 1.156 . . . . 0.0 111.682 178.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.4 119.65 1.25 Allowed Glycine 0 CA--C 1.521 0.427 0 CA-C-O 116.429 -2.317 . . . . 0.0 109.058 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -61.55 -56.89 15.09 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 121.451 2.626 . . . . 0.0 109.298 178.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -58.59 -47.13 85.33 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.23 0.612 . . . . 0.0 109.652 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -58.89 -44.71 91.22 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 112.525 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -64.13 -44.92 90.72 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 120.645 1.566 . . . . 0.0 110.596 -178.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -56.37 -54.16 48.78 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 122.016 0.912 . . . . 0.0 111.694 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.519 HG21 HD11 ' C' 1022 ' ' ILE . 57.6 mt -69.1 -49.18 64.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -177.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 76.7 mt -61.44 -38.17 86.2 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 119.75 1.159 . . . . 0.0 110.657 -179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 69.4 mtp -61.42 -52.89 62.71 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.316 0.962 . . . . 0.0 110.032 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -63.34 -40.73 98.11 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.379 -178.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.84 -36.45 78.17 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.547 1.067 . . . . 0.0 111.207 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 7.2 tptp -70.66 -47.34 60.45 Favored 'General case' 0 N--CA 1.462 0.152 0 O-C-N 120.343 -1.473 . . . . 0.0 108.484 178.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -58.16 -51.59 69.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.411 1.485 . . . . 0.0 110.233 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.3 m -61.0 -39.94 91.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.509 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -41.96 89.92 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 119.128 0.876 . . . . 0.0 109.122 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.16 -36.72 84.97 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.48 0.582 . . . . 0.0 111.149 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -68.17 -47.97 66.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 33.1 ttp -65.9 -27.97 68.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 118.728 0.695 . . . . 0.0 109.993 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -68.63 -39.57 80.69 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.061 -0.971 . . . . 0.0 109.191 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.9 -24.23 44.3 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.993 1.27 . . . . 0.0 111.55 179.072 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.54 145.05 66.64 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.21 -84.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.841 0 N-CA-C 108.377 -1.432 . . . . 0.0 108.377 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -167.65 63.04 0.63 Allowed Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 125.013 1.325 . . . . 0.0 110.14 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -70.93 -106.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 124.049 3.166 . . . . 0.0 112.178 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.41 -25.6 66.06 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 120.906 -1.122 . . . . 0.0 109.168 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 t -54.98 -45.15 76.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.509 1.124 . . . . 0.0 108.559 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -74.9 -44.17 50.3 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.861 0.865 . . . . 0.0 110.998 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 22.9 t -61.96 -51.55 67.63 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.288 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.6 -39.5 93.83 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.072 0.949 . . . . 0.0 110.488 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -55.83 -46.98 77.99 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-N 118.999 0.818 . . . . 0.0 109.152 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -65.36 -51.89 57.44 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.89 -47.69 70.84 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.148 0.979 . . . . 0.0 112.996 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.98 -34.5 75.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.576 1.08 . . . . 0.0 109.053 179.333 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -28.05 69.2 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.039 -1.038 . . . . 0.0 109.536 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 58.9 mt -63.45 -15.65 58.34 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.087 0.858 . . . . 0.0 112.235 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.8 tt -77.1 -21.46 54.27 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.917 1.287 . . . . 0.0 110.302 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -96.07 172.63 7.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.994 1.318 . . . . 0.0 111.804 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 . . . . . 0 C--O 1.244 0.795 0 C-N-CA 127.511 2.324 . . . . 0.0 107.73 -179.296 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 81.2 p . . . . . 0 N--CA 1.463 0.221 0 CA-C-O 118.864 -0.588 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 38.8 t0 -69.39 -75.65 0.11 Allowed 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 125.685 1.594 . . . . 0.0 111.279 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.86 -44.3 77.44 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 125.251 1.42 . . . . 0.0 109.672 -176.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 7.3 tp10 76.17 167.78 0.26 Allowed 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 127.374 2.27 . . . . 0.0 112.673 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.5 tp -72.86 95.91 2.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.881 1.672 . . . . 0.0 106.787 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 46.3 mt -100.31 168.81 9.54 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -140.23 147.23 39.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.878 1.271 . . . . 0.0 108.743 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 33.3 tp -124.02 94.5 45.48 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.037 1.335 . . . . 0.0 108.02 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.56 121.48 5.59 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.764 2.309 . . . . 0.0 109.505 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.9 t -144.94 159.92 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.298 1.039 . . . . 0.0 109.674 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 12.7 ptt-85 -136.52 102.9 5.08 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.988 1.267 . . . . 0.0 109.186 176.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.97 139.01 5.5 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 117.613 -1.66 . . . . 0.0 110.274 178.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -71.03 -52.09 21.55 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.618 2.209 . . . . 0.0 106.901 177.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.3 -46.5 67.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.669 1.188 . . . . 0.0 107.817 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -56.41 -44.93 80.83 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.217 0.462 . . . . 0.0 111.308 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.2 t80 -65.29 -51.57 59.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.765 0.712 . . . . 0.0 111.0 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -54.97 -57.11 12.99 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.477 1.111 . . . . 0.0 111.414 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ppp? -61.02 -46.78 89.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.513 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 33.9 mt -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 117.747 -1.121 . . . . 0.0 110.427 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.63 -53.14 61.11 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 120.048 1.295 . . . . 0.0 110.632 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -55.58 -48.62 74.52 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1022 ' ' ILE . . . . . 0.519 HD11 HG21 ' B' ' 111' ' ' ILE . 84.5 mt -67.69 -43.07 86.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 122.996 0.518 . . . . 0.0 112.264 -178.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -66.57 -48.92 68.08 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 118.159 -0.924 . . . . 0.0 109.817 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.83 -44.86 91.96 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.238 -0.887 . . . . 0.0 108.611 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 16.2 t -56.97 -38.09 72.52 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.661 1.119 . . . . 0.0 111.737 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.5 tm? -71.09 -57.75 4.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.195 0.598 . . . . 0.0 110.743 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -56.35 -48.04 77.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.875 0.47 . . . . 0.0 110.119 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.14 -47.04 86.75 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 118.279 -0.867 . . . . 0.0 109.523 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.3 68.66 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.372 0.987 . . . . 0.0 110.907 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -71.58 -34.59 70.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.663 0.785 . . . . 0.0 111.734 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -77.84 -27.51 49.91 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.887 1.221 . . . . 0.0 110.637 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.2 mp -73.54 157.33 87.88 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.946 0.898 . . . . 0.0 109.357 178.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -77.49 161.77 31.1 Favored 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 121.873 1.715 . . . . 0.0 110.074 178.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -75.54 -2.78 30.61 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 117.671 -1.157 . . . . 0.0 113.833 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -48.31 -58.47 4.54 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 120.18 1.355 . . . . 0.0 112.985 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 23.8 m -65.49 -34.1 77.47 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.981 -1.074 . . . . 0.0 111.123 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.91 -44.94 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.268 1.427 . . . . 0.0 109.921 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.77 -56.75 13.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.584 1.153 . . . . 0.0 108.759 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 83.0 m -59.24 -36.43 75.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.339 -0.838 . . . . 0.0 110.67 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 32.0 t80 -61.09 -53.89 51.46 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.293 0.951 . . . . 0.0 109.158 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -41.67 94.47 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.975 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.58 -46.58 89.69 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.061 0.846 . . . . 0.0 110.708 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -66.41 -40.23 89.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.957 0.799 . . . . 0.0 110.625 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -57.74 -52.62 64.72 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.701 1.2 . . . . 0.0 108.822 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -64.15 -43.86 93.92 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.069 0.948 . . . . 0.0 111.017 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -57.95 -35.99 71.91 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 117.078 -1.439 . . . . 0.0 113.108 -179.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -54.99 -43.73 73.85 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 121.028 1.74 . . . . 0.0 111.423 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 8.6 m80 -62.62 -37.5 86.55 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 122.082 -0.386 . . . . 0.0 110.237 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 93.0 mm-40 -71.31 -40.87 70.52 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.339 -0.85 . . . . 0.0 111.199 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 62.9 m170 -53.83 -41.01 66.92 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 124.989 1.316 . . . . 0.0 112.292 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 7.6 mp -56.75 -25.83 55.85 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.229 0.922 . . . . 0.0 112.654 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 11.3 mp -90.1 -1.12 57.9 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.725 1.21 . . . . 0.0 112.883 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 23.82 73.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 128.972 2.909 . . . . 0.0 113.476 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -71.39 64.75 0.41 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.655 1.582 . . . . 0.0 110.518 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 55.8 tt0 25.22 58.89 0.05 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 129.112 2.965 . . . . 0.0 111.522 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 9.1 m -83.2 55.72 3.24 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 1.2 t -165.24 100.43 0.73 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 16.6 tt -166.78 156.47 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 127.789 2.436 . . . . 0.0 105.742 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -146.48 158.42 43.89 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 20.0 p . . . . . 0 C--O 1.255 1.368 0 C-N-CA 128.783 2.833 . . . . 0.0 103.518 179.277 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.921 0 N-CA-C 110.927 -0.869 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 15.9 m -103.31 -156.17 0.55 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.103 1.361 . . . . 0.0 108.024 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -68.7 175.39 3.57 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.64 1.176 . . . . 0.0 110.439 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -30.01 69.42 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.673 1.189 . . . . 0.0 108.095 177.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 26.2 t70 36.43 78.32 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 130.851 3.66 . . . . 0.0 113.726 178.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1098 ' ' THR . . . . . 0.443 ' HA ' ' HB3' ' B' ' 104' ' ' ARG . 40.6 m -157.62 136.8 11.77 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.498 1.919 . . . . 0.0 106.368 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -115.69 158.27 23.03 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -138.13 161.26 37.26 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.973 0.909 . . . . 0.0 108.961 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 69.3 mt -139.08 153.36 48.03 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -146.94 99.49 3.19 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 127.861 2.465 . . . . 0.0 105.798 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.49 151.09 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 124.467 1.107 . . . . 0.0 111.146 -178.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.49 102.06 8.01 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 122.212 1.006 . . . . 0.0 110.266 178.044 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.63 110.02 0.57 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.848 -2.501 . . . . 0.0 106.848 178.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 -55.53 -57.46 11.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 121.358 2.579 . . . . 0.0 112.43 -179.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 98.7 mttt -66.37 -39.51 89.16 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.001 -0.437 . . . . 0.0 110.026 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -56.5 -50.71 71.0 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.976 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.08 -43.88 97.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.15 0.886 . . . . 0.0 111.464 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.33 -51.62 69.01 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.551 0.614 . . . . 0.0 110.823 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 83.9 mt -66.9 -54.53 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.58 1.152 . . . . 0.0 110.742 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.34 -32.66 68.73 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.189 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 31.4 mtp -66.3 -52.08 50.92 Favored 'General case' 0 C--N 1.345 0.383 0 CA-C-N 119.764 1.166 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -60.69 -41.56 95.4 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 119.303 -0.959 . . . . 0.0 110.712 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.07 -60.79 2.64 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.659 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 15.7 tptp -53.88 -45.11 70.94 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.298 0.954 . . . . 0.0 112.724 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.05 -49.75 74.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.661 0.6 . . . . 0.0 109.481 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.9 m -61.71 -34.84 76.5 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.85 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -66.07 -42.07 89.91 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.928 1.291 . . . . 0.0 108.508 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.32 -44.01 89.19 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.83 -38.02 89.09 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.424 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttp -77.26 -20.05 55.69 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 120.548 1.522 . . . . 0.0 109.957 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -81.89 -26.07 34.45 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.077 -1.014 . . . . 0.0 111.079 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -92.08 -33.55 14.74 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.316 -0.865 . . . . 0.0 110.441 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 80.5 t -85.32 147.14 46.47 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.93 -88.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.018 3.145 . . . . 0.0 114.818 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -170.64 58.64 0.29 Allowed Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.341 1.456 . . . . 0.0 110.864 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.3 -90.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.421 2.747 . . . . 0.0 113.39 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.6 -25.1 67.24 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.7 t -54.61 -56.4 10.54 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.675 1.19 . . . . 0.0 108.937 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 13.2 t0 -69.4 -44.64 71.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.683 0.674 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 7.6 t -55.82 -50.44 70.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.118 0.567 . . . . 0.0 111.621 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 17.9 t80 -69.08 -43.75 73.92 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -45.58 69.51 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 119.411 1.005 . . . . 0.0 110.56 179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -64.76 -53.12 52.15 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 119.623 1.101 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.5 -40.89 75.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.44 1.496 . . . . 0.0 111.39 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.04 -32.29 39.5 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.341 1.856 . . . . 0.0 110.251 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -57.08 -39.25 74.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 58.0 mt -53.62 -21.44 6.74 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.58 -10.46 59.57 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.489 1.116 . . . . 0.0 111.99 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' D' D 1141 ' ' GLN . . . . . 0.425 ' CD ' ' H ' ' D' 1142 ' ' ARG . 0.0 OUTLIER -102.15 172.84 6.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.564 1.146 . . . . 0.0 111.045 -179.632 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' D' D 1142 ' ' ARG . . . . . 0.425 ' H ' ' CD ' ' D' 1141 ' ' GLN . 10.0 ptt180 . . . . . 0 C--O 1.248 1.005 0 C-N-CA 127.921 2.488 . . . . 0.0 106.787 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -79.64 -3.41 47.04 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.323 -0.86 . . . . 0.0 109.55 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -103.51 -0.76 29.4 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.121 2.168 . . . . 0.0 113.762 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -112.14 122.4 47.63 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.94 127.29 32.12 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 43.0 mt -120.47 173.91 6.87 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.297 1.439 . . . . 0.0 109.634 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -139.84 149.82 43.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -116.12 96.55 47.57 Favored Pre-proline 0 CA--C 1.536 0.439 0 C-N-CA 124.772 1.229 . . . . 0.0 108.653 -179.437 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.71 110.97 1.69 Allowed 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.3 3.333 . . . . 0.0 112.9 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.9 t -144.84 158.77 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.849 1.204 . . . . 0.0 110.46 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 50.0 ttt-85 -135.05 103.44 5.56 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.062 1.345 . . . . 0.0 108.651 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.22 132.6 2.65 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 108.181 -1.968 . . . . 0.0 108.181 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt85 -70.63 -51.35 28.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 121.132 2.466 . . . . 0.0 109.885 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.09 -36.3 77.43 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 m -63.29 -52.22 62.86 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.218 -0.896 . . . . 0.0 109.787 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -58.17 -47.79 82.3 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 119.719 1.145 . . . . 0.0 110.337 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -54.15 -57.19 12.07 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.803 0.69 . . . . 0.0 112.319 -179.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -66.95 -43.8 82.22 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.076 0.55 . . . . 0.0 111.929 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.2 tp -55.83 -49.21 73.89 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.785 0.834 . . . . 0.0 110.016 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 tt -70.48 -47.87 58.5 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.032 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -55.35 -44.84 76.33 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.887 1.221 . . . . 0.0 113.657 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -75.4 -32.17 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -68.29 -41.88 80.32 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.462 -1.399 . . . . 0.0 109.252 178.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.34 -55.5 17.88 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 125.653 1.581 . . . . 0.0 110.791 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 p -54.16 -43.41 70.59 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.626 0.648 . . . . 0.0 110.594 179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.01 -56.49 8.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.808 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -53.71 -43.39 68.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.406 1.003 . . . . 0.0 111.743 -178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.9 -53.68 19.79 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.165 -0.922 . . . . 0.0 108.842 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -54.93 -49.08 72.19 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.122 1.328 . . . . 0.0 110.835 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -64.03 -27.18 68.94 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.047 0.84 . . . . 0.0 110.995 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -77.39 -49.26 15.26 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.516 1.053 . . . . 0.0 110.687 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.494 HD22 HD22 ' B' ' 129' ' ' LEU . 0.5 OUTLIER -118.67 67.14 7.43 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 125.084 1.353 . . . . 0.0 113.027 -179.02 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -79.47 60.92 8.01 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 123.342 2.694 . . . . 0.0 108.459 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -142.46 -68.41 0.36 Allowed 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 t60 -48.63 -57.78 5.73 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.561 1.145 . . . . 0.0 112.992 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.74 -49.12 78.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.331 1.452 . . . . 0.0 111.813 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.6 mm -60.68 -43.51 95.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 124.924 1.289 . . . . 0.0 109.699 -178.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.62 -53.16 61.44 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 125.524 1.53 . . . . 0.0 108.407 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.6 m -63.3 -34.67 78.2 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.085 -0.96 . . . . 0.0 110.96 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -61.53 -49.16 77.81 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 120.618 1.554 . . . . 0.0 107.942 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.61 -45.86 92.28 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.238 1.015 . . . . 0.0 109.093 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -60.34 -44.8 95.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.543 1.537 . . . . 0.0 111.93 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.24 -45.89 91.29 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.076 1.351 . . . . 0.0 110.528 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -60.05 -50.95 71.7 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.05 -0.66 . . . . 0.0 110.635 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.52 -35.27 80.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 118.505 -0.759 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -52.03 -40.05 60.49 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-N 119.293 0.951 . . . . 0.0 111.022 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -52.81 -47.04 67.92 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.425 0.557 . . . . 0.0 109.88 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -75.11 -37.01 61.61 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 178.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -58.68 -36.61 74.45 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.339 -0.838 . . . . 0.0 111.247 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -61.04 -34.67 75.22 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.084 0.857 . . . . 0.0 110.598 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.8 tp -68.18 -29.59 68.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.134 0.574 . . . . 0.0 110.301 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.74 16.54 25.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.542 1.937 . . . . 0.0 110.881 179.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -59.84 149.21 32.0 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.118 -0.989 . . . . 0.0 110.954 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -131.01 176.38 8.3 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.719 1.208 . . . . 0.0 109.375 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -74.74 -173.23 1.78 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.479 1.112 . . . . 0.0 108.091 178.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.5 t -66.11 174.36 2.59 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 122.486 1.136 . . . . 0.0 111.528 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.1 t -93.27 -165.49 1.34 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.71 2.404 . . . . 0.0 107.204 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 tt -79.03 14.67 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.059 0 C-N-CA 124.538 1.135 . . . . 0.0 109.926 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 -102.49 119.9 39.61 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 127.034 2.133 . . . . 0.0 106.837 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.0 p . . . . . 0 C--O 1.258 1.509 0 CA-C-O 114.461 -2.685 . . . . 0.0 107.228 178.613 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.945 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 32.0 m -61.79 -33.82 74.8 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 117.767 0.784 . . . . 0.0 111.478 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 49.91 56.32 8.07 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.126 1.77 . . . . 0.0 111.634 178.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -67.34 -26.61 66.58 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -178.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.17 145.78 47.84 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.9 161.85 36.95 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -113.16 131.08 55.99 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -107.22 159.74 16.12 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.016 0.926 . . . . 0.0 112.574 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 mp -143.65 156.17 44.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 126.004 1.722 . . . . 0.0 106.97 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 100.85 2.86 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.452 1.901 . . . . 0.0 106.574 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.584 HG21 ' HD2' ' D' 1116 ' ' LYS . 3.6 m -149.22 151.55 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -178.106 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt85 -118.52 101.7 8.34 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 122.68 1.228 . . . . 0.0 109.066 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.13 106.59 0.42 Allowed Glycine 0 N--CA 1.451 -0.366 1 N-CA-C 102.924 -4.07 . . . . 0.0 102.924 176.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -60.26 -56.69 18.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.099 2.949 . . . . 0.0 111.353 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -62.93 -39.9 95.98 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -61.99 -52.38 64.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.019 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.5 -51.39 59.73 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 120.206 1.366 . . . . 0.0 111.819 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -58.36 -53.49 57.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.671 0.668 . . . . 0.0 111.03 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.2 mt -61.3 -54.11 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 O-C-N 121.438 -0.789 . . . . 0.0 110.731 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 82.8 mt -54.97 -41.7 71.49 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.384 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 14.2 mtp -57.2 -51.26 70.05 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 120.928 1.695 . . . . 0.0 108.848 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.33 -52.33 66.1 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 122.611 0.365 . . . . 0.0 110.291 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 43.2 mt -58.6 -42.89 89.17 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 122.775 0.43 . . . . 0.0 111.12 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' LYS . . . . . 0.538 ' HD2' HG11 ' D' 1103 ' ' VAL . 25.5 ttpt -62.5 -57.43 11.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.6 1.16 . . . . 0.0 110.889 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -60.45 -41.17 93.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 118.649 0.658 . . . . 0.0 110.016 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 2.9 t -61.02 -42.24 98.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.986 -0.446 . . . . 0.0 109.874 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.26 -35.92 71.57 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 117.351 -1.309 . . . . 0.0 109.92 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -63.52 -40.01 95.91 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.252 1.387 . . . . 0.0 108.931 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 36.3 mt -66.89 -53.35 33.07 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 5.7 tpt -56.89 -34.66 68.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.041 0.936 . . . . 0.0 110.355 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.43 -41.73 84.32 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.485 1.514 . . . . 0.0 110.857 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.45 -33.03 64.68 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.529 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 20.3 m -86.79 148.7 46.52 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-N 119.521 1.055 . . . . 0.0 111.831 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -75.94 -106.1 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.05 2.5 . . . . 0.0 106.875 178.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.73 74.44 7.12 Favored Pre-proline 0 CA--C 1.542 0.638 0 O-C-N 119.71 -1.869 . . . . 0.0 111.431 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -81.12 -100.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 124.725 3.617 . . . . 0.0 111.539 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 129' ' ' LEU . . . . . 0.494 HD22 HD22 ' A' ' 32' ' ' LEU . 9.7 tt -56.11 -34.71 66.3 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 120.724 -1.235 . . . . 0.0 109.499 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 73.5 t -51.83 -54.44 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 126.114 1.765 . . . . 0.0 109.698 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.09 -49.52 77.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.036 0.934 . . . . 0.0 110.007 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 25.9 t -56.03 -50.54 70.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.363 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -67.01 -35.01 78.97 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.541 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -58.08 -48.53 79.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.643 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.75 -42.6 70.27 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.078 0.854 . . . . 0.0 111.763 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -57.17 -45.42 83.69 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 118.64 0.655 . . . . 0.0 111.233 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -77.32 -31.72 54.8 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.092 0.957 . . . . 0.0 110.773 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -57.72 -37.78 74.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 119.792 1.178 . . . . 0.0 109.188 178.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.8 -18.21 53.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.737 0.815 . . . . 0.0 112.237 179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 19.9 tp -78.0 -19.21 54.87 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.461 1.104 . . . . 0.0 111.141 179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.88 173.55 7.71 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 121.036 -1.04 . . . . 0.0 109.84 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.176 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 98.3 p . . . . . 0 N--CA 1.47 0.572 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -96.6 -4.01 41.9 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.722 1.209 . . . . 0.0 108.54 177.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 25.9 t0 -109.02 -22.21 12.26 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.347 1.459 . . . . 0.0 113.103 -178.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -85.02 138.43 32.45 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.307 0.958 . . . . 0.0 109.004 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 26.9 tp -78.22 108.29 11.43 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.99 165.04 11.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.288 0.949 . . . . 0.0 111.456 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -142.58 156.67 45.12 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.455 1.502 . . . . 0.0 108.17 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -135.0 105.79 10.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.393 -179.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -79.58 116.5 3.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.437 2.758 . . . . 0.0 110.941 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.8 t -145.03 147.13 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.593 1.088 . . . . 0.0 111.039 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -133.97 101.61 5.12 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.5 126.97 1.49 Allowed Glycine 0 CA--C 1.519 0.315 0 N-CA-C 105.447 -3.061 . . . . 0.0 105.447 177.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -65.68 -51.57 58.4 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 121.54 2.67 . . . . 0.0 108.791 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.22 -42.82 83.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.338 0.655 . . . . 0.0 109.758 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 8.0 m -55.78 -47.71 76.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.213 1.405 . . . . 0.0 108.785 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.0 t80 -69.32 -50.48 46.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.515 1.126 . . . . 0.0 111.068 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.68 -51.0 66.88 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.952 1.301 . . . . 0.0 112.761 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.4 ttm -65.6 -51.3 60.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.804 0.442 . . . . 0.0 110.147 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -41.54 95.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.253 -178.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.79 -38.25 79.84 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.502 1.501 . . . . 0.0 108.85 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -59.38 -42.14 90.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.164 0.893 . . . . 0.0 108.735 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1022 ' ' ILE . . . . . 0.478 HG23 HD22 ' D' 1115 ' ' LEU . 94.1 mt -72.66 -38.28 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.797 0.839 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -61.45 -54.43 43.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 O-C-N 121.071 -1.018 . . . . 0.0 109.492 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -53.08 60.86 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.132 1.373 . . . . 0.0 111.058 -178.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 35.7 p -55.24 -51.56 66.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.99 -41.58 82.06 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 118.774 -0.632 . . . . 0.0 112.439 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.33 -44.93 95.36 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.59 -48.86 65.62 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.665 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 7.7 tmm? -55.36 -44.64 76.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.587 0.63 . . . . 0.0 109.977 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -79.9 -19.9 47.1 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 118.122 -0.942 . . . . 0.0 113.43 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 72.1 t80 -86.3 -27.73 24.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.437 1.017 . . . . 0.0 110.169 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 25.3 tp -135.62 61.26 42.03 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 125.548 1.539 . . . . 0.0 110.177 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.69 58.03 6.25 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.476 2.784 . . . . 0.0 107.707 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.36 -71.64 0.47 Allowed 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 127.984 2.514 . . . . 0.0 107.431 -178.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 71.2 t60 -52.7 -57.73 9.14 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.711 1.204 . . . . 0.0 113.884 -178.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -45.19 83.73 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.113 -0.992 . . . . 0.0 111.686 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 9.4 mm -64.13 -34.45 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 124.908 1.283 . . . . 0.0 110.037 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -69.77 -56.69 6.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 14.0 m -54.01 -40.87 67.38 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.571 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 3.7 t80 -60.25 -54.41 46.11 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.69 1.586 . . . . 0.0 109.819 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -34.72 78.03 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.518 0.727 . . . . 0.0 111.908 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -72.29 -46.64 54.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.811 1.244 . . . . 0.0 109.841 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -60.01 -42.12 93.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.336 1.054 . . . . 0.0 110.937 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -67.31 -47.59 70.12 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.136 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -57.74 -40.83 80.6 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.124 0.57 . . . . 0.0 110.493 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -54.49 -32.58 58.21 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.036 0.934 . . . . 0.0 111.623 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -56.34 -53.36 58.25 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.291 0.951 . . . . 0.0 110.009 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 9.2 m170 -72.63 -26.6 61.73 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 119.079 -0.486 . . . . 0.0 109.871 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -65.92 -36.41 83.3 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.988 0.813 . . . . 0.0 109.987 179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 32.6 m170 -59.11 -32.64 70.01 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 119.044 0.838 . . . . 0.0 111.215 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 46.2 tp -67.66 -28.04 67.37 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.753 0.706 . . . . 0.0 109.935 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.25 16.09 27.19 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.478 2.311 . . . . 0.0 110.743 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -55.61 99.29 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.648 1.179 . . . . 0.0 112.952 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -80.33 171.6 14.85 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -76.26 -172.37 2.06 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 177.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 6.8 t -64.79 173.97 2.04 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 122.393 1.092 . . . . 0.0 112.136 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 22.9 t -93.95 -166.39 1.49 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.712 2.405 . . . . 0.0 107.582 179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 16.6 tt -77.4 4.31 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 C-N-CA 124.451 1.101 . . . . 0.0 110.362 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 15.3 mp0 -90.35 123.46 34.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.234 1.813 . . . . 0.0 107.62 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 24.2 p . . . . . 0 C--O 1.255 1.373 0 CA-C-O 114.68 -2.581 . . . . 0.0 107.126 178.518 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.538 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 20.1 m -128.37 -42.34 1.5 Allowed 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 123.508 0.723 . . . . 0.0 111.363 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 41.0 m-20 49.91 60.0 4.12 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.685 1.594 . . . . 0.0 108.107 -179.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -64.01 -27.66 69.27 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 113.29 -1.777 . . . . 0.0 108.668 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -68.85 116.99 9.96 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 125.261 1.424 . . . . 0.0 107.41 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.89 163.61 16.29 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.977 0.911 . . . . 0.0 110.914 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -101.58 128.45 47.83 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.903 -2.629 . . . . 0.0 103.903 178.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -103.59 145.04 30.63 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.984 1.314 . . . . 0.0 108.874 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.6 mp -140.1 151.39 45.31 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -139.95 111.1 6.99 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.712 1.605 . . . . 0.0 108.861 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1103 ' ' VAL . . . . . 0.538 HG11 ' HD2' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -155.82 150.86 10.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 124.485 1.114 . . . . 0.0 111.805 179.394 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -124.53 99.73 6.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 122.093 0.949 . . . . 0.0 108.501 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.43 119.76 1.4 Allowed Glycine 0 CA--C 1.509 -0.318 0 N-CA-C 105.932 -2.867 . . . . 0.0 105.932 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -63.52 -56.91 12.29 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 121.533 2.666 . . . . 0.0 108.426 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -69.36 -38.29 78.0 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.155 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.63 -52.57 65.1 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.709 -178.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.39 -41.86 98.97 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.149 -0.969 . . . . 0.0 111.832 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -60.66 -53.94 51.33 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.507 0.723 . . . . 0.0 111.555 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 55.1 mt -70.32 -45.92 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 118.459 -0.782 . . . . 0.0 109.679 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.66 -44.71 81.62 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 119.576 1.08 . . . . 0.0 110.363 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 27.1 mtp -60.53 -45.98 91.83 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.008 1.276 . . . . 0.0 109.736 178.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -56.63 -49.63 74.41 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1115 ' ' LEU . . . . . 0.478 HD22 HG23 ' C' 1022 ' ' ILE . 34.1 mt -60.17 -48.46 81.63 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.58 0.752 . . . . 0.0 111.243 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D 1116 ' ' LYS . . . . . 0.584 ' HD2' HG21 ' B' ' 103' ' ' VAL . 24.3 ttpt -54.62 -59.62 4.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 110.653 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.54 -47.97 75.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.008 0.923 . . . . 0.0 110.07 -179.296 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 34.4 t -53.35 -53.22 54.21 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.005 0.922 . . . . 0.0 111.119 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.82 -30.94 66.02 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 117.614 -1.184 . . . . 0.0 111.89 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -62.41 -41.65 98.84 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.969 1.713 . . . . 0.0 108.384 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 35.8 mt -67.95 -47.04 69.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.6 tpt -57.01 -35.84 69.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.377 0.671 . . . . 0.0 111.639 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.23 -43.08 74.77 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.872 1.669 . . . . 0.0 110.438 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.33 -25.32 60.58 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 33.5 m -92.65 148.85 36.97 Favored Pre-proline 0 CA--C 1.537 0.474 0 CA-C-N 119.226 0.921 . . . . 0.0 108.992 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -74.13 -105.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.059 2.506 . . . . 0.0 108.041 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -151.07 66.04 7.05 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 120.239 -1.538 . . . . 0.0 106.946 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.22 -103.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.427 2.751 . . . . 0.0 113.064 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.3 tt -62.52 -25.73 68.18 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.96 -1.088 . . . . 0.0 109.438 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 45.8 t -53.86 -56.96 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 C-N-CA 125.69 1.596 . . . . 0.0 109.192 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.22 -39.12 86.23 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.08 0.237 . . . . 0.0 111.08 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 1.9 t -60.12 -50.9 71.87 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.609 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.23 -33.09 74.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.097 0.959 . . . . 0.0 109.345 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -48.5 80.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 117.089 -1.434 . . . . 0.0 110.009 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -72.13 -46.42 56.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 120.052 1.296 . . . . 0.0 110.918 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -46.54 64.72 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.497 0.719 . . . . 0.0 110.324 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . 0.295 1.7 tp60 -81.08 -26.03 36.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -59.46 -36.2 75.51 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 120.403 1.456 . . . . 0.0 107.183 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 31.0 mt -61.97 -18.08 59.17 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.103 0.961 . . . . 0.0 112.243 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 8.3 tp -68.09 -25.89 65.55 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.239 1.415 . . . . 0.0 111.635 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.38 172.6 9.01 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.721 1.608 . . . . 0.0 110.532 -179.136 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.331 0 CA-C-O 118.216 -0.897 . . . . 0.0 109.221 -179.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.467 0.39 0 CA-C-O 120.893 0.378 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.0 -38.73 89.22 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 129.083 2.953 . . . . 0.0 111.061 -178.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -93.09 1.11 57.36 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.813 1.645 . . . . 0.0 112.863 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -81.47 146.64 30.12 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.871 1.268 . . . . 0.0 111.233 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -84.74 121.52 27.8 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 45.2 mt -108.15 161.94 14.52 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -140.5 104.89 4.85 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tp -87.87 110.22 33.42 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.362 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -87.04 123.26 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.424 3.416 . . . . 0.0 112.045 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 t -146.1 154.81 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 O-C-N 120.546 -1.346 . . . . 0.0 107.682 178.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 -135.08 100.67 4.63 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 134.72 3.37 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 106.674 -2.571 . . . . 0.0 106.674 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -69.87 -52.76 22.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 121.397 2.599 . . . . 0.0 110.595 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -66.43 -42.94 86.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.598 0.759 . . . . 0.0 110.004 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 62.8 m -65.32 -34.04 77.39 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.213 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -73.07 -48.35 36.67 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.96 1.709 . . . . 0.0 108.774 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -53.43 -56.08 19.78 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 123.936 0.894 . . . . 0.0 110.553 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 20.9 ptm -60.85 -42.68 98.28 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.127 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.07 -47.01 81.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 119.989 1.268 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -55.84 19.81 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.538 0.608 . . . . 0.0 110.278 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.68 -47.7 79.27 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 125.614 1.566 . . . . 0.0 112.828 -178.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.42 -36.18 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.333 0.653 . . . . 0.0 109.89 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.7 -48.89 65.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.17 -1.581 . . . . 0.0 108.197 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -55.22 -52.03 64.68 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.426 1.49 . . . . 0.0 110.327 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.2 p -56.72 -41.53 77.63 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.7 0.682 . . . . 0.0 111.572 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.1 -48.72 61.82 Favored 'General case' 0 CA--C 1.521 -0.163 0 O-C-N 121.412 -0.805 . . . . 0.0 111.432 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.39 -53.98 51.08 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 126.762 2.025 . . . . 0.0 111.928 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.53 -38.72 90.47 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 117.303 -1.332 . . . . 0.0 110.184 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 10.8 tmm? -63.44 -45.17 92.13 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.034 1.288 . . . . 0.0 107.792 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.89 -22.41 66.99 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.59 0.632 . . . . 0.0 110.508 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.82 -25.7 22.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.478 -1.389 . . . . 0.0 111.132 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 mt -131.89 63.33 68.5 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 126.926 2.09 . . . . 0.0 107.722 -179.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -73.51 7.13 2.38 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 123.281 2.654 . . . . 0.0 114.561 -178.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -112.9 -56.31 2.43 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 119.518 1.054 . . . . 0.0 110.081 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -48.24 -52.63 20.25 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -178.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.43 -48.46 77.67 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.815 -0.553 . . . . 0.0 111.768 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.2 mm -62.52 -34.43 64.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.732 0.813 . . . . 0.0 111.203 -179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -61.72 -56.73 16.56 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.583 1.553 . . . . 0.0 108.472 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.7 m -61.35 -42.26 98.39 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' B' ' 121' ' ' LEU . 2.4 t80 -56.69 -53.42 57.94 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.438 0.695 . . . . 0.0 111.982 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -65.17 -39.62 93.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 118.762 -0.637 . . . . 0.0 110.821 -178.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.26 -49.26 78.33 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.34 -48.79 79.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.2 1.8 . . . . 0.0 110.559 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.16 -46.06 79.42 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 123.898 0.879 . . . . 0.0 110.148 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 tt0 -69.18 -42.64 75.58 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.021 1.328 . . . . 0.0 111.114 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -56.34 -52.1 65.79 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 125.69 1.596 . . . . 0.0 108.864 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -54.54 -49.32 70.56 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.485 0.714 . . . . 0.0 109.59 179.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -64.41 -28.19 69.52 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.192 0.905 . . . . 0.0 112.305 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -71.72 -59.6 2.67 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.085 -1.009 . . . . 0.0 108.98 178.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -58.42 -20.32 43.66 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.663 1.185 . . . . 0.0 112.715 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 54.6 tp -61.33 -30.06 70.27 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.729 1.611 . . . . 0.0 111.047 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.7 tp -92.23 -69.92 0.72 Allowed 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.45 0.568 . . . . 0.0 109.664 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -162.46 167.45 23.53 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.851 1.661 . . . . 0.0 107.042 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.9 ttpt 70.7 114.74 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 127.712 2.405 . . . . 0.0 110.412 -179.608 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -119.52 167.76 11.66 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 107.281 -1.378 . . . . 0.0 107.281 179.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.6 m -131.43 -64.81 0.79 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m 46.37 39.08 5.95 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.4 tt -61.01 141.48 17.3 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 O-C-N 121.635 -0.666 . . . . 0.0 109.619 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -129.55 158.27 39.73 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.432 1.893 . . . . 0.0 107.914 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.257 1.482 0 C-N-CA 126.512 1.925 . . . . 0.0 107.628 179.889 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.256 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 8.0 t -156.39 -178.78 7.58 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -137.34 73.94 1.46 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 102.741 -3.059 . . . . 0.0 102.741 178.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -127.38 -14.37 5.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -178.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -88.16 156.07 19.44 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 119.687 1.131 . . . . 0.0 110.397 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m -84.67 152.07 24.03 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -109.45 143.79 38.57 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -117.48 161.64 19.25 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.175 1.39 . . . . 0.0 110.23 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' B' ' 101' ' ' LEU . 12.0 tp -161.22 117.32 2.18 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.16 103.17 9.29 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.214 1.406 . . . . 0.0 109.367 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.485 HG11 ' HE2' ' D' 1116 ' ' LYS . 93.4 t -150.03 150.62 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.29 1.036 . . . . 0.0 110.318 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -108.44 102.67 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.806 1.242 . . . . 0.0 108.673 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.5 122.16 1.72 Allowed Glycine 0 N--CA 1.467 0.723 0 CA-C-O 115.802 -2.665 . . . . 0.0 109.067 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -68.03 -59.62 3.12 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 122.504 3.152 . . . . 0.0 113.387 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -73.24 -43.86 60.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -51.39 -51.0 58.52 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.799 1.639 . . . . 0.0 110.471 -178.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -72.11 -39.77 68.63 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.764 1.165 . . . . 0.0 111.411 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.53 -53.48 50.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.871 0.843 . . . . 0.0 109.544 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.488 HG21 HD11 ' C' 1022 ' ' ILE . 12.5 mt -61.6 -48.27 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.752 1.621 . . . . 0.0 109.427 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -57.49 -41.04 79.94 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 117.983 -1.008 . . . . 0.0 111.311 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 20.2 mtp -66.25 -44.73 82.86 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.357 1.435 . . . . 0.0 110.179 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -55.63 -45.98 77.5 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 73.3 mt -72.59 -27.39 62.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.032 1.333 . . . . 0.0 112.84 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 116' ' ' LYS . . . . . 0.417 ' HE2' HG11 ' D' 1103 ' ' VAL . 0.0 OUTLIER -64.13 -60.68 2.92 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.46 1.104 . . . . 0.0 109.032 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -63.09 -38.14 90.01 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 124.403 1.065 . . . . 0.0 108.755 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 41.9 t -52.78 -54.25 36.64 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.922 0.783 . . . . 0.0 112.219 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.15 -33.09 72.88 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.036 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.7 -43.08 97.68 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.02 1.282 . . . . 0.0 109.601 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 40' ' ' TYR . 80.8 mt -65.26 -50.22 66.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.742 1.217 . . . . 0.0 109.566 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 10.4 tpt -62.77 -29.94 71.08 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.668 0.387 . . . . 0.0 110.936 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -76.13 -41.7 49.21 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.637 0.775 . . . . 0.0 110.714 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 pp -78.12 -33.47 50.53 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -86.74 146.63 41.66 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 119.298 0.954 . . . . 0.0 109.208 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.31 -172.74 0.37 Allowed 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.2 2.6 . . . . 0.0 109.575 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -107.64 62.51 0.22 Allowed Pre-proline 0 CA--C 1.548 0.876 0 O-C-N 120.288 -1.507 . . . . 0.0 113.519 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.37 -87.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.757 2.304 . . . . 0.0 112.792 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.3 -39.48 83.14 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 121.486 -0.759 . . . . 0.0 110.239 -178.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 m -56.05 -48.02 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 117.051 -1.452 . . . . 0.0 111.716 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -75.39 -32.22 60.71 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 120.869 1.668 . . . . 0.0 111.795 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 t -65.41 -46.89 78.21 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -69.35 -39.39 78.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.168 0.987 . . . . 0.0 109.459 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.02 -48.68 77.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 119.24 0.927 . . . . 0.0 110.122 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -68.85 -46.53 68.26 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -57.89 -44.17 86.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.393 0.542 . . . . 0.0 111.404 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -72.99 -33.61 65.91 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.864 1.666 . . . . 0.0 110.626 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -61.8 -37.24 83.65 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 119.524 1.056 . . . . 0.0 110.08 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.79 -24.21 63.92 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.675 0.39 . . . . 0.0 110.474 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 11.8 tp -70.85 -12.96 61.85 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.623 1.169 . . . . 0.0 110.959 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -141.1 81.28 1.78 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.432 1.493 . . . . 0.0 109.424 179.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? . . . . . 0 C--O 1.247 0.959 0 C-N-CA 127.975 2.51 . . . . 0.0 108.423 -179.554 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 119.562 -0.256 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.05 -43.15 77.59 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 126.916 2.087 . . . . 0.0 113.368 -178.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.26 1.31 56.63 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.619 1.567 . . . . 0.0 113.093 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -79.05 138.65 38.09 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.721 0.808 . . . . 0.0 112.535 -178.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 58.1 tp -73.39 112.84 9.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 177.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.3 mt -107.43 162.18 14.16 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.067 1.347 . . . . 0.0 108.783 -179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -137.71 144.35 41.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.202 1.001 . . . . 0.0 108.544 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 13.8 tp -118.57 96.25 49.73 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.79 115.27 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 123.298 2.665 . . . . 0.0 109.452 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.7 t -143.51 153.14 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 123.677 0.791 . . . . 0.0 110.462 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 41.5 ttt-85 -132.93 101.79 5.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 103.92 -2.622 . . . . 0.0 103.92 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.66 121.94 1.0 Allowed Glycine 0 CA--C 1.516 0.155 0 N-CA-C 105.479 -3.048 . . . . 0.0 105.479 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -66.43 -52.32 47.71 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 121.913 2.856 . . . . 0.0 109.801 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.37 -47.76 75.29 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -55.26 -41.47 72.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.343 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 29.8 t80 -73.9 -50.0 22.22 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.799 1.181 . . . . 0.0 111.095 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -54.47 -50.71 67.1 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.87 0.759 . . . . 0.0 110.707 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 25.7 ptm -65.52 -43.06 91.22 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.433 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.66 -42.08 99.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 120.014 1.279 . . . . 0.0 109.804 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.48 -56.46 21.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -56.74 -48.8 76.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.247 0.619 . . . . 0.0 112.5 -178.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1022 ' ' ILE . . . . . 0.488 HD11 HG21 ' B' ' 111' ' ' ILE . 97.9 mt -67.36 -36.32 76.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.362 1.065 . . . . 0.0 112.143 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -48.8 46.33 Favored 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 120.44 -1.412 . . . . 0.0 108.267 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.14 -41.94 97.65 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.727 0.811 . . . . 0.0 109.298 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 95.4 p -59.97 -46.38 89.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.495 1.043 . . . . 0.0 110.818 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 8.1 tt -67.89 -51.07 52.29 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.745 0.818 . . . . 0.0 111.647 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -59.91 -53.73 54.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 124.009 0.924 . . . . 0.0 111.513 -178.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.72 -31.65 72.77 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 119.112 0.869 . . . . 0.0 111.581 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -69.01 -45.57 70.19 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 178.051 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -65.34 -29.85 70.63 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.611 -0.68 . . . . 0.0 110.222 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.9 t80 -80.28 -31.87 38.24 Favored 'General case' 0 C--N 1.339 0.116 0 C-N-CA 124.193 0.997 . . . . 0.0 111.267 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1032 ' ' LEU . . . . . 0.554 HD11 HD22 ' D' 1129 ' ' LEU . 15.6 mt -129.7 68.95 81.24 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 124.999 1.32 . . . . 0.0 110.812 -178.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -78.39 2.77 7.76 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.45 2.766 . . . . 0.0 115.181 -178.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -98.72 -46.47 5.67 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 120.626 1.557 . . . . 0.0 110.876 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 77.8 m80 -62.69 -58.66 6.72 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -177.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.87 -51.6 66.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.882 0.765 . . . . 0.0 111.573 -178.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.48 -37.75 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 124.254 1.021 . . . . 0.0 112.35 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -69.21 -53.84 17.86 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.285 0.948 . . . . 0.0 109.076 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.2 m -52.61 -43.69 65.53 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.447 0.567 . . . . 0.0 110.425 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1040 ' ' TYR . . . . . 0.406 ' CD2' HD21 ' D' 1121 ' ' LEU . 3.5 t80 -61.68 -54.27 44.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.306 1.442 . . . . 0.0 111.049 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -62.74 -33.46 75.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.959 0.345 . . . . 0.0 110.487 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -65.3 -44.93 86.35 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -59.14 -48.72 80.59 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 119.78 1.173 . . . . 0.0 109.535 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -53.81 -51.61 62.98 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.386 0.674 . . . . 0.0 111.16 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.84 -41.64 82.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.061 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.33 -40.81 96.64 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.1 0.864 . . . . 0.0 109.307 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -59.91 -47.29 86.39 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 2.2 m80 -59.98 -42.46 94.24 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.472 0.709 . . . . 0.0 110.111 178.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -62.29 -53.18 58.84 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.067 0.947 . . . . 0.0 110.427 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 49.3 m170 -65.21 -24.67 67.42 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.41 1.084 . . . . 0.0 111.012 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 40.9 tp -63.18 -28.95 70.4 Favored 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.064 -1.022 . . . . 0.0 109.484 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 49.1 tp -82.34 -65.43 1.01 Allowed 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 177.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.08 171.67 10.8 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.197 0.999 . . . . 0.0 109.642 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? 59.85 87.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.178 1.791 . . . . 0.0 112.503 178.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -82.14 99.67 9.37 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 2.5 m -65.8 -30.58 71.24 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 28.1 m 0.33 76.28 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 129.918 3.287 . . . . 0.0 117.68 -179.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 18.8 tt -79.93 154.26 4.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -136.06 159.42 41.76 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.498 1.119 . . . . 0.0 110.033 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.247 0.959 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.348 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 39.1 t -152.92 175.06 13.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.99 48.46 2.34 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 127.747 2.419 . . . . 0.0 107.7 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -79.57 -30.61 41.69 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.454 -0.779 . . . . 0.0 109.151 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.32 131.48 51.12 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 128.288 2.635 . . . . 0.0 112.566 -178.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 1.3 m -83.17 146.4 28.65 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -102.64 145.42 29.68 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.918 -1.114 . . . . 0.0 108.894 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -124.58 143.64 50.59 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 125.274 1.43 . . . . 0.0 107.324 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 9.4 tp -144.9 142.26 29.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 118.327 -0.844 . . . . 0.0 108.928 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -139.51 107.97 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.031 1.332 . . . . 0.0 109.138 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1103 ' ' VAL . . . . . 0.417 HG11 ' HE2' ' B' ' 116' ' ' LYS . 82.7 t -149.81 147.12 16.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 119.001 0.818 . . . . 0.0 109.095 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -102.19 103.61 14.14 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.775 0.83 . . . . 0.0 111.598 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.82 117.34 1.06 Allowed Glycine 0 N--CA 1.464 0.52 0 CA-C-O 115.994 -2.559 . . . . 0.0 108.125 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -67.48 -57.07 7.19 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 122.827 3.314 . . . . 0.0 111.452 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 30.7 mttp -68.44 -44.8 74.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -51.76 -50.88 59.8 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.025 1.33 . . . . 0.0 110.265 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.68 -45.91 77.36 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.88 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -58.42 -48.37 80.91 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.881 1.219 . . . . 0.0 109.931 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 65.7 mt -56.34 -53.95 33.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 C-N-CA 124.858 1.263 . . . . 0.0 108.658 179.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.85 -39.44 81.32 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.927 -179.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.6 mtp -65.21 -49.54 69.31 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 120.607 1.548 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -53.8 -46.6 71.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.88 0.848 . . . . 0.0 109.433 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.8 -27.2 61.01 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.404 0.682 . . . . 0.0 112.215 -179.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1116 ' ' LYS . . . . . 0.485 ' HE2' HG11 ' B' ' 103' ' ' VAL . 0.1 OUTLIER -63.04 -60.01 4.03 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.555 1.07 . . . . 0.0 109.696 -179.776 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.12 -42.74 99.08 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 31.1 t -52.76 -52.36 56.88 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.69 0.677 . . . . 0.0 112.55 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.21 -35.46 76.23 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.665 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -64.37 -48.39 75.65 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.013 1.279 . . . . 0.0 109.183 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1121 ' ' LEU . . . . . 0.406 HD21 ' CD2' ' C' 1040 ' ' TYR . 59.3 mt -58.16 -52.34 65.95 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.078 1.351 . . . . 0.0 111.548 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.9 tpt -64.16 -26.34 68.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.146 0.979 . . . . 0.0 111.392 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.86 -40.47 28.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.179 0.9 . . . . 0.0 109.85 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1124 ' ' LEU . . . . . . . . . . . . 0.32 2.0 pp -73.71 -32.42 63.89 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.2 t -94.31 148.39 34.97 Favored Pre-proline 0 CA--C 1.537 0.455 0 CA-C-N 119.068 0.849 . . . . 0.0 108.81 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.17 -164.21 0.09 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 123.715 2.944 . . . . 0.0 110.747 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -116.14 66.2 3.0 Favored Pre-proline 0 CA--C 1.547 0.851 0 O-C-N 120.183 -1.573 . . . . 0.0 113.737 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -79.96 -85.62 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 121.813 1.675 . . . . 0.0 112.662 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1129 ' ' LEU . . . . . 0.554 HD22 HD11 ' C' 1032 ' ' LEU . 7.9 tt -64.86 -38.12 89.93 Favored 'General case' 0 C--N 1.347 0.497 0 O-C-N 121.095 -1.003 . . . . 0.0 109.721 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 m -54.71 -36.06 35.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.542 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.39 -41.95 38.22 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 119.06 0.845 . . . . 0.0 109.433 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.95 -47.64 82.33 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.178 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.08 -51.38 68.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.985 0.914 . . . . 0.0 108.561 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -43.55 67.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 123.651 0.78 . . . . 0.0 110.447 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -62.84 -54.06 44.69 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 118.493 0.588 . . . . 0.0 110.031 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 10.0 tp60 -59.63 -37.28 78.2 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -40.82 43.94 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.082 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -58.91 -39.49 81.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.344 1.429 . . . . 0.0 107.397 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.03 -15.23 55.77 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.187 -0.946 . . . . 0.0 112.75 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 15.5 tp -83.52 -19.59 35.43 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.094 1.358 . . . . 0.0 110.855 179.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -140.2 96.81 3.11 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.637 1.575 . . . . 0.0 107.962 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? . . . . . 0 C--O 1.256 1.395 0 CA-C-O 114.888 -2.482 . . . . 0.0 104.405 -177.961 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 . . . . . 0 C--O 1.233 0.211 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.5 tp -74.02 94.32 2.36 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.3 mt -93.03 167.45 11.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -134.0 159.58 40.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.44 90.29 49.04 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -71.28 108.27 2.32 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 125.249 3.966 . . . . 0.0 108.645 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.0 t -138.5 148.64 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 124.338 1.055 . . . . 0.0 110.516 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.2 102.06 4.88 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 175.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.46 124.49 1.25 Allowed Glycine 0 CA--C 1.522 0.472 0 N-CA-C 104.955 -3.258 . . . . 0.0 104.955 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -52.19 26.84 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 120.34 2.07 . . . . 0.0 111.476 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.84 -42.17 95.14 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -56.9 -47.79 79.7 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.24 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.93 -53.99 51.74 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.835 0.743 . . . . 0.0 111.211 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -55.33 -47.59 75.45 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -69.68 -44.16 71.02 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 118.237 0.472 . . . . 0.0 112.267 -179.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.88 -44.11 94.04 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.22 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -50.36 63.27 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.947 0.794 . . . . 0.0 109.757 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.59 -50.1 73.95 Favored 'General case' 0 C--O 1.225 -0.202 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.83 -32.25 57.35 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 CA-C-N 119.672 1.124 . . . . 0.0 110.155 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.561 ' HE2' HG11 ' C' 1010 ' ' VAL . 19.3 tptp -66.59 -46.55 75.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.69 -54.24 34.73 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.786 1.234 . . . . 0.0 110.924 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 m -53.61 -44.72 69.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 119.941 1.246 . . . . 0.0 112.086 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.53 -50.95 48.18 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.616 0.644 . . . . 0.0 110.017 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -54.42 -47.88 72.27 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.386 1.074 . . . . 0.0 110.817 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -64.62 -43.77 92.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.907 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 54.2 ttp -55.61 -48.19 75.3 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.115 0.87 . . . . 0.0 109.676 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -76.54 -14.39 60.02 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -86.33 -54.26 4.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 119.631 1.105 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 CA--C 1.534 0.35 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.991 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.3 t60 . . . . . 0 CA--C 1.535 0.384 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.0 m -59.79 -47.52 85.35 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 123.417 0.687 . . . . 0.0 111.006 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.408 HG13 ' H ' ' A' ' 37' ' ' ILE . 8.3 mt -60.3 -44.55 95.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 126.395 1.878 . . . . 0.0 111.933 -177.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.07 -58.72 7.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.5 m -55.83 -41.01 73.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.622 0.769 . . . . 0.0 111.162 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -65.34 -53.93 36.43 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.986 0.914 . . . . 0.0 110.993 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -61.73 -41.58 97.82 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.582 -0.699 . . . . 0.0 110.502 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.94 -54.24 33.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.014 0.926 . . . . 0.0 109.415 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -58.5 -44.39 89.42 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 119.649 1.113 . . . . 0.0 110.707 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -58.03 -36.39 72.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.441 1.019 . . . . 0.0 109.662 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.27 -53.73 33.35 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 CA--C 1.535 0.395 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.815 -179.693 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 56.4 m . . . . . 0 N--CA 1.451 -0.412 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -101.62 138.52 38.5 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -117.22 145.63 43.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.428 1.491 . . . . 0.0 109.577 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.3 mt -136.06 128.83 30.97 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 125.027 1.331 . . . . 0.0 107.469 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -129.46 100.52 5.58 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.22 149.87 11.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 124.065 0.946 . . . . 0.0 108.797 -179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -114.11 102.36 10.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.4 0.68 . . . . 0.0 110.739 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.57 113.76 0.75 Allowed Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 116.396 -2.335 . . . . 0.0 108.72 177.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -60.59 -56.42 21.55 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.669 2.735 . . . . 0.0 110.501 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -63.06 -52.03 64.36 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -51.96 -49.62 62.85 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.825 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -63.24 -44.84 94.09 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 120.623 1.556 . . . . 0.0 111.596 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -57.06 -50.69 71.98 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.346 0.976 . . . . 0.0 110.4 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.472 HG21 HD11 ' C' 1022 ' ' ILE . 81.2 mt -62.01 -58.27 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 127.058 2.143 . . . . 0.0 110.609 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.61 -36.79 77.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 116.647 -1.644 . . . . 0.0 110.043 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 64.0 mtp -63.08 -52.88 60.97 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 121.423 1.919 . . . . 0.0 110.316 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.45 -43.21 97.1 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.513 0.597 . . . . 0.0 111.827 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 74.6 mt -69.66 -34.49 74.07 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.67 0.668 . . . . 0.0 110.815 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . 0.42 ' HB2' HD21 ' D' 1112 ' ' LEU . 0.2 OUTLIER -66.24 -54.16 28.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.684 0.794 . . . . 0.0 109.78 180.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -60.93 -41.94 97.21 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.011 1.325 . . . . 0.0 108.818 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.6 t -52.78 -52.97 54.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.827 0.851 . . . . 0.0 110.992 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.2 -38.64 82.17 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.92 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -46.09 88.37 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.577 1.081 . . . . 0.0 109.071 178.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' B' ' 121' ' ' LEU . 3.7 mm? -67.45 -45.07 77.08 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 117.151 -1.404 . . . . 0.0 108.01 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 6.3 tpt -53.89 -33.35 56.27 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 120.101 1.319 . . . . 0.0 110.383 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.47 -31.92 48.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.847 0.859 . . . . 0.0 111.107 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 51.1 tp -87.88 -33.43 18.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 4.1 m -93.46 148.08 34.85 Favored Pre-proline 0 C--O 1.235 0.313 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.59 175.41 9.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 120.981 1.121 . . . . 0.0 110.071 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.36 33.47 0.05 OUTLIER Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 117.538 2.422 . . . . 0.0 117.538 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.26 -57.23 0.79 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 123.07 2.132 . . . . 0.0 112.551 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -28.89 69.9 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.974 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 9.9 t -63.25 -56.54 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.109 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.218 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.46 -35.68 77.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.157 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 9.6 t -61.71 -50.26 73.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 109.247 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.79 -40.41 72.58 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.896 -0.502 . . . . 0.0 109.759 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -52.89 -48.22 67.34 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.145 1.378 . . . . 0.0 111.448 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -77.7 -46.18 22.62 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 123.362 0.665 . . . . 0.0 112.09 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -55.59 -39.03 70.19 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.8 tm0? -80.55 -29.61 37.12 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 125.306 1.443 . . . . 0.0 109.048 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.28 -30.06 64.38 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.546 1.521 . . . . 0.0 108.035 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 14.3 mt -59.38 -13.66 9.2 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 118.917 0.78 . . . . 0.0 112.797 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.546 0.812 0 C-N-CA 126.218 1.807 . . . . 0.0 108.94 177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 . . . . . 0 N--CA 1.464 0.243 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 61.5 tp -77.17 95.29 4.24 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 16.7 mt -96.48 127.41 42.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.723 2.009 . . . . 0.0 108.874 -178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -106.2 122.61 46.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.591 0.756 . . . . 0.0 109.465 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.3 mt -95.72 100.24 5.99 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 117.552 -1.213 . . . . 0.0 108.842 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -75.33 121.94 6.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.809 2.34 . . . . 0.0 110.252 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . 0.561 HG11 ' HE2' ' A' ' 23' ' ' LYS . 4.8 t -145.63 152.37 14.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 O-C-N 120.951 -1.093 . . . . 0.0 110.716 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.18 102.02 4.87 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.22 130.49 2.13 Favored Glycine 0 CA--C 1.52 0.365 0 CA-C-O 116.311 -2.383 . . . . 0.0 107.646 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -52.53 22.77 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.655 2.727 . . . . 0.0 111.911 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -72.54 -31.14 65.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.54 -41.55 98.45 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.822 0.849 . . . . 0.0 110.203 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 11.1 t80 -69.61 -52.04 29.57 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.057 0.844 . . . . 0.0 108.947 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -54.3 -57.42 11.29 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.81 -45.87 91.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.03 0.532 . . . . 0.0 111.999 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.5 mm? -67.29 -38.2 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.962 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.24 -49.03 47.52 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 119.988 1.267 . . . . 0.0 111.079 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.21 -46.97 75.93 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.407 1.003 . . . . 0.0 110.959 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . 0.472 HD11 HG21 ' B' ' 111' ' ' ILE . 84.5 mt -68.69 -45.39 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.2 tptp -58.02 -45.84 86.25 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 124.537 1.135 . . . . 0.0 110.615 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -67.36 -50.98 57.55 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.434 1.094 . . . . 0.0 108.894 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 30.2 m -53.96 -42.6 69.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.368 0.985 . . . . 0.0 111.134 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -68.89 -52.13 32.82 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.452 1.101 . . . . 0.0 109.894 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -58.55 -43.55 89.36 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 122.956 0.502 . . . . 0.0 110.886 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.09 -40.02 86.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.762 -1.113 . . . . 0.0 109.516 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 49.0 ttp -63.13 -35.73 81.26 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.005 0.821 . . . . 0.0 110.163 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -87.6 -12.87 44.37 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.28 0.945 . . . . 0.0 112.496 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 7.2 t80 -98.58 -57.85 2.1 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.859 1.264 . . . . 0.0 113.029 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.391 0 C-N-CA 123.727 0.811 . . . . 0.0 111.933 -178.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.0 t60 . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 44.4 m -59.14 -43.51 92.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.044 -0.979 . . . . 0.0 108.463 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 42.4 mt -61.54 -45.41 98.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 119.791 1.178 . . . . 0.0 109.334 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -56.26 -55.37 34.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.806 0.842 . . . . 0.0 110.266 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 41.2 m -65.24 -34.85 79.35 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.819 -0.55 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.68 -52.61 56.32 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.473 1.109 . . . . 0.0 109.929 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -55.65 -47.33 76.83 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -59.32 -57.15 14.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.915 0.886 . . . . 0.0 109.966 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -50.2 -50.47 49.39 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.722 0.809 . . . . 0.0 111.349 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -63.13 -40.7 98.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.612 0.642 . . . . 0.0 110.97 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -62.89 -43.95 97.42 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.545 0.738 . . . . 0.0 109.455 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 . . . . . 0 N--CA 1.448 -0.548 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.135 178.942 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.5 m . . . . . 0 CA--C 1.534 0.363 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -101.82 134.38 45.09 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -120.84 123.3 42.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 125.837 1.655 . . . . 0.0 109.209 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . 0.435 HD23 ' H ' ' D' 1102 ' ' GLN . 0.5 OUTLIER -126.65 147.83 49.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.174 0.99 . . . . 0.0 108.884 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . 0.435 ' H ' HD23 ' D' 1101 ' ' LEU . 7.4 pm0 -136.06 110.87 8.73 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.098 2.159 . . . . 0.0 109.428 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -155.2 151.21 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.471 1.509 . . . . 0.0 110.639 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.67 102.44 7.6 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.732 1.151 . . . . 0.0 110.535 177.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.56 122.87 2.04 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 105.197 -3.161 . . . . 0.0 105.197 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.57 -58.19 5.7 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 120.989 2.395 . . . . 0.0 114.3 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -63.06 -41.02 99.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.596 0.635 . . . . 0.0 109.327 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -53.02 -48.58 67.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.288 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.6 t80 -63.76 -48.38 77.2 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 119.514 1.052 . . . . 0.0 111.727 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.0 -47.29 68.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.197 0.908 . . . . 0.0 111.313 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.4 mt -68.57 -57.56 8.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 126.104 1.762 . . . . 0.0 110.79 -179.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . 0.42 HD21 ' HB2' ' B' ' 116' ' ' LYS . 5.1 mp -56.68 -39.0 73.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 118.925 0.784 . . . . 0.0 110.797 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 42.1 mtp -63.55 -52.67 60.08 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.362 0.983 . . . . 0.0 110.237 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.08 -33.33 75.25 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.428 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . 0.429 HD22 ' CG2' ' C' 1022 ' ' ILE . 31.6 mt -70.32 -38.37 74.91 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 120.215 1.37 . . . . 0.0 109.951 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . 0.403 ' HE3' ' CG ' ' D' 1120 ' ' GLU . 21.8 tptt -62.67 -52.49 63.08 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -57.01 -42.37 80.22 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.412 1.485 . . . . 0.0 109.693 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 44.8 t -52.64 -54.63 30.71 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.529 1.132 . . . . 0.0 110.255 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.09 -43.39 74.61 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.411 -0.805 . . . . 0.0 110.977 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . 0.403 ' CG ' ' HE3' ' D' 1116 ' ' LYS . 2.0 mm-40 -55.36 -48.15 74.69 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.172 0.896 . . . . 0.0 111.7 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . 0.457 ' HA ' HD13 ' D' 1121 ' ' LEU . 3.4 mm? -72.35 -48.76 39.4 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 116.208 -1.853 . . . . 0.0 109.058 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.5 tpt -54.51 -33.06 59.2 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.846 1.657 . . . . 0.0 109.436 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -74.87 -32.96 62.01 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 117.897 -1.049 . . . . 0.0 110.572 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 43.7 tp -87.03 -32.55 19.95 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.179 1.354 . . . . 0.0 113.624 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 9.7 m -92.41 148.45 36.44 Favored Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 120.752 -1.218 . . . . 0.0 108.322 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -68.84 177.34 5.03 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 N-CA-C 109.426 -1.028 . . . . 0.0 109.426 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -113.4 47.71 0.38 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 116.361 1.986 . . . . 0.0 116.361 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.41 -51.18 0.77 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.744 2.296 . . . . 0.0 113.014 -178.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -29.6 69.43 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.136 -0.978 . . . . 0.0 110.625 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.6 t -61.17 -54.48 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 124.034 0.934 . . . . 0.0 108.669 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.63 -45.73 92.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.02 0.827 . . . . 0.0 111.428 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.8 t -59.07 -50.46 74.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.095 0.958 . . . . 0.0 110.484 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.1 t80 -68.39 -42.16 79.48 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.035 1.334 . . . . 0.0 110.853 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.49 -49.15 68.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 119.107 0.867 . . . . 0.0 111.023 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -74.43 -39.93 62.29 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.1 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -62.79 -29.9 71.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.822 0.449 . . . . 0.0 111.42 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -80.19 -39.06 29.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -56.75 -32.67 65.8 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.814 -0.554 . . . . 0.0 109.518 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 15.1 mt -64.26 -12.19 38.83 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.605 1.162 . . . . 0.0 113.097 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 3.0 tt . . . . . 0 CA--C 1.537 0.468 0 C-N-CA 124.618 1.167 . . . . 0.0 109.122 178.284 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.3 95.4 0.43 Allowed 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -104.14 129.16 51.85 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.292 1.037 . . . . 0.0 110.243 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -103.38 118.6 37.12 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -101.93 96.02 6.23 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 125.806 1.642 . . . . 0.0 111.118 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -75.38 113.95 3.88 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 125.12 3.88 . . . . 0.0 111.466 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.9 t -145.11 154.91 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.278 -0.889 . . . . 0.0 109.487 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -135.34 101.88 4.97 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 125.046 1.339 . . . . 0.0 107.817 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.94 121.36 0.97 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 107.64 -2.184 . . . . 0.0 107.64 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.92 -51.57 31.81 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 120.232 2.016 . . . . 0.0 108.45 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.98 -32.82 73.5 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -61.52 -53.37 57.27 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.135 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -67.65 -39.16 84.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.02 -57.23 12.56 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.332 0.515 . . . . 0.0 110.397 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -71.48 -33.38 69.24 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 119.322 -0.37 . . . . 0.0 111.494 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 tp -61.22 -53.34 58.11 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.172 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.88 -34.95 77.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.225 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.25 -49.22 72.6 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.602 1.092 . . . . 0.0 110.607 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.0 mt -83.25 -35.05 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 123.612 0.765 . . . . 0.0 112.169 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.52 -46.63 87.54 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 120.186 -1.571 . . . . 0.0 109.359 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -67.83 -48.9 64.9 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 117.346 -1.311 . . . . 0.0 109.812 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.3 p -53.03 -41.26 64.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 120.04 1.291 . . . . 0.0 112.158 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 26' ' ' LEU . 1.1 tm? -74.19 -49.67 22.53 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.898 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -54.46 -47.61 72.71 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.031 0.832 . . . . 0.0 109.913 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.426 HD22 HG22 ' B' ' 130' ' ' VAL . 55.8 mt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.709 1.604 . . . . 0.0 110.857 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.9 ttt -56.75 -47.1 80.84 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.586 1.154 . . . . 0.0 109.079 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -64.84 -40.28 94.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.866 1.267 . . . . 0.0 111.532 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.8 -30.33 65.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.696 1.199 . . . . 0.0 112.307 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.3 tp . . . . . 0 C--O 1.238 0.449 0 C-N-CA 123.657 0.783 . . . . 0.0 109.918 -179.362 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.0 m80 . . . . . 0 CA--C 1.538 0.498 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.6 m -57.15 -48.53 78.46 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.252 1.387 . . . . 0.0 107.798 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.4 mt -65.35 -44.48 94.69 Favored 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 124.38 1.072 . . . . 0.0 108.616 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.04 -39.27 77.97 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.449 0.568 . . . . 0.0 111.98 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.4 m -66.6 -52.48 44.81 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -55.76 -51.38 67.59 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 123.408 0.683 . . . . 0.0 111.042 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -53.21 -48.44 68.13 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.737 0.415 . . . . 0.0 111.3 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -64.02 -50.81 67.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.539 0.735 . . . . 0.0 111.924 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -61.53 -40.49 94.84 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.019 0.928 . . . . 0.0 111.846 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -45.37 67.95 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -58.02 -29.15 65.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.412 1.005 . . . . 0.0 111.709 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.763 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 59.2 m . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 120.517 0.198 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -123.37 142.24 51.17 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 124.488 1.115 . . . . 0.0 108.567 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -127.2 147.45 50.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.06 0.944 . . . . 0.0 109.777 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.16 144.87 51.15 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.357 1.863 . . . . 0.0 107.371 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.08 98.92 4.12 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.223 1.009 . . . . 0.0 112.321 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -151.72 150.35 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.174 -1.579 . . . . 0.0 112.108 -178.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.428 ' HB3' ' HA ' ' D' 1098 ' ' THR . 0.0 OUTLIER -124.2 100.85 6.9 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 121.924 0.869 . . . . 0.0 108.883 177.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.64 116.54 1.04 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 103.753 -3.739 . . . . 0.0 103.753 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.7 -56.78 14.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 120.473 2.137 . . . . 0.0 111.002 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -61.11 -48.96 79.25 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 -54.86 -45.5 74.57 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.428 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -61.83 -55.05 33.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.356 -1.307 . . . . 0.0 111.216 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -48.45 -54.32 14.6 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.291 1.036 . . . . 0.0 111.049 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.3 mt -60.62 -57.73 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 126.13 1.772 . . . . 0.0 110.028 -179.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.44 -25.77 67.44 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.195 -0.94 . . . . 0.0 112.136 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 5.5 ttt -68.91 -52.42 29.63 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.657 1.117 . . . . 0.0 108.218 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -65.58 -37.67 87.31 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 118.894 -1.123 . . . . 0.0 110.344 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.0 mt -63.89 -38.89 92.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.756 -0.59 . . . . 0.0 111.241 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -54.21 28.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 O-C-N 121.344 -0.848 . . . . 0.0 110.025 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -54.66 -42.83 71.79 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 125.377 1.673 . . . . 0.0 108.337 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 40.8 t -58.04 -48.65 79.45 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.242 1.017 . . . . 0.0 110.899 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.26 -43.43 86.48 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.65 0.659 . . . . 0.0 111.26 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.07 -45.63 91.24 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.198 0.908 . . . . 0.0 109.598 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -48.05 75.02 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.635 -0.666 . . . . 0.0 109.818 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -24.0 67.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.129 0.972 . . . . 0.0 111.098 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -89.31 -20.65 23.8 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.747 1.158 . . . . 0.0 110.521 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.08 -33.18 11.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 120.034 1.288 . . . . 0.0 112.149 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.1 t -95.49 148.08 34.04 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.729 1.612 . . . . 0.0 108.487 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.25 -178.1 3.98 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 123.481 2.788 . . . . 0.0 111.635 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -129.0 62.84 64.43 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 116.752 2.13 . . . . 0.0 116.752 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.19 -54.83 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.517 2.811 . . . . 0.0 113.728 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 tt -56.33 -34.09 66.24 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.627 0.771 . . . . 0.0 109.767 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.426 HG22 HD22 ' A' ' 28' ' ' LEU . 14.8 t -61.25 -47.57 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 126.101 1.76 . . . . 0.0 109.3 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -63.49 -36.29 83.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.646 1.112 . . . . 0.0 109.74 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 2.8 t -70.62 -39.05 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.881 0.472 . . . . 0.0 110.166 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -70.1 -50.76 37.57 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.315 1.446 . . . . 0.0 109.371 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.17 -48.12 68.25 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.447 1.499 . . . . 0.0 110.445 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 -68.34 -48.05 65.87 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.732 1.151 . . . . 0.0 110.648 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -56.0 -40.47 73.41 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.004 -0.435 . . . . 0.0 110.924 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -80.74 -27.71 36.74 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.541 1.137 . . . . 0.0 111.264 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -63.68 -33.3 75.32 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.654 1.57 . . . . 0.0 108.483 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.7 mt -63.96 -15.68 59.78 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.043 0.937 . . . . 0.0 111.756 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 CA--C 1.539 0.546 0 C-N-CA 125.094 1.357 . . . . 0.0 109.433 178.558 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 36.3 tt0 . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 21.9 tp -73.78 95.15 2.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.82 176.36 5.32 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.306 2.242 . . . . 0.0 109.276 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -138.42 144.83 40.36 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.633 1.573 . . . . 0.0 107.224 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.9 tp -126.11 105.78 25.32 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.418 1.487 . . . . 0.0 110.494 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -82.66 115.43 2.47 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 123.868 3.045 . . . . 0.0 111.43 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 96.4 t -139.93 150.86 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 120.299 -1.501 . . . . 0.0 108.056 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.39 104.77 5.71 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.205 0.602 . . . . 0.0 110.775 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -165.96 125.42 1.34 Allowed Glycine 0 CA--C 1.519 0.319 0 N-CA-C 105.881 -2.888 . . . . 0.0 105.881 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -68.52 -51.78 39.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 121.779 2.79 . . . . 0.0 109.881 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.0 -41.71 97.4 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.561 0.696 . . . . 0.0 109.138 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -61.93 -46.82 87.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 124.344 1.057 . . . . 0.0 111.647 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 17.1 t80 -66.77 -41.91 86.93 Favored 'General case' 0 C--O 1.23 0.065 0 CA-C-N 120.157 1.344 . . . . 0.0 111.863 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -55.54 -56.99 13.86 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.563 0.745 . . . . 0.0 110.716 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 tmm? -70.47 -40.26 73.77 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 118.507 -0.758 . . . . 0.0 112.594 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 8.5 tp -58.11 -40.95 82.49 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.242 0.928 . . . . 0.0 108.904 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 6.6 mt -66.87 -47.14 72.8 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.919 -1.039 . . . . 0.0 109.142 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -55.52 -49.14 73.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.382 0.992 . . . . 0.0 111.976 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.76 -36.89 66.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 O-C-N 121.866 -0.521 . . . . 0.0 111.183 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -66.59 -57.9 6.29 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.108 -0.995 . . . . 0.0 109.122 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -54.96 -55.23 33.08 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.327 1.451 . . . . 0.0 109.731 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 33.1 p -53.37 -49.9 66.2 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.958 1.254 . . . . 0.0 112.49 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.28 -52.07 63.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 118.197 0.453 . . . . 0.0 110.767 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.84 -40.67 80.66 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.452 0.701 . . . . 0.0 112.089 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 31.5 mt -71.36 -44.5 64.91 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.036 -1.04 . . . . 0.0 110.012 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -43.25 85.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -66.61 -44.45 82.06 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.404 1.882 . . . . 0.0 110.951 179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 t80 -68.64 -44.46 74.12 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 12.6 tp . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 124.621 1.168 . . . . 0.0 110.869 -178.287 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 13.3 m80 . . . . . 0 CA--C 1.534 0.363 0 CA-C-O 119.775 -0.155 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -51.55 66.81 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.75 1.22 . . . . 0.0 108.801 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 48.3 mt -65.39 -45.31 93.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 125.743 1.617 . . . . 0.0 108.676 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.48 -45.3 69.57 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 124.911 1.284 . . . . 0.0 111.314 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.7 m -65.68 -52.9 47.88 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.752 1.221 . . . . 0.0 109.784 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -55.78 -48.97 74.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.027 0.931 . . . . 0.0 111.208 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -55.22 -48.53 73.76 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.3 0.64 . . . . 0.0 110.468 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -33.72 75.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.97 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.76 -48.74 77.86 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.522 0.729 . . . . 0.0 109.089 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -60.25 -46.58 89.3 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.896 0.479 . . . . 0.0 109.718 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -58.64 -33.49 70.12 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.198 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 CA--C 1.541 0.6 0 CA-C-N 119.826 1.194 . . . . 0.0 108.443 178.696 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . 0.428 ' HA ' ' HB3' ' B' ' 104' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.362 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -119.83 130.49 54.93 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -120.6 142.79 49.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.401 1.08 . . . . 0.0 109.227 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.31 134.83 54.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.703 1.201 . . . . 0.0 108.197 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -128.25 111.52 13.49 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.7 m -155.38 151.68 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 126.209 1.804 . . . . 0.0 108.71 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.88 101.68 7.38 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.86 122.32 1.81 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 106.833 -2.507 . . . . 0.0 106.833 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -67.51 -58.0 5.51 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 120.799 2.299 . . . . 0.0 113.683 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 51.6 mttm -65.83 -42.93 89.93 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -51.98 -49.01 64.08 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.227 -0.892 . . . . 0.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 75.2 t80 -62.94 -49.63 73.99 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.301 0.955 . . . . 0.0 112.558 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -56.77 -49.71 74.47 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.208 0.913 . . . . 0.0 110.551 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.8 mt -58.98 -48.81 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 1.8 mm? -62.3 -34.7 77.1 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.313 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -52.85 57.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.189 0.904 . . . . 0.0 108.562 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -62.97 -42.47 99.84 Favored 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.72 -0.792 . . . . 0.0 111.232 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 34.9 mt -64.1 -44.59 91.85 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 118.209 0.459 . . . . 0.0 112.157 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.62 -51.96 55.6 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 118.703 0.683 . . . . 0.0 110.475 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.05 -52.12 59.55 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.583 1.177 . . . . 0.0 108.815 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 42.2 t -56.5 -44.7 80.94 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.143 -1.408 . . . . 0.0 112.839 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.87 -44.9 91.68 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.899 1.227 . . . . 0.0 110.487 -179.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.77 -48.26 81.45 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.635 0.774 . . . . 0.0 109.511 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -44.95 89.26 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.2 1.0 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.4 -30.55 70.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.769 1.227 . . . . 0.0 111.47 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 40.0 tp10 -78.7 -34.69 45.85 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.843 -0.599 . . . . 0.0 109.914 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.1 pp -85.75 -29.81 23.58 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.1 p -94.2 144.26 27.74 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 119.917 1.235 . . . . 0.0 109.059 -178.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.65 175.51 7.92 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.484 1.456 . . . . 0.0 110.667 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -117.93 39.96 0.31 Allowed Pre-proline 0 CA--C 1.553 1.083 0 N-CA-C 118.07 2.619 . . . . 0.0 118.07 -176.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -57.54 -48.76 15.8 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.727 2.284 . . . . 0.0 115.08 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 9.1 tt -65.1 -38.98 92.45 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.4 t -58.11 -48.32 84.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 123.773 0.829 . . . . 0.0 109.01 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.85 -45.08 78.55 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 2.5 m -63.05 -48.0 80.58 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 119.183 -0.437 . . . . 0.0 110.238 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.38 -52.59 64.73 Favored 'General case' 0 C--O 1.227 -0.109 0 C-N-CA 124.834 1.253 . . . . 0.0 110.948 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -53.23 -46.04 68.94 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.37 1.868 . . . . 0.0 110.822 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.75 -50.78 26.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.626 0.648 . . . . 0.0 110.226 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -56.08 -35.15 66.66 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.818 -0.552 . . . . 0.0 110.888 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -78.1 -32.89 50.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.165 0.986 . . . . 0.0 110.286 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -59.57 -33.09 71.0 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.7 mt -61.2 -9.93 5.75 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.423 0.689 . . . . 0.0 112.544 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.744 0 C-N-CA 126.582 1.953 . . . . 0.0 109.665 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.9 tp -77.58 108.91 11.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.034 1.334 . . . . 0.0 111.429 -178.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -103.34 162.64 12.84 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -135.97 102.25 4.98 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.338 -0.852 . . . . 0.0 111.094 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mp -75.73 119.4 76.97 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 119.897 1.226 . . . . 0.0 108.626 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -86.85 117.42 1.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 122.836 2.358 . . . . 0.0 107.839 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.4 t -141.13 152.07 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 119.955 1.252 . . . . 0.0 108.763 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.16 102.9 5.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.93 124.58 1.24 Allowed Glycine 0 C--O 1.225 -0.444 0 CA-C-O 115.695 -2.725 . . . . 0.0 107.682 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -69.88 -52.0 28.45 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 122.617 3.209 . . . . 0.0 111.288 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -76.17 -30.85 58.24 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.816 1.246 . . . . 0.0 109.29 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 m -67.0 -51.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -58.88 -37.9 77.61 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 119.036 0.835 . . . . 0.0 109.912 179.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -57.64 9.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.472 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -64.95 -44.09 90.57 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.497 0.59 . . . . 0.0 111.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.04 -51.4 69.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.2 1.0 . . . . 0.0 108.49 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -70.77 -45.56 64.51 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.323 0.965 . . . . 0.0 111.85 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -56.31 -48.85 75.87 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.657 1.117 . . . . 0.0 113.367 -177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.7 mt -74.4 -32.97 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.718 -0.614 . . . . 0.0 109.352 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.89 -48.23 79.89 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.98 -45.46 93.55 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 125.554 1.541 . . . . 0.0 109.139 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.2 t -53.17 -51.35 62.33 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.747 0.819 . . . . 0.0 110.72 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tt -61.6 -55.56 29.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.865 0.866 . . . . 0.0 109.946 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.89 -51.63 65.4 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 124.547 1.139 . . . . 0.0 112.588 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.05 -41.55 86.31 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.141 -0.974 . . . . 0.0 112.521 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.89 -45.5 93.48 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -67.23 -31.51 71.92 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 118.36 -0.829 . . . . 0.0 111.378 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -71.39 -27.59 63.43 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.159 0.89 . . . . 0.0 109.767 178.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.2 mt . . . . . 0 C--O 1.241 0.631 0 CA-C-N 119.743 1.156 . . . . 0.0 109.417 178.497 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.236 0.363 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -45.68 79.02 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.759 -0.588 . . . . 0.0 112.026 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.2 mm -67.49 -34.76 70.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 123.849 0.86 . . . . 0.0 111.048 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -58.7 -54.85 42.47 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -58.74 -41.11 85.72 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.649 0.78 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -60.42 -53.4 57.99 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.22 0.918 . . . . 0.0 110.558 179.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.07 -40.46 81.09 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.074 0.55 . . . . 0.0 109.867 -178.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.55 -47.92 65.64 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.77 -0.633 . . . . 0.0 109.712 179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.41 -46.8 76.6 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.41 1.484 . . . . 0.0 110.995 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -62.36 -49.72 74.45 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.713 0.805 . . . . 0.0 110.47 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.08 -41.87 98.62 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.635 1.174 . . . . 0.0 111.253 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 123.064 0.546 . . . . 0.0 111.896 -179.191 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -102.74 129.61 49.43 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -105.68 155.14 19.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.71 145.91 26.94 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.27 108.6 5.27 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.367 1.867 . . . . 0.0 109.892 -179.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.576 HG11 ' HE3' ' D' 1116 ' ' LYS . 54.6 t -155.37 146.37 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.54 1.136 . . . . 0.0 109.372 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -97.27 104.77 16.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.07 108.06 0.5 Allowed Glycine 0 C--O 1.225 -0.45 0 CA-C-O 116.448 -2.306 . . . . 0.0 111.451 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -64.53 -57.23 9.74 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.546 3.173 . . . . 0.0 110.775 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -50.09 66.64 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.927 0.891 . . . . 0.0 109.908 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -56.71 -43.57 80.69 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 118.481 -0.771 . . . . 0.0 112.031 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -61.47 -49.96 74.69 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.225 0.921 . . . . 0.0 109.483 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.62 -53.73 54.28 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 124.04 0.837 . . . . 0.0 112.349 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.34 -58.03 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.601 1.56 . . . . 0.0 110.921 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.31 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 117.606 -1.188 . . . . 0.0 111.184 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -70.25 -44.81 67.72 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 120.821 1.646 . . . . 0.0 108.169 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.04 -47.6 71.4 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 18.5 mt -67.99 -39.54 83.23 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.013 0.925 . . . . 0.0 111.454 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -57.93 -59.07 5.81 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.751 1.62 . . . . 0.0 109.012 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -54.27 -50.3 67.57 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.769 2.028 . . . . 0.0 110.369 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 16.4 m -59.07 -36.25 74.75 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -38.42 64.14 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.097 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.96 -42.75 98.9 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.48 -42.64 99.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.25 -38.11 89.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.64 0.776 . . . . 0.0 110.85 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.63 -38.16 70.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.775 0.83 . . . . 0.0 111.404 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -32.97 28.24 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 65.4 t -93.72 141.28 23.59 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 119.3 0.955 . . . . 0.0 108.524 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -67.72 -164.38 0.1 OUTLIER 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 122.841 2.361 . . . . 0.0 110.389 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -108.77 47.3 0.2 Allowed Pre-proline 0 CA--C 1.555 1.154 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -67.89 -71.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.314 2.676 . . . . 0.0 112.602 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.76 -38.69 79.01 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 7.5 t -52.89 -55.86 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 126.777 2.031 . . . . 0.0 109.975 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -66.01 -43.39 87.84 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.314 1.046 . . . . 0.0 111.583 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.1 t -56.73 -49.92 73.77 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.513 0.725 . . . . 0.0 109.986 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -64.77 -48.79 73.24 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.686 1.594 . . . . 0.0 108.111 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.0 66.3 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.761 1.224 . . . . 0.0 112.098 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.32 -56.62 10.26 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.91 0.777 . . . . 0.0 110.692 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -53.98 -41.39 67.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.096 0.558 . . . . 0.0 110.94 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -69.56 -41.63 75.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.569 1.148 . . . . 0.0 110.261 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -56.96 -31.45 65.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 119.434 1.015 . . . . 0.0 109.871 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.37 -11.49 6.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.15 0.886 . . . . 0.0 112.45 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 CA--C 1.54 0.559 0 C-N-CA 125.57 1.548 . . . . 0.0 109.638 178.236 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.59 106.58 8.32 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.373 1.869 . . . . 0.0 110.462 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.07 154.27 19.9 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.025 1.73 . . . . 0.0 109.072 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -119.16 145.32 46.09 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.217 0.917 . . . . 0.0 111.519 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.8 mt -117.79 90.3 35.89 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.711 1.604 . . . . 0.0 110.661 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.0 106.72 2.27 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.952 3.768 . . . . 0.0 110.769 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 15.3 t -139.41 156.91 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.339 1.456 . . . . 0.0 108.917 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.57 101.56 4.83 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 123.156 0.583 . . . . 0.0 110.026 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.87 121.92 1.02 Allowed Glycine 0 CA--C 1.522 0.512 0 N-CA-C 108.363 -1.895 . . . . 0.0 108.363 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -69.19 -51.84 33.96 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.277 2.039 . . . . 0.0 111.255 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -70.7 -33.46 70.91 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.48 0.657 . . . . 0.0 109.465 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 33.1 m -60.1 -51.29 70.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.319 1.448 . . . . 0.0 108.552 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.12 -44.52 95.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.751 1.221 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -55.91 -57.18 13.16 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.6 ppp? -65.24 -39.12 92.28 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.682 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 19.7 tp -60.07 -49.6 77.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.671 -0.681 . . . . 0.0 112.078 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.63 -45.86 88.33 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.594 0.634 . . . . 0.0 109.856 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -55.2 -45.58 75.86 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.266 0.626 . . . . 0.0 111.549 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 25.8 mt -76.27 -46.73 32.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.207 0.603 . . . . 0.0 111.169 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -59.6 -37.24 78.02 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.35 0.66 . . . . 0.0 110.221 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -66.64 -51.97 50.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.3 t -53.44 -51.52 62.4 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.693 0.797 . . . . 0.0 112.131 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.18 -53.64 54.42 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.609 0.764 . . . . 0.0 110.764 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -58.84 -51.03 71.74 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.159 0.584 . . . . 0.0 111.967 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.8 -38.03 89.6 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.655 0.782 . . . . 0.0 111.4 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.2 tmt? -62.04 -46.79 87.58 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -74.93 -20.27 59.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.702 0.683 . . . . 0.0 110.888 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -76.64 -38.09 55.22 Favored 'General case' 0 C--N 1.346 0.445 0 O-C-N 120.568 -1.332 . . . . 0.0 108.396 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 17.5 mt . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 177.532 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.467 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.92 71.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.148 1.34 . . . . 0.0 111.281 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.34 -36.95 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.687 1.195 . . . . 0.0 110.45 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.5 -52.46 61.16 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.131 1.772 . . . . 0.0 108.762 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.8 m -64.11 -40.81 97.0 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -56.59 -53.65 55.18 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.409 1.084 . . . . 0.0 109.614 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -63.09 -40.09 96.61 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.444 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.75 -48.83 80.05 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.879 0.763 . . . . 0.0 109.031 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -62.09 -50.77 70.6 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.276 1.43 . . . . 0.0 111.283 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -57.02 -43.79 82.21 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.386 1.074 . . . . 0.0 108.978 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -64.66 -54.32 33.63 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.791 0.837 . . . . 0.0 109.3 178.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.0 tt0 . . . . . 0 CA--C 1.529 0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 112.675 -178.562 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.541 0.614 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -102.22 128.91 48.54 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.63 160.87 13.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.165 1.386 . . . . 0.0 109.453 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . 0.496 HD23 ' H ' ' D' 1102 ' ' GLN . 0.5 OUTLIER -152.8 152.67 31.87 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.409 -1.432 . . . . 0.0 107.893 176.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . 0.496 ' H ' HD23 ' D' 1101 ' ' LEU . 1.1 tm0? -151.39 98.0 2.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.779 1.232 . . . . 0.0 109.032 -177.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 55.2 t -148.73 149.65 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.983 1.713 . . . . 0.0 108.35 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -118.94 102.06 8.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.403 1.456 . . . . 0.0 112.606 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.37 124.93 2.42 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 107.164 -2.374 . . . . 0.0 107.164 176.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -67.3 -57.15 7.18 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 120.641 2.22 . . . . 0.0 110.979 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.58 -47.98 83.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.84 -50.52 63.57 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.482 1.513 . . . . 0.0 112.402 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 66.7 t80 -64.31 -48.01 77.24 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.17 -178.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.84 -53.03 54.61 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.022 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.98 -57.95 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 125.474 1.51 . . . . 0.0 110.597 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.24 -40.05 88.89 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.9 -1.048 . . . . 0.0 111.551 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.5 tmt? -64.1 -48.9 74.33 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 120.418 1.463 . . . . 0.0 109.726 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 14.3 ttmm -53.47 -51.89 61.28 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.492 0.717 . . . . 0.0 109.205 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 40.0 mt -62.7 -42.06 99.44 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.407 1.083 . . . . 0.0 111.57 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . 0.576 ' HE3' HG11 ' B' ' 103' ' ' VAL . 39.0 tptt -59.77 -53.3 59.55 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.748 1.219 . . . . 0.0 110.798 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -59.54 -51.38 70.07 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.385 1.474 . . . . 0.0 109.491 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.5 m -54.76 -44.61 73.78 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.09 0.956 . . . . 0.0 112.179 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -36.74 77.94 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.265 0.484 . . . . 0.0 110.988 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.65 -41.29 92.75 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.399 1.0 . . . . 0.0 109.127 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.72 -52.25 58.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.805 1.242 . . . . 0.0 110.376 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.5 -19.87 65.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.235 0.471 . . . . 0.0 111.75 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -79.64 -39.16 32.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.857 1.208 . . . . 0.0 109.065 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -75.62 -28.9 59.01 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 118.245 -0.883 . . . . 0.0 112.61 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.91 147.39 33.87 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.781 0.832 . . . . 0.0 110.057 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.45 -176.53 2.54 Favored 'Trans proline' 0 CA--C 1.547 1.14 0 C-N-CA 123.314 2.676 . . . . 0.0 110.496 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -104.22 40.94 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.256 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.84 -56.76 0.23 Allowed 'Trans proline' 0 C--N 1.355 0.875 0 CA-C-N 124.34 2.586 . . . . 0.0 113.096 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.57 -44.63 90.09 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.193 0.906 . . . . 0.0 108.824 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 t -53.07 -53.46 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 125.544 1.538 . . . . 0.0 110.504 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 7.4 t70 -63.53 -38.51 91.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.154 0.888 . . . . 0.0 111.44 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 21.5 t -62.89 -50.09 72.25 Favored 'General case' 0 N--CA 1.457 -0.119 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -62.14 -42.57 99.37 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -48.02 73.66 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.62 0.768 . . . . 0.0 110.011 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -69.66 -47.79 62.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.175 0.898 . . . . 0.0 110.672 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -55.7 -40.44 72.4 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.814 1.246 . . . . 0.0 111.231 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -80.64 -33.77 35.47 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.058 1.743 . . . . 0.0 110.611 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -60.5 -30.89 70.0 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.483 1.038 . . . . 0.0 108.671 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.3 -20.48 59.34 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.441 0.564 . . . . 0.0 111.956 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.539 0.543 0 C-N-CA 124.956 1.302 . . . . 0.0 112.014 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 CA--C 1.548 0.879 0 CA-C-O 120.878 0.371 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -81.53 101.54 10.01 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.18 -1.575 . . . . 0.0 107.002 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.64 168.79 11.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.711 1.205 . . . . 0.0 108.602 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -133.26 138.28 46.39 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.919 1.288 . . . . 0.0 108.653 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.8 90.43 48.37 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 124.823 1.249 . . . . 0.0 111.966 -178.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.74 112.39 2.66 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 124.5 3.467 . . . . 0.0 111.806 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.7 t -144.71 152.96 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.554 1.141 . . . . 0.0 108.501 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -135.18 100.88 4.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.67 1.123 . . . . 0.0 108.858 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.99 124.21 1.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-O 116.343 -2.365 . . . . 0.0 107.356 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -66.16 -51.09 61.11 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 121.399 2.6 . . . . 0.0 110.055 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.02 -41.65 92.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.202 1.001 . . . . 0.0 111.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -64.81 -50.0 68.47 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.125 1.37 . . . . 0.0 108.692 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -56.92 -51.82 67.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.643 -0.694 . . . . 0.0 111.028 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -55.3 -54.87 38.05 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 124.159 0.912 . . . . 0.0 111.942 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.434 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 37.6 ttm -59.55 -50.45 73.85 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.488 0.315 . . . . 0.0 111.391 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.82 -41.69 91.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.854 0.862 . . . . 0.0 110.813 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 tt -68.05 -45.72 73.1 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.46 -40.16 81.91 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.949 0.795 . . . . 0.0 111.512 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mt -72.77 -43.64 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -59.26 -46.23 89.06 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.545 -0.722 . . . . 0.0 109.316 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -56.03 -55.21 35.57 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.935 1.694 . . . . 0.0 109.65 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 p -64.18 -44.32 92.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.04 -47.88 84.34 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 118.669 0.668 . . . . 0.0 109.88 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -62.13 -43.57 98.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.502 HD21 HG22 ' B' ' 130' ' ' VAL . 0.6 OUTLIER -55.02 -49.92 70.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 118.733 0.697 . . . . 0.0 111.324 -179.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.0 ttm -57.4 -37.17 72.29 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.72 -34.55 64.85 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.022 -1.049 . . . . 0.0 111.628 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.43 ' C ' HD22 ' A' ' 32' ' ' LEU . 32.0 m-85 -77.07 -30.85 55.71 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.606 1.094 . . . . 0.0 110.894 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.43 HD22 ' C ' ' A' ' 31' ' ' TYR . 2.6 mm? . . . . . 0 CA--C 1.539 0.532 0 C-N-CA 126.68 1.992 . . . . 0.0 107.896 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 m -61.73 -45.54 93.5 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.086 -1.008 . . . . 0.0 109.359 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 9.1 mm -63.47 -41.07 91.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 123.837 0.855 . . . . 0.0 110.578 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.9 -36.92 78.01 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.609 1.564 . . . . 0.0 109.726 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.5 m -68.52 -52.39 32.66 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -60.36 -36.07 77.16 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.309 1.044 . . . . 0.0 111.55 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -48.96 76.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.684 1.194 . . . . 0.0 108.712 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -67.22 -55.88 12.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 118.499 -0.762 . . . . 0.0 111.205 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.92 -54.76 34.28 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.425 1.09 . . . . 0.0 111.576 -178.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.39 -39.55 93.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.516 -0.754 . . . . 0.0 111.373 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -64.02 -49.81 70.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.833 0.742 . . . . 0.0 109.347 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 . . . . . 0 CA--C 1.531 0.233 0 CA-C-N 118.798 0.726 . . . . 0.0 110.03 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 96.8 m . . . . . 0 N--CA 1.449 -0.51 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -102.1 150.93 22.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -123.56 137.14 54.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.52 1.128 . . . . 0.0 109.777 -177.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 19.7 tp -139.68 149.83 44.16 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 123.387 0.675 . . . . 0.0 110.805 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -145.68 108.29 4.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.367 -2.457 . . . . 0.0 104.367 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 m -149.66 150.67 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.804 1.184 . . . . 0.0 112.153 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.42 102.14 10.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.67 114.42 0.82 Allowed Glycine 0 C--O 1.227 -0.316 0 CA-C-O 116.006 -2.552 . . . . 0.0 109.873 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -68.05 -57.44 6.12 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 122.489 3.144 . . . . 0.0 108.404 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -70.3 -49.88 45.06 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.14 -51.32 58.65 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.059 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -67.12 -36.52 82.08 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.958 1.254 . . . . 0.0 111.682 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -60.71 -54.14 48.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 120.003 1.274 . . . . 0.0 110.768 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.77 -51.08 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 125.745 1.618 . . . . 0.0 110.611 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.3 mt -60.41 -33.88 73.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.718 -179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -45.92 70.21 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.771 1.623 . . . . 0.0 108.212 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . 0.45 ' HE3' ' HE2' ' C' 1018 ' ' MET . 29.1 ttpt -55.83 -49.49 73.13 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 30.7 mt -60.43 -36.34 77.96 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-O 119.009 -0.52 . . . . 0.0 110.97 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -59.99 4.46 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 119.477 1.035 . . . . 0.0 109.149 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -62.05 -43.81 98.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.619 -0.705 . . . . 0.0 111.423 -178.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 4.1 t -58.05 -45.29 87.27 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.405 1.002 . . . . 0.0 111.501 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -69.56 -46.34 66.63 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 117.846 -1.073 . . . . 0.0 109.679 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -57.01 -49.34 76.09 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.051 0.841 . . . . 0.0 109.939 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.51 -50.72 72.75 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 123.808 0.843 . . . . 0.0 110.726 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -69.6 -18.87 63.65 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -83.57 -47.38 11.36 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.034 1.334 . . . . 0.0 108.976 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.79 -32.67 72.56 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.699 -179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 77.6 t -92.76 144.51 28.71 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -67.61 -176.76 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.08 2.52 . . . . 0.0 111.274 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -111.5 48.37 0.29 Allowed Pre-proline 0 CA--C 1.551 1.0 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.93 -57.46 0.13 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.251 1.967 . . . . 0.0 113.782 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.7 tt -63.38 -31.96 73.26 Favored 'General case' 0 C--N 1.349 0.546 0 O-C-N 120.627 -1.296 . . . . 0.0 110.952 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.502 HG22 HD21 ' A' ' 28' ' ' LEU . 3.0 t -51.8 -56.78 4.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 C-N-CA 124.226 1.01 . . . . 0.0 111.943 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -73.9 -31.49 63.12 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.406 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.2 m -61.06 -47.88 84.32 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 122.398 1.094 . . . . 0.0 108.088 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -66.98 -38.36 85.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.466 1.506 . . . . 0.0 108.409 178.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -46.99 84.37 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.96 0.904 . . . . 0.0 109.188 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -59.03 -46.41 88.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -44.66 89.04 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.41 0.684 . . . . 0.0 110.906 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -35.36 73.71 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.169 0.987 . . . . 0.0 110.076 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -56.21 -40.31 73.85 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.2 -18.29 63.34 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.562 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp . . . . . 0 C--N 1.342 0.252 0 CA-C-N 119.904 1.229 . . . . 0.0 110.154 179.763 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 120.831 0.348 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 33.7 tp -76.54 95.49 3.91 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 103.968 -2.605 . . . . 0.0 103.968 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 58.4 mt -89.54 124.64 34.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 124.35 1.06 . . . . 0.0 108.222 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -104.57 125.93 51.18 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 128.917 2.887 . . . . 0.0 108.1 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.95 92.01 19.75 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.244 1.417 . . . . 0.0 109.641 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.24 118.17 4.86 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.648 2.232 . . . . 0.0 107.501 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 22.0 t -145.15 155.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 119.706 1.139 . . . . 0.0 109.978 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -134.98 102.58 5.27 Favored 'General case' 0 C--N 1.343 0.312 0 O-C-N 121.214 -0.929 . . . . 0.0 109.134 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.37 116.83 0.7 Allowed Glycine 0 CA--C 1.519 0.31 0 CA-C-O 115.496 -2.836 . . . . 0.0 107.001 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.4 tpp85 -61.98 -51.82 66.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.697 2.749 . . . . 0.0 111.976 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -69.2 -41.07 77.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.868 0.758 . . . . 0.0 109.502 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -55.47 -46.49 76.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.3 t80 -65.57 -47.93 74.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.54 0.736 . . . . 0.0 109.998 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -53.18 -50.71 64.07 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.774 1.23 . . . . 0.0 110.69 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . 0.45 ' HE2' ' HE3' ' B' ' 114' ' ' LYS . 3.1 tmm? -69.33 -43.16 74.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.314 0.646 . . . . 0.0 111.41 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.12 -46.55 89.26 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.735 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.25 -46.33 81.01 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 119.268 0.94 . . . . 0.0 111.612 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -54.98 -44.46 74.47 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.111 0.868 . . . . 0.0 110.335 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.5 mt -72.63 -44.11 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.839 1.256 . . . . 0.0 111.166 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -57.77 -49.08 77.78 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.847 0.859 . . . . 0.0 109.34 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.25 -45.45 80.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.305 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.7 p -61.08 -40.6 94.3 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 120.328 1.422 . . . . 0.0 111.536 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 64.4 mt -67.87 -46.32 72.02 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.124 0.97 . . . . 0.0 109.471 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.18 -44.18 97.18 Favored 'General case' 0 C--O 1.224 -0.264 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . 0.525 HD13 HD23 ' C' 1032 ' ' LEU . 1.4 mm? -57.95 -44.3 86.88 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 119.12 0.873 . . . . 0.0 110.515 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 4.6 ttm -57.19 -36.07 70.37 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -76.96 -37.17 55.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.365 -1.302 . . . . 0.0 111.669 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . 0.468 ' C ' HD22 ' C' 1032 ' ' LEU . 52.5 m-85 -83.1 -19.59 36.47 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 120.942 1.701 . . . . 0.0 113.667 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . 0.525 HD23 HD13 ' C' 1028 ' ' LEU . 1.9 mm? . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.18 -43.18 96.08 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.126 -0.984 . . . . 0.0 110.373 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 13.0 mm -63.93 -34.33 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.369 1.068 . . . . 0.0 109.808 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -69.56 -44.34 71.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.246 1.018 . . . . 0.0 108.892 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.3 m -62.94 -46.74 86.32 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.1 t80 -59.24 -50.36 74.29 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.247 1.419 . . . . 0.0 111.226 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 tpp85 -56.43 -48.48 76.91 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.923 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -57.26 -55.73 31.03 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.313 0.96 . . . . 0.0 109.585 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.96 -54.36 39.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.846 1.259 . . . . 0.0 112.968 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -65.23 -47.01 78.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.118 1.367 . . . . 0.0 111.592 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -56.62 -47.17 80.26 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.589 1.156 . . . . 0.0 108.231 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 . . . . . 0 N--CA 1.453 -0.319 0 C-N-CA 124.576 1.15 . . . . 0.0 110.471 178.869 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -131.4 158.33 41.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.846 1.258 . . . . 0.0 109.069 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -124.44 160.58 27.9 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.152 1.381 . . . . 0.0 110.352 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 13.4 tp -159.88 139.01 10.93 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.585 1.154 . . . . 0.0 108.496 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -138.97 98.07 3.45 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 30.4 m -145.45 151.72 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 O-C-N 120.683 -1.26 . . . . 0.0 114.254 -176.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.14 103.48 12.69 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.45 100.56 0.24 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 103.661 -3.776 . . . . 0.0 103.661 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -61.82 -57.49 11.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 122.474 3.137 . . . . 0.0 112.803 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 6.5 mttp -66.34 -38.73 88.33 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.376 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.5 m120 -59.39 -51.76 68.51 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.67 -1.157 . . . . 0.0 111.36 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . 0.413 ' CZ ' ' HG3' ' D' 1113 ' ' MET . 84.2 t80 -60.84 -42.1 97.13 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 120.247 1.385 . . . . 0.0 110.333 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.45 -53.71 52.9 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.469 0.652 . . . . 0.0 110.068 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.96 -54.04 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 125.562 1.545 . . . . 0.0 110.607 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.11 -38.86 74.02 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.488 1.515 . . . . 0.0 111.186 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . 0.413 ' HG3' ' CZ ' ' D' 1109 ' ' PHE . 0.0 OUTLIER -71.74 -43.99 64.86 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.213 1.369 . . . . 0.0 109.577 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . 0.434 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 8.8 ttpt -56.9 -44.74 82.66 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 68.9 mt -63.46 -36.09 82.6 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.869 0.868 . . . . 0.0 111.248 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -60.03 4.47 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.215 -0.928 . . . . 0.0 108.68 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -64.4 -29.37 70.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.368 0.267 . . . . 0.0 111.081 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 17.8 t -64.45 -47.68 78.17 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.842 0.747 . . . . 0.0 110.088 178.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.51 -44.3 58.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 116.959 -1.496 . . . . 0.0 111.979 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -59.28 -41.24 88.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.952 1.705 . . . . 0.0 110.827 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.1 mm? -66.33 -50.6 63.04 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 3.5 ttt -61.76 -27.4 68.7 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.31 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -78.6 -37.07 43.33 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.345 1.458 . . . . 0.0 111.773 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -79.43 -27.9 41.71 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 118.362 -0.828 . . . . 0.0 112.257 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.25 147.14 33.98 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 118.735 0.698 . . . . 0.0 109.988 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.92 -175.16 0.55 Allowed 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.243 2.629 . . . . 0.0 109.378 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.272 7.2 pt20 -111.63 51.18 0.34 Allowed Pre-proline 0 CA--C 1.557 1.232 0 O-C-N 120.039 -1.663 . . . . 0.0 114.425 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.42 -65.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.462 2.775 . . . . 0.0 113.127 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.15 -30.43 71.49 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.708 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -58.92 -55.79 21.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.814 1.246 . . . . 0.0 110.367 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 45.2 t0 -63.63 -40.71 97.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.649 0.659 . . . . 0.0 110.483 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 19.9 m -60.13 -50.4 73.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.327 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.7 t80 -62.96 -42.92 99.97 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.89 1.276 . . . . 0.0 110.39 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -45.61 70.44 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -69.03 -52.88 24.02 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.577 0.751 . . . . 0.0 110.512 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -50.47 -47.51 57.04 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.027 1.731 . . . . 0.0 111.183 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.72 -38.99 62.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.547 1.139 . . . . 0.0 109.281 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.5 -32.39 39.92 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.495 1.043 . . . . 0.0 110.882 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -56.98 -23.55 46.72 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 118.684 0.675 . . . . 0.0 112.171 177.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 32.2 tp . . . . . 0 N--CA 1.467 0.397 0 CA-C-N 120.485 1.493 . . . . 0.0 112.898 -179.767 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 110.582 -0.155 . . . . 0.0 110.582 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.3 tp -79.38 95.24 5.69 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.1 mt -95.52 140.73 29.94 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -112.21 144.11 42.15 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.774 1.63 . . . . 0.0 107.902 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.4 tp -130.39 94.04 30.99 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 124.596 1.158 . . . . 0.0 109.546 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -78.58 121.26 5.07 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 109.356 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.4 t -144.78 156.08 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.03 1.286 . . . . 0.0 108.719 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -133.03 102.17 5.5 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.99 110.58 0.41 Allowed Glycine 0 C--O 1.219 -0.84 0 CA-C-O 115.839 -2.645 . . . . 0.0 107.526 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.32 65.29 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 122.94 3.37 . . . . 0.0 109.1 178.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -67.05 -46.84 73.14 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -36.85 84.8 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.925 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -71.11 -43.9 66.73 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 120.189 1.359 . . . . 0.0 108.672 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.14 -49.8 76.21 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.511 1.051 . . . . 0.0 109.308 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.4 ttp -57.22 -46.77 82.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.882 0.473 . . . . 0.0 109.82 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.54 -38.97 93.17 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 123.921 0.888 . . . . 0.0 110.027 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.37 -47.13 71.29 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 119.297 0.953 . . . . 0.0 109.718 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -48.95 74.01 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.582 0.753 . . . . 0.0 110.501 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.3 mt -73.01 -33.45 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.185 0.994 . . . . 0.0 110.957 -178.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -67.58 -56.9 7.62 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.57 -38.94 72.64 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.058 2.143 . . . . 0.0 110.426 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -61.19 -52.52 64.48 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.405 -0.807 . . . . 0.0 110.838 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -39.27 61.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.012 0.824 . . . . 0.0 111.851 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.79 -54.47 46.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.827 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.21 -41.45 77.05 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 117.97 -1.015 . . . . 0.0 110.264 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -57.86 -38.99 76.68 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.247 0.931 . . . . 0.0 110.668 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -79.53 -20.63 46.66 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.328 0.513 . . . . 0.0 110.119 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -82.59 -39.56 22.06 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.984 -1.072 . . . . 0.0 112.103 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.3 tp . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.876 1.67 . . . . 0.0 109.933 -179.285 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 80.4 m80 . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.5 m -54.8 -51.16 66.65 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.165 2.186 . . . . 0.0 109.031 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.48 -45.87 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 125.607 1.563 . . . . 0.0 109.733 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.97 -55.6 32.06 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.817 0.447 . . . . 0.0 111.845 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -62.0 -43.01 99.74 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.42 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -58.02 -49.55 76.48 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 119.494 1.043 . . . . 0.0 108.9 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.97 -48.2 82.69 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.193 1.397 . . . . 0.0 111.725 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -59.85 -56.55 20.36 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.477 1.111 . . . . 0.0 110.091 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -58.48 -43.95 89.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.155 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -52.86 -46.75 68.01 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.163 0.985 . . . . 0.0 111.95 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.12 -53.9 38.11 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.009 0.524 . . . . 0.0 111.016 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 121.011 0.434 . . . . 0.0 110.84 -179.472 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.7 m . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -106.03 150.68 25.51 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -128.58 140.15 51.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.511 1.125 . . . . 0.0 110.718 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.5 mt -133.21 110.12 9.9 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -110.29 98.59 7.8 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 128.503 2.721 . . . . 0.0 105.808 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -154.41 151.17 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.226 1.41 . . . . 0.0 109.012 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.33 101.27 7.27 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.685 0.675 . . . . 0.0 110.813 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.19 105.42 0.39 Allowed Glycine 0 C--O 1.228 -0.28 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -53.79 -54.15 42.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 121.586 2.693 . . . . 0.0 112.918 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.89 -40.65 89.45 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.868 0.758 . . . . 0.0 109.854 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -60.18 -50.58 73.13 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.154 -0.926 . . . . 0.0 110.539 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . 0.415 ' CD2' ' HB3' ' D' 1099 ' ' TYR . 31.8 t80 -54.33 -46.04 72.8 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 119.256 0.935 . . . . 0.0 111.194 -178.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -61.74 -53.74 51.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.34 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 45.2 mt -58.05 -52.54 57.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.985 1.714 . . . . 0.0 110.543 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 73.6 mt -65.76 -32.28 73.73 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.154 1.381 . . . . 0.0 111.885 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 24.3 mtp -68.24 -54.56 16.85 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.85 1.205 . . . . 0.0 109.433 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -60.71 -35.95 77.62 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.674 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.95 -54.77 11.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 117.836 -1.078 . . . . 0.0 110.697 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 5.3 tptp -58.16 -40.83 82.42 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 121.059 1.754 . . . . 0.0 110.018 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.5 -58.53 7.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 126.322 1.849 . . . . 0.0 106.39 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 90.2 p -57.68 -36.16 71.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.3 -42.77 65.11 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.17 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -64.84 -40.03 94.52 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.012 1.278 . . . . 0.0 107.583 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 44.6 mt -64.24 -46.16 85.0 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.026 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -71.2 -19.08 62.43 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.312 0.96 . . . . 0.0 110.7 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -89.08 -42.79 11.51 Favored 'General case' 0 C--N 1.343 0.323 0 O-C-N 121.01 -1.056 . . . . 0.0 113.225 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -76.3 -33.01 59.07 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.0 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -95.5 147.56 33.2 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 178.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -71.68 177.89 6.36 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.508 1.472 . . . . 0.0 110.382 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -112.17 50.85 0.37 Allowed Pre-proline 0 CA--C 1.554 1.099 0 O-C-N 121.08 -1.013 . . . . 0.0 112.389 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.37 -57.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.732 2.288 . . . . 0.0 113.292 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.2 tt -65.33 -33.52 76.16 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 119.992 1.269 . . . . 0.0 109.206 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 40.2 t -54.36 -56.33 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.851 1.661 . . . . 0.0 109.228 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.59 -47.35 85.88 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.81 0.844 . . . . 0.0 111.233 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 30.1 t -54.75 -50.78 67.58 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 0.0 110.442 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -68.55 -44.08 75.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.87 1.268 . . . . 0.0 111.019 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -54.96 -46.0 74.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 118.822 0.737 . . . . 0.0 109.729 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -65.81 -49.63 67.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.448 0.567 . . . . 0.0 110.917 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -57.28 -44.77 84.29 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.229 0.612 . . . . 0.0 111.673 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.69 -29.82 61.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.882 0.873 . . . . 0.0 109.547 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -61.75 -32.83 73.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -6.0 3.62 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.07 1.348 . . . . 0.0 113.021 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.468 0.448 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.902 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.5 tp10 . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 110.894 -0.039 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 67.2 tp -78.47 95.21 5.08 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 42.8 mt -90.52 153.75 20.13 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -123.29 142.31 51.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.584 1.154 . . . . 0.0 108.921 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 41.7 tp -134.11 94.89 17.43 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.11 0.964 . . . . 0.0 111.182 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.18 130.03 9.05 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.432 2.755 . . . . 0.0 109.964 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 2.4 t -145.78 152.04 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.602 1.161 . . . . 0.0 108.478 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -134.91 101.83 5.03 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 177.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.57 117.01 0.7 Allowed Glycine 0 CA--C 1.519 0.328 0 N-CA-C 105.402 -3.079 . . . . 0.0 105.402 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -52.41 58.85 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 122.067 2.934 . . . . 0.0 110.968 -179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.95 -41.14 78.43 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 54.0 m -58.27 -48.03 81.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 118.316 -0.849 . . . . 0.0 109.964 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.4 t80 -58.54 -50.59 73.21 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 119.147 0.885 . . . . 0.0 110.145 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.0 -48.8 78.72 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 ttt -58.69 -49.34 77.93 Favored 'General case' 0 N--CA 1.46 0.066 0 C-N-CA 124.754 1.222 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.86 -50.28 73.85 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.385 1.074 . . . . 0.0 109.132 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -55.86 28.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.011 0.924 . . . . 0.0 111.15 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -55.6 -48.52 74.75 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.676 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 76.7 mt -67.0 -43.93 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.669 -0.644 . . . . 0.0 111.176 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.16 -52.28 59.77 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 123.786 0.835 . . . . 0.0 111.539 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -66.92 -35.11 79.25 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.258 1.023 . . . . 0.0 110.044 -179.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 4.8 t -56.05 -51.77 66.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -48.27 80.17 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 123.193 0.308 . . . . 0.0 110.663 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -57.06 -54.62 44.68 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.51 0.724 . . . . 0.0 111.989 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.43 -41.4 84.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 119.342 0.974 . . . . 0.0 112.344 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -44.6 92.8 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 -22.99 46.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.733 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 t80 -79.14 -33.45 44.16 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.117 1.326 . . . . 0.0 111.311 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 49.8 tp . . . . . 0 CA--C 1.536 0.405 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 179.427 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 38.3 m80 . . . . . 0 CA--C 1.533 0.293 0 CA-C-O 118.554 -0.736 . . . . 0.0 112.934 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.6 m -61.27 -49.39 77.27 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 120.117 1.326 . . . . 0.0 109.451 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . 0.608 ' H ' HD12 ' C' 1037 ' ' ILE . 2.2 mp -59.21 -42.95 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 126.342 1.857 . . . . 0.0 109.526 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.73 -59.41 4.93 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.676 1.19 . . . . 0.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.3 m -60.1 -52.74 64.05 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.153 1.381 . . . . 0.0 111.897 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.27 -50.33 69.8 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.466 0.706 . . . . 0.0 112.37 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -61.13 -44.7 96.94 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 118.887 0.767 . . . . 0.0 111.641 -179.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -61.93 -48.91 78.32 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -64.55 -36.24 83.56 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-O 116.984 -1.484 . . . . 0.0 111.127 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -60.46 -42.33 95.95 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 120.92 1.691 . . . . 0.0 108.239 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -47.6 84.89 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 118.997 0.817 . . . . 0.0 110.598 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 3.4 tp60 . . . . . 0 CA--C 1.542 0.661 0 O-C-N 123.41 0.444 . . . . 0.0 110.647 -179.836 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 80.6 m . . . . . 0 C--O 1.235 0.311 0 CA-C-O 121.265 0.555 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . 0.415 ' HB3' ' CD2' ' B' ' 109' ' ' PHE . 67.8 m-85 -120.38 143.12 48.59 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -126.83 142.94 51.41 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.777 1.231 . . . . 0.0 110.677 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 90.4 mt -129.86 140.97 50.89 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -136.87 98.44 3.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.423 1.077 . . . . 0.0 108.117 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.6 m -153.19 151.51 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.944 1.298 . . . . 0.0 111.671 -177.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.33 102.79 10.18 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.374 0.988 . . . . 0.0 111.604 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.25 116.81 0.99 Allowed Glycine 0 C--O 1.229 -0.168 0 CA-C-O 115.636 -2.758 . . . . 0.0 107.886 177.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.78 -56.93 11.81 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 122.521 3.16 . . . . 0.0 111.592 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.84 -43.8 97.83 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 14.7 m120 -54.13 -47.88 71.39 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 117.671 -1.156 . . . . 0.0 112.038 -178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.1 t80 -64.5 -46.25 83.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.524 1.056 . . . . 0.0 109.856 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.98 -52.39 65.7 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.537 1.062 . . . . 0.0 111.408 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.16 -48.61 84.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 126.971 2.108 . . . . 0.0 111.825 -178.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 53.8 mt -67.72 -36.14 80.06 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.901 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 68.8 mtp -65.45 -53.2 46.32 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 119.999 1.272 . . . . 0.0 109.729 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -56.37 -40.72 75.01 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.359 0.981 . . . . 0.0 111.276 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 38.6 mt -74.24 -41.0 62.03 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . 0.568 ' HZ1' ' HG2' ' D' 1120 ' ' GLU . 3.1 tptp -65.7 -43.44 89.17 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.476 -1.39 . . . . 0.0 107.941 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -59.47 -52.86 63.76 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.482 1.513 . . . . 0.0 108.021 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 84.2 p -60.6 -34.64 74.53 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.008 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . 0.42 HD13 ' HA ' ' D' 1119 ' ' LEU . 0.8 OUTLIER -69.07 -36.98 78.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.233 0.924 . . . . 0.0 109.489 179.035 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . 0.568 ' HG2' ' HZ1' ' D' 1116 ' ' LYS . 0.6 OUTLIER -64.71 -52.48 56.9 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.238 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 43.3 mt -57.8 -47.12 83.49 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.135 1.774 . . . . 0.0 112.122 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.0 ppp? -76.49 -24.61 53.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 120.074 1.306 . . . . 0.0 112.749 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -80.44 -42.9 21.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.115 0.87 . . . . 0.0 110.049 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.3 -32.24 38.07 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -178.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.77 149.07 35.86 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.766 1.226 . . . . 0.0 107.916 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -65.36 167.95 15.52 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 121.339 1.359 . . . . 0.0 110.954 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -118.79 57.05 3.1 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 124.507 1.123 . . . . 0.0 113.113 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -70.51 -64.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.25 2.633 . . . . 0.0 112.826 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.7 tt -58.81 -33.78 70.76 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.868 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.8 t -52.2 -53.52 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 C-N-CA 124.154 0.982 . . . . 0.0 110.054 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 35.5 t0 -70.52 -41.17 72.91 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.202 0.91 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 14.5 t -54.82 -49.82 70.07 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.16 -49.72 63.73 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.423 1.489 . . . . 0.0 109.8 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -53.53 -45.91 69.96 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.216 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.67 -49.18 69.55 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 120.525 1.511 . . . . 0.0 110.236 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -52.03 -49.26 63.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.125 1.37 . . . . 0.0 109.242 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -39.68 75.24 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 127.138 2.175 . . . . 0.0 111.173 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -59.94 -28.09 67.33 Favored 'General case' 0 N--CA 1.462 0.156 0 O-C-N 120.988 -1.07 . . . . 0.0 109.651 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -19.71 47.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.506 0.722 . . . . 0.0 111.076 177.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.1 tt . . . . . 0 CA--C 1.53 0.194 0 C-N-CA 125.17 1.388 . . . . 0.0 110.332 179.359 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 CA--C 1.521 -0.149 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -66.19 96.43 0.34 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.785 1.634 . . . . 0.0 109.121 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.88 143.73 26.69 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -103.79 100.69 10.5 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 30.7 tp -92.11 107.36 22.48 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 128.468 2.707 . . . . 0.0 108.217 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -85.16 129.68 3.88 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.218 2.612 . . . . 0.0 110.767 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 t -145.43 150.62 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.92 1.236 . . . . 0.0 110.867 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -136.43 102.24 4.9 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.95 128.1 1.63 Allowed Glycine 0 N--CA 1.459 0.208 0 CA-C-O 114.845 -3.197 . . . . 0.0 107.765 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -52.97 17.64 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 122.791 3.295 . . . . 0.0 109.898 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.35 -33.79 76.51 Favored 'General case' 0 C--N 1.343 0.29 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 m -60.48 -50.26 74.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.287 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.95 -46.42 87.81 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.217 -178.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -59.24 -52.37 65.95 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.413 0.551 . . . . 0.0 111.067 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 34.6 ttm -59.12 -52.0 67.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.245 1.018 . . . . 0.0 109.215 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.7 mp -60.8 -30.72 70.23 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.78 0.718 . . . . 0.0 111.015 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -55.77 7.74 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 119.197 0.908 . . . . 0.0 108.849 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.14 -39.04 92.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -178.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.478 HG23 HD22 ' B' ' 115' ' ' LEU . 29.4 mt -62.13 -47.6 92.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 178.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.41 -58.04 9.82 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -51.97 -39.29 59.1 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.358 1.863 . . . . 0.0 113.386 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 p -69.02 -51.16 42.12 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.675 0.671 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 tt -62.83 -50.65 70.14 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 124.614 1.166 . . . . 0.0 111.553 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.91 -53.99 48.34 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.33 1.052 . . . . 0.0 110.79 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.34 -35.81 76.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.562 0.619 . . . . 0.0 111.365 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -27.03 68.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.509 1.05 . . . . 0.0 110.529 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -92.77 -28.26 16.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.791 -0.568 . . . . 0.0 109.848 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -75.46 -29.92 59.78 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.145 0.884 . . . . 0.0 110.65 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 tm? . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.677 1.591 . . . . 0.0 107.771 179.921 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.2 m80 . . . . . 0 CA--C 1.53 0.192 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.0 m -59.3 -45.15 92.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.614 1.097 . . . . 0.0 110.106 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.47 -49.66 82.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 C-N-CA 125.384 1.474 . . . . 0.0 108.148 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.34 -41.57 96.71 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.2 m -60.88 -50.22 74.29 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.11 -43.16 77.87 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.627 0.771 . . . . 0.0 110.287 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -49.38 78.01 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.86 -0.525 . . . . 0.0 110.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -65.52 -50.39 65.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.948 0.899 . . . . 0.0 110.899 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -54.93 36.82 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.543 1.137 . . . . 0.0 110.596 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? -64.91 -32.9 74.84 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.886 1.221 . . . . 0.0 112.734 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.47 -47.77 74.93 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 118.762 0.71 . . . . 0.0 109.159 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 . . . . . 0 N--CA 1.451 -0.424 0 C-N-CA 124.434 1.094 . . . . 0.0 109.502 -179.853 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.467 0.384 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -109.8 140.03 44.18 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.42 145.94 49.84 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 127.466 2.306 . . . . 0.0 107.867 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.633 HD22 ' HE2' ' D' 1116 ' ' LYS . 50.0 mt -147.94 150.16 33.54 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.772 0.829 . . . . 0.0 109.052 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.02 107.63 4.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.524 -1.227 . . . . 0.0 110.43 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.9 t -155.13 144.82 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 119.879 1.218 . . . . 0.0 109.374 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.06 103.85 15.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -141.38 112.75 0.79 Allowed Glycine 0 C--O 1.227 -0.307 0 N-CA-C 106.985 -2.446 . . . . 0.0 106.985 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 46.3 tpt85 -65.22 -59.21 4.32 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.991 2.396 . . . . 0.0 112.068 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -71.67 -42.02 68.0 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.16 -50.81 61.07 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 125.639 1.576 . . . . 0.0 110.468 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.31 -41.04 85.99 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.822 1.192 . . . . 0.0 110.322 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.85 -52.44 62.78 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.491 1.042 . . . . 0.0 109.134 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 56.2 mt -57.08 -57.88 8.14 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 C-N-CA 127.205 2.202 . . . . 0.0 110.118 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 mp -55.26 -54.01 48.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.571 1.148 . . . . 0.0 110.869 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 7.3 ttp -59.84 -45.12 93.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.356 0.98 . . . . 0.0 111.417 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -56.31 -52.43 64.55 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.897 0.879 . . . . 0.0 109.934 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.478 HD22 HG23 ' A' ' 22' ' ' ILE . 78.4 mt -70.49 -30.0 66.68 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . 0.463 ' HD2' HG21 ' D' 1103 ' ' VAL . 29.3 ttpp -58.81 -60.04 4.48 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.43 -45.27 80.84 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 124.201 0.938 . . . . 0.0 110.688 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 66.7 m -60.48 -44.06 96.32 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 118.034 -0.984 . . . . 0.0 113.389 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -38.21 63.01 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.894 1.224 . . . . 0.0 109.458 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -55.35 -52.81 62.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.798 0.808 . . . . 0.0 109.396 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.08 -42.41 94.13 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.452 -1.261 . . . . 0.0 109.288 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.52 -31.08 70.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.338 0.972 . . . . 0.0 111.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -77.09 -40.02 47.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.828 0.74 . . . . 0.0 110.013 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 26.7 tp -76.61 -22.46 54.15 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 33.3 m -94.5 147.61 33.54 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 119.848 1.203 . . . . 0.0 109.334 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.54 177.4 7.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 121.883 1.722 . . . . 0.0 108.639 178.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -112.09 56.58 0.47 Allowed Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 121.056 -1.028 . . . . 0.0 113.013 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.5 -72.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.584 2.19 . . . . 0.0 110.544 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.17 -36.91 85.18 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.8 t -54.29 -56.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 125.029 1.331 . . . . 0.0 111.597 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.18 -44.94 90.46 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.161 1.346 . . . . 0.0 111.497 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 17.4 t -57.83 -47.0 83.89 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -68.25 -35.63 78.21 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.235 1.414 . . . . 0.0 109.684 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 23.0 ttm-85 -55.46 -48.95 73.71 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.229 1.377 . . . . 0.0 108.834 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -69.72 -51.64 32.51 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.905 0.882 . . . . 0.0 111.631 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -51.11 -49.07 61.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.861 0.864 . . . . 0.0 110.068 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.26 -37.54 71.94 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.527 1.131 . . . . 0.0 110.579 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -57.13 -27.62 61.99 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.172 0.989 . . . . 0.0 110.6 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.25 -12.97 57.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.778 0.717 . . . . 0.0 112.186 177.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.539 0.541 0 O-C-N 120.943 -1.098 . . . . 0.0 111.045 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 7.6 tt -79.37 98.88 6.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.147 1.379 . . . . 0.0 108.528 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.2 mt -87.64 152.74 21.93 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 126.125 1.77 . . . . 0.0 107.138 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -115.15 100.07 7.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 23.6 tp -82.04 108.57 11.84 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.455 1.502 . . . . 0.0 108.932 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -93.74 103.43 0.14 Allowed 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 124.772 3.648 . . . . 0.0 110.923 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 68.0 t -136.39 159.18 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 120.759 -1.213 . . . . 0.0 110.641 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -135.52 102.2 5.05 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.51 130.97 2.22 Favored Glycine 0 CA--C 1.517 0.176 0 CA-C-O 115.538 -2.812 . . . . 0.0 109.23 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -70.12 -52.68 21.77 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 121.351 2.576 . . . . 0.0 108.636 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.33 -34.93 78.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.199 0.599 . . . . 0.0 109.825 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.7 m -65.95 -47.98 72.85 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 89.9 t80 -64.33 -49.48 71.54 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.843 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -55.46 -53.23 58.94 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.527 1.131 . . . . 0.0 110.506 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 10.4 ttm -58.17 -53.59 56.6 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 123.285 0.634 . . . . 0.0 110.25 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.1 mp -62.75 -28.62 70.09 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.725 -1.131 . . . . 0.0 111.489 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.81 -56.6 5.96 Favored 'General case' 0 CA--C 1.522 -0.102 0 CA-C-N 120.696 1.589 . . . . 0.0 108.259 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -61.11 -46.9 88.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.479 0.712 . . . . 0.0 112.785 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 48.0 mt -67.9 -44.12 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.604 0.638 . . . . 0.0 110.632 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.2 tmpt? -66.73 -44.22 82.14 Favored 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 120.974 -1.079 . . . . 0.0 110.01 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -62.93 -50.85 69.21 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.582 0.753 . . . . 0.0 110.518 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 19.0 p -56.14 -46.41 79.25 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.184 0.902 . . . . 0.0 111.475 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 4.2 tt -62.94 -49.1 76.07 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.927 1.291 . . . . 0.0 110.056 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -60.27 -54.91 40.13 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.788 0.835 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.76 -40.93 94.31 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 124.416 1.086 . . . . 0.0 112.132 -178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmm? -63.27 -44.29 95.55 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -65.0 -37.11 86.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -33.54 76.15 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.801 1.24 . . . . 0.0 112.714 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.3 tm? . . . . . 0 CA--C 1.544 0.746 0 CA-C-N 119.28 0.946 . . . . 0.0 109.713 -179.419 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 26.5 m80 . . . . . 0 N--CA 1.456 -0.167 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 60.8 m -57.95 -47.67 82.24 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.473 1.033 . . . . 0.0 108.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 4.0 mp -59.29 -42.09 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.915 0.886 . . . . 0.0 109.062 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.06 -57.73 10.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.652 0.381 . . . . 0.0 111.213 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 91.2 m -57.82 -43.46 85.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.3 1.04 . . . . 0.0 109.745 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -58.43 -46.54 86.29 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.539 1.063 . . . . 0.0 110.302 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -49.16 76.54 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.69 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -68.32 -47.74 66.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 118.802 -0.618 . . . . 0.0 110.99 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -48.28 -51.19 26.88 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.081 1.353 . . . . 0.0 110.102 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . 0.296 3.7 pp0? -72.98 -31.72 64.71 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.74 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -66.25 -40.25 90.07 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.184 1.356 . . . . 0.0 108.456 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 20.1 tp60 . . . . . 0 CA--C 1.532 0.262 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.941 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 121.019 0.438 . . . . 0.0 110.687 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -106.99 145.4 32.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -130.03 143.29 50.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 125.571 1.548 . . . . 0.0 107.306 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 59.7 mt -144.42 154.81 43.35 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.095 0.558 . . . . 0.0 110.446 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -145.02 107.42 4.38 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.453 1.901 . . . . 0.0 108.116 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . 0.463 HG21 ' HD2' ' B' ' 116' ' ' LYS . 99.6 t -155.55 152.32 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 128.547 2.739 . . . . 0.0 106.497 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 103.49 7.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 121.128 1.785 . . . . 0.0 112.854 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.39 120.33 1.75 Allowed Glycine 0 C--O 1.228 -0.279 0 N-CA-C 105.957 -2.857 . . . . 0.0 105.957 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 9.3 tpt85 -57.85 -56.61 19.69 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.439 1.62 . . . . 0.0 111.688 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 58.7 mttp -67.51 -48.91 65.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -51.7 -52.03 51.47 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.051 0.94 . . . . 0.0 110.51 -177.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 93.1 t80 -61.06 -51.03 70.91 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 117.89 -1.052 . . . . 0.0 111.816 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -57.63 -47.56 81.88 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.875 1.216 . . . . 0.0 111.415 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 87.7 mt -61.21 -58.2 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.832 1.253 . . . . 0.0 108.896 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 4.6 mp -55.2 -47.47 75.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.264 0.626 . . . . 0.0 109.802 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -44.38 87.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.695 1.198 . . . . 0.0 110.279 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -62.72 -53.03 60.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.751 1.16 . . . . 0.0 108.558 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 59.4 mt -59.2 -30.06 67.94 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.084 0.553 . . . . 0.0 112.475 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . 0.633 ' HE2' HD22 ' B' ' 101' ' ' LEU . 28.5 ttpp -64.34 -60.52 3.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.703 1.201 . . . . 0.0 108.522 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.23 -41.21 99.07 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 123.704 0.628 . . . . 0.0 110.722 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 58.6 m -58.91 -48.18 82.36 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.35 0.977 . . . . 0.0 112.019 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -41.63 70.21 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -57.27 -46.55 82.97 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.645 1.111 . . . . 0.0 110.341 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.52 -39.67 88.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 117.804 -1.093 . . . . 0.0 108.783 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -66.97 -30.75 70.95 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.151 0.98 . . . . 0.0 110.605 178.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -75.7 -28.74 58.75 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.935 1.694 . . . . 0.0 109.661 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 40.9 tp -85.48 -33.1 21.92 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.597 1.159 . . . . 0.0 112.476 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 21.2 m -93.46 148.0 34.72 Favored Pre-proline 0 C--N 1.332 -0.181 0 O-C-N 120.934 -1.104 . . . . 0.0 110.233 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -70.82 -179.9 3.75 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 N-CA-C 108.105 -1.536 . . . . 0.0 108.105 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -112.0 61.52 0.57 Allowed Pre-proline 0 CA--C 1.544 0.718 0 O-C-N 120.814 -1.179 . . . . 0.0 111.936 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.96 -75.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 123.598 2.865 . . . . 0.0 109.974 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.4 tt -65.05 -30.35 71.31 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.9 t -55.9 -52.41 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.328 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.15 -45.96 75.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.182 1.355 . . . . 0.0 110.693 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -50.25 67.53 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.643 0.777 . . . . 0.0 109.839 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 24.8 t80 -67.02 -42.46 84.9 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 125.335 1.454 . . . . 0.0 110.064 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -57.06 -47.8 80.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.954 1.252 . . . . 0.0 110.866 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -67.45 -37.77 83.48 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.898 0.772 . . . . 0.0 110.453 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -64.67 -34.0 77.26 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.767 1.627 . . . . 0.0 111.238 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.97 -43.69 19.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.53 1.532 . . . . 0.0 108.501 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -57.76 -31.53 66.59 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.018 0.927 . . . . 0.0 110.498 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 19.3 mt -58.6 -21.35 53.16 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.708 0.803 . . . . 0.0 111.429 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.534 0.355 0 C-N-CA 123.368 0.667 . . . . 0.0 111.884 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.236 0.357 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.0 tp -89.8 121.75 32.24 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -106.57 163.75 12.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.597 1.159 . . . . 0.0 108.011 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -132.44 145.17 51.0 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.588 HD21 ' HE2' ' C' 1023 ' ' LYS . 3.1 tt -132.99 96.91 17.26 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-O 118.272 -0.871 . . . . 0.0 109.255 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.05 126.4 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.582 2.855 . . . . 0.0 112.737 -179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 t -145.77 148.63 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 119.655 1.116 . . . . 0.0 109.917 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -136.28 100.94 4.53 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.55 117.45 0.74 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 105.389 -3.084 . . . . 0.0 105.389 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -65.09 -50.94 64.18 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 122.174 2.987 . . . . 0.0 111.592 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.267 0.939 . . . . 0.0 110.228 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.2 m -63.84 -49.57 72.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -59.0 -34.88 72.36 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.932 1.242 . . . . 0.0 112.123 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.05 -57.38 13.34 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.422 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 1.2 ptp -63.82 -37.8 88.74 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 119.74 -0.784 . . . . 0.0 112.336 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.55 -53.62 48.88 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 117.896 -1.05 . . . . 0.0 111.817 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.01 -52.6 64.3 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 119.661 1.119 . . . . 0.0 110.439 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -56.29 -47.57 78.39 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.67 -47.62 69.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 118.709 0.686 . . . . 0.0 109.979 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.49 -53.78 41.17 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.937 0.895 . . . . 0.0 109.817 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -61.52 -34.39 75.43 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.978 0.911 . . . . 0.0 112.69 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 p -67.77 -43.74 79.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.489 0.586 . . . . 0.0 110.291 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.07 -42.45 89.38 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.399 1.079 . . . . 0.0 109.333 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -54.74 -53.87 49.4 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 56.5 tp -60.07 -56.28 23.57 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.402 1.081 . . . . 0.0 112.765 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.497 ' HE1' HH21 ' A' ' 41' ' ' ARG . 0.2 OUTLIER -54.36 -32.35 56.68 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.347 1.459 . . . . 0.0 112.467 -178.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -89.92 -41.64 11.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.633 0.651 . . . . 0.0 111.129 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -70.58 -21.71 62.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 112.912 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp . . . . . 0 C--O 1.236 0.364 0 C-N-CA 123.992 0.917 . . . . 0.0 110.652 -178.987 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 . . . . . 0 CA--C 1.53 0.201 0 CA-C-O 119.18 -0.438 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 m -62.14 -51.25 68.64 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.5 mp -57.21 -48.1 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.531 1.132 . . . . 0.0 108.682 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -60.57 -58.68 7.45 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.8 p -59.93 -50.02 75.39 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 123.726 0.81 . . . . 0.0 111.9 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.84 -35.25 76.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 118.043 0.383 . . . . 0.0 111.069 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.497 HH21 ' HE1' ' A' ' 29' ' ' MET . 37.9 ttm180 -67.24 -48.57 67.4 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -58.61 -45.62 88.78 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.657 0.383 . . . . 0.0 110.672 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -63.59 -49.66 72.49 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.422 -0.799 . . . . 0.0 110.337 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -58.01 -40.14 80.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.142 0.883 . . . . 0.0 110.239 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -67.19 -49.79 63.34 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 CA--C 1.534 0.356 0 O-C-N 121.599 -0.688 . . . . 0.0 110.42 179.606 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 98.3 m . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -119.69 130.11 54.87 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 104.15 -2.537 . . . . 0.0 104.15 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -108.33 151.03 26.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.507 1.523 . . . . 0.0 110.43 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 45.1 mt -148.67 150.73 33.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.698 0.799 . . . . 0.0 109.362 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.26 106.02 4.13 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.327 1.451 . . . . 0.0 109.867 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 57.5 t -154.68 151.48 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.968 1.307 . . . . 0.0 109.156 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -113.08 102.33 10.29 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.51 1.504 . . . . 0.0 111.603 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.15 111.32 0.64 Allowed Glycine 0 CA--C 1.52 0.366 0 CA-C-O 116.046 -2.53 . . . . 0.0 108.08 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 11.2 tpt180 -60.32 -58.02 10.3 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.954 2.877 . . . . 0.0 112.566 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -67.28 -41.83 84.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 118.544 0.611 . . . . 0.0 110.613 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -58.78 -48.05 82.6 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.54 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -63.7 -44.13 94.56 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 119.007 0.821 . . . . 0.0 110.438 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -57.66 -53.92 52.71 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.737 0.699 . . . . 0.0 111.277 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.8 mt -59.7 -54.17 38.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 124.31 1.044 . . . . 0.0 109.757 -178.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 58.1 mt -58.63 -51.32 70.42 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 117.259 -1.353 . . . . 0.0 112.247 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 26.2 ttt -64.16 -44.59 91.63 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.96 1.255 . . . . 0.0 111.133 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.1 ttpt -54.05 -52.37 61.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 119.028 0.831 . . . . 0.0 109.115 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 81.6 mt -72.57 -23.88 61.03 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.384 0.674 . . . . 0.0 112.187 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . 0.472 ' HD3' HD11 ' D' 1112 ' ' LEU . 25.2 tptt -63.26 -60.11 3.83 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 120.196 1.362 . . . . 0.0 107.978 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -39.13 77.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.434 1.709 . . . . 0.0 108.649 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 7.0 t -57.03 -45.31 83.21 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 123.43 0.692 . . . . 0.0 111.322 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.27 -42.77 71.67 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.382 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.91 -37.03 85.9 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 120.728 1.604 . . . . 0.0 110.248 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 mt -66.57 -48.28 70.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -61.61 -31.9 72.0 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.935 0.894 . . . . 0.0 111.113 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -73.9 -33.35 63.97 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.178 0.899 . . . . 0.0 109.671 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 52.7 tp -83.54 -33.69 25.41 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.5 m -94.16 148.6 35.42 Favored Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -71.42 172.26 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.082 0 CA-C-N 119.904 1.002 . . . . 0.0 110.5 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -112.84 41.6 0.23 Allowed Pre-proline 0 CA--C 1.556 1.18 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.51 -48.81 2.88 Favored 'Trans proline' 0 C--N 1.354 0.836 0 CA-C-N 122.417 1.899 . . . . 0.0 111.502 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.2 -36.13 80.98 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.016 0.826 . . . . 0.0 109.567 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.25 -46.65 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.068 0 C-N-CA 123.809 0.844 . . . . 0.0 110.23 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 100.0 m-20 -62.12 -50.07 73.36 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.015 0.526 . . . . 0.0 110.31 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.3 t -62.37 -46.38 88.89 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.008 0.523 . . . . 0.0 111.176 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -61.32 -49.61 76.29 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.535 1.134 . . . . 0.0 109.006 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -56.55 -47.72 78.83 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 118.503 -0.76 . . . . 0.0 108.968 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -58.7 -54.48 46.6 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.039 0.836 . . . . 0.0 111.207 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -34.4 75.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.7 0.682 . . . . 0.0 112.4 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -74.56 -33.9 62.8 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.148 0.579 . . . . 0.0 110.069 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -61.76 -38.62 88.66 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.151 -1.593 . . . . 0.0 107.55 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.16 -13.4 60.15 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.112 0.565 . . . . 0.0 112.059 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--N 1.341 0.207 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 178.44 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 68.8 tp -86.57 124.23 32.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.87 169.1 10.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -137.97 152.24 48.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -119.43 99.84 49.91 Favored Pre-proline 0 C--O 1.235 0.311 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -80.04 108.15 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.821 3.014 . . . . 0.0 109.582 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.3 t -142.17 147.42 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 O-C-N 121.027 -1.046 . . . . 0.0 110.365 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -126.25 101.97 6.98 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.56 120.82 0.91 Allowed Glycine 0 N--CA 1.459 0.218 0 CA-C-O 116.035 -2.536 . . . . 0.0 108.578 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -66.73 -51.77 52.07 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 122.411 3.106 . . . . 0.0 110.395 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -67.9 -38.12 82.59 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.31 99.11 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.274 0.63 . . . . 0.0 110.691 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 20.9 t80 -68.9 -38.93 79.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 119.742 1.155 . . . . 0.0 108.921 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -60.51 -54.4 45.9 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.353 -0.832 . . . . 0.0 111.497 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 3.8 ptp -61.59 -33.04 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.619 0.645 . . . . 0.0 111.132 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.21 -46.83 66.47 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -43.2 98.31 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 119.467 1.03 . . . . 0.0 109.741 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.74 -48.88 74.47 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.194 0.998 . . . . 0.0 110.624 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 8.6 mt -79.76 -31.53 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.508 0.723 . . . . 0.0 111.837 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . 0.588 ' HE2' HD21 ' A' ' 8' ' ' LEU . 1.4 tmmt? -65.86 -56.69 10.55 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.14 -49.27 76.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.896 1.678 . . . . 0.0 113.055 -178.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 13.7 p -61.88 -50.19 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.688 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -65.77 -40.33 91.9 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.035 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.02 -54.53 41.88 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -47.56 78.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 117.916 0.326 . . . . 0.0 111.21 -179.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -54.76 -33.35 61.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.705 1.202 . . . . 0.0 111.297 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 -22.92 18.72 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.073 1.349 . . . . 0.0 111.354 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.48 -34.63 31.24 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.339 1.427 . . . . 0.0 109.752 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 22.6 tp . . . . . 0 C--O 1.237 0.423 0 C-N-CA 126.433 1.893 . . . . 0.0 107.592 179.593 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 84.2 m-70 . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 7.3 m -61.75 -51.55 67.88 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.976 0.91 . . . . 0.0 109.002 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.98 -40.45 85.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 125.787 1.635 . . . . 0.0 109.116 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -65.21 -58.04 7.0 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.434 1.494 . . . . 0.0 112.625 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 26.3 p -59.2 -43.55 92.23 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.73 0.812 . . . . 0.0 110.744 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 6.5 t80 -59.72 -39.62 85.28 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.934 0.494 . . . . 0.0 109.789 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -62.86 -48.81 77.43 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 118.99 0.814 . . . . 0.0 109.653 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -57.83 -56.37 22.86 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.268 0.627 . . . . 0.0 111.009 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -60.47 -45.1 94.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.895 -1.05 . . . . 0.0 111.428 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.89 -33.77 76.44 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.258 0.935 . . . . 0.0 113.297 -178.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -69.33 -50.36 47.26 Favored 'General case' 0 N--CA 1.461 0.084 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 . . . . . 0 CA--C 1.538 0.489 0 C-N-CA 124.054 0.942 . . . . 0.0 110.752 179.104 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 84.2 m . . . . . 0 N--CA 1.465 0.287 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -113.24 130.16 56.31 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -105.69 140.03 39.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.942 2.897 . . . . 0.0 110.141 -177.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 77.5 mt -137.66 144.93 42.09 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.326 -0.859 . . . . 0.0 111.006 -178.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.84 101.39 3.94 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.03 1.732 . . . . 0.0 110.377 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . 0.452 HG11 ' HE3' ' B' ' 116' ' ' LYS . 63.9 t -151.25 152.01 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 120.585 -1.322 . . . . 0.0 109.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -115.79 101.47 8.84 Favored 'General case' 0 C--N 1.347 0.497 0 CA-C-N 120.486 1.494 . . . . 0.0 113.547 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.84 118.38 1.24 Allowed Glycine 0 CA--C 1.522 0.494 0 N-CA-C 107.717 -2.153 . . . . 0.0 107.717 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -66.73 -56.65 9.56 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 121.307 2.554 . . . . 0.0 111.014 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -63.38 -45.92 88.87 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.048 0.928 . . . . 0.0 109.328 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -57.99 -51.27 70.34 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 117.205 -1.378 . . . . 0.0 111.763 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.55 -44.97 95.54 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.498 1.499 . . . . 0.0 111.149 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -50.73 -54.1 26.03 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.807 0.843 . . . . 0.0 110.509 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.6 mt -65.88 -52.34 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.822 1.249 . . . . 0.0 110.383 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . 0.472 HD11 ' HD3' ' B' ' 116' ' ' LYS . 18.2 mt -51.73 -52.26 49.92 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.566 1.147 . . . . 0.0 111.974 -178.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 24.0 ttt -64.7 -44.26 90.84 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.25 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . 0.422 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 24.7 ttpt -54.99 -52.18 63.93 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.93 -45.8 76.76 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.576 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.6 tptt -53.76 -59.75 4.21 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 118.949 0.795 . . . . 0.0 111.755 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -30.31 71.18 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 18.4 t -60.86 -39.04 87.66 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 120.324 1.42 . . . . 0.0 109.7 178.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.07 -38.6 63.88 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.275 0.489 . . . . 0.0 110.093 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.73 -43.29 96.94 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.93 -48.85 70.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.6 tmt? -59.56 -22.49 61.79 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.752 0.821 . . . . 0.0 110.861 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.71 -46.8 35.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 65.1 tp -71.99 -33.11 67.84 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.864 0.866 . . . . 0.0 113.334 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 23.1 m -92.25 147.5 34.71 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 120.101 1.319 . . . . 0.0 110.4 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -71.45 174.86 10.25 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 N-CA-C 108.398 -1.424 . . . . 0.0 108.398 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -122.74 44.3 0.87 Allowed Pre-proline 0 CA--C 1.555 1.136 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -61.91 -48.72 8.03 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.158 2.572 . . . . 0.0 113.273 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 49.7 tp -65.64 -26.41 67.79 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.453 -0.779 . . . . 0.0 109.689 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 39.7 t -67.27 -46.56 83.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.237 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -56.84 -43.81 81.5 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -64.6 -48.47 74.82 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.137 0.575 . . . . 0.0 109.975 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.36 -41.85 94.54 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.205 1.002 . . . . 0.0 110.166 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.07 -48.44 80.12 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.66 -49.82 69.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 117.893 -1.051 . . . . 0.0 111.89 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -42.46 95.67 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.118 1.326 . . . . 0.0 111.384 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -71.01 -37.55 72.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.157 0.435 . . . . 0.0 111.12 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -65.82 -39.75 91.17 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 119.028 0.831 . . . . 0.0 109.659 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 43.4 mt -66.81 -26.13 66.79 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.887 0.767 . . . . 0.0 110.003 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 124.295 1.038 . . . . 0.0 108.677 178.839 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.87 104.71 1.14 Allowed 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -92.2 169.25 10.75 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -123.93 127.92 48.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 13.5 tp -115.67 93.98 38.98 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 126.022 1.729 . . . . 0.0 107.353 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -77.8 119.92 4.94 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.062 2.508 . . . . 0.0 112.988 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -145.62 155.59 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.04 1.336 . . . . 0.0 108.775 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.0 101.4 4.71 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.2 0.6 . . . . 0.0 111.102 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.48 115.93 0.65 Allowed Glycine 0 CA--C 1.526 0.732 0 C-N-CA 126.805 2.145 . . . . 0.0 107.758 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.07 -51.98 65.92 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.6 2.7 . . . . 0.0 112.286 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -73.42 -32.38 64.38 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 123.27 0.628 . . . . 0.0 110.737 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -61.05 -43.4 98.94 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.123 1.369 . . . . 0.0 108.627 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -67.51 -54.43 20.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -54.64 -54.93 35.12 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.471 0.708 . . . . 0.0 112.909 -178.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 40.0 ttm -53.42 -54.02 42.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.983 0.913 . . . . 0.0 110.349 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.94 -28.73 67.73 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-O 118.014 -0.993 . . . . 0.0 112.911 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.22 -55.8 10.98 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.61 -40.49 72.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.031 0.932 . . . . 0.0 110.349 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.447 HG23 HD22 ' B' ' 115' ' ' LEU . 93.2 mt -67.9 -51.07 53.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.63 -0.7 . . . . 0.0 110.337 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -32.82 74.49 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.108 1.322 . . . . 0.0 110.721 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -66.16 -55.17 17.71 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.031 1.332 . . . . 0.0 110.395 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 p -54.38 -40.63 68.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 117.9 0.318 . . . . 0.0 110.326 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 tt -68.5 -55.43 11.77 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.734 1.214 . . . . 0.0 110.513 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -53.36 -52.78 58.16 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.244 1.817 . . . . 0.0 111.869 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.8 -46.22 90.46 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.993 -1.003 . . . . 0.0 109.641 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.54 -43.03 97.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 119.079 0.854 . . . . 0.0 109.281 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -71.69 -13.17 61.66 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -102.77 -28.96 11.78 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.299 0.954 . . . . 0.0 113.526 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.6 tp . . . . . 0 CA--C 1.531 0.232 0 C-N-CA 125.206 1.402 . . . . 0.0 109.848 -178.43 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.5 m170 . . . . . 0 CA--C 1.536 0.404 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.8 m -67.83 -46.09 72.82 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.777 0.831 . . . . 0.0 108.942 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -65.28 -34.39 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -58.27 8.13 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.0 m -68.29 -49.43 60.5 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -52.2 -51.93 55.19 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 123.924 0.89 . . . . 0.0 111.256 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -69.05 -46.1 68.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.937 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -58.45 -52.99 63.29 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.986 0.514 . . . . 0.0 110.629 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -62.75 -41.18 99.08 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.676 -0.678 . . . . 0.0 109.372 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.78 -39.38 84.69 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.383 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.73 -52.15 61.76 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.187 1.358 . . . . 0.0 108.348 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.2 tm0? . . . . . 0 CA--C 1.538 0.518 0 C-N-CA 124.687 1.195 . . . . 0.0 111.712 -179.52 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . 0.488 ' HA ' ' HB3' ' D' 1104 ' ' ARG . 53.1 m . . . . . 0 C--O 1.237 0.44 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . 0.513 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 86.9 m-85 -101.7 128.23 48.1 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.108 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -105.98 161.98 14.0 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 126.026 1.73 . . . . 0.0 109.317 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 93.7 mt -151.0 142.98 23.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 127.441 2.296 . . . . 0.0 106.285 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -144.39 98.87 3.28 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.251 1.42 . . . . 0.0 108.37 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 m -153.63 150.32 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 123.485 0.714 . . . . 0.0 111.682 -177.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -117.54 102.48 9.22 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.043 1.292 . . . . 0.0 114.201 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.31 129.28 3.82 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 106.781 -2.528 . . . . 0.0 106.781 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -66.73 -57.51 6.97 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.202 2.001 . . . . 0.0 110.88 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -70.35 -37.87 74.7 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -54.6 -41.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.233 0.613 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -75.12 -42.68 55.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.257 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -54.15 -54.93 32.88 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.853 1.66 . . . . 0.0 110.273 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.02 -54.92 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.466 1.506 . . . . 0.0 110.423 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -32.18 73.74 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-O 116.711 -1.614 . . . . 0.0 112.89 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 21.3 mtp -68.78 -53.24 22.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 121.019 1.736 . . . . 0.0 107.547 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -52.07 -48.55 64.6 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.297 1.039 . . . . 0.0 109.836 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.447 HD22 HG23 ' A' ' 22' ' ' ILE . 50.9 mt -67.46 -54.99 15.47 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.6 -0.715 . . . . 0.0 112.138 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -54.45 -37.85 65.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 120.095 1.316 . . . . 0.0 110.797 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.04 -57.59 8.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.731 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 73.0 m -55.54 -34.12 64.41 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.11 -0.947 . . . . 0.0 111.432 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.45 -40.24 67.17 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.713 1.205 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.77 -47.09 85.01 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.44 1.018 . . . . 0.0 108.478 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 75.5 mt -60.64 -47.3 86.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -26.77 68.02 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.263 1.025 . . . . 0.0 111.807 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -79.64 -54.79 5.54 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.808 0.843 . . . . 0.0 111.868 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -69.6 -32.72 71.61 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.86 148.27 34.49 Favored Pre-proline 0 CA--C 1.534 0.327 0 C-N-CA 125.105 1.362 . . . . 0.0 108.756 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -70.98 169.42 20.52 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 121.077 1.185 . . . . 0.0 109.576 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -115.7 58.88 1.46 Allowed Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.436 1.094 . . . . 0.0 113.207 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.07 -63.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 123.558 2.838 . . . . 0.0 115.645 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.31 -33.33 75.57 Favored 'General case' 0 CA--C 1.513 -0.477 0 O-C-N 121.162 -0.961 . . . . 0.0 108.934 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.424 HG23 ' H ' ' B' ' 130' ' ' VAL . 15.1 t -50.27 -53.33 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 C-N-CA 125.173 1.389 . . . . 0.0 108.401 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -66.39 -51.4 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.8 m -59.16 -41.13 87.66 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.97 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -67.98 -52.77 32.07 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.019 1.328 . . . . 0.0 110.365 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -59.69 -39.78 85.67 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.401 -1.285 . . . . 0.0 110.129 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -64.28 -55.6 20.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.911 1.232 . . . . 0.0 110.058 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -56.42 -42.48 78.12 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.356 -0.84 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -67.83 -40.72 83.74 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.993 0.917 . . . . 0.0 110.828 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -61.23 -34.32 74.93 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 125.26 1.424 . . . . 0.0 110.567 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -57.73 -14.36 5.6 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.388 0.994 . . . . 0.0 113.128 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 CA--C 1.543 0.683 0 CA-C-N 119.814 1.188 . . . . 0.0 109.693 178.451 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 . . . . . 0 N--CA 1.456 -0.141 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 1.9 tt -69.19 95.9 0.79 Allowed 'General case' 0 C--O 1.236 0.378 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.7 mt -90.28 168.77 11.66 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.784 1.633 . . . . 0.0 107.506 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -126.44 135.23 51.12 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 28.4 tp -111.72 91.97 16.11 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.8 106.65 2.24 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.261 2.641 . . . . 0.0 109.471 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 58.9 t -144.91 153.69 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 119.977 1.262 . . . . 0.0 110.769 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -128.52 102.97 6.85 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.3 110.59 0.39 Allowed Glycine 0 CA--C 1.522 0.469 0 CA-C-O 115.646 -2.752 . . . . 0.0 108.878 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -62.06 -53.15 59.53 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 123.099 3.449 . . . . 0.0 111.962 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 16.7 m -67.92 -45.48 74.26 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.28 -0.887 . . . . 0.0 109.469 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.54 -52.39 61.33 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 124.051 0.94 . . . . 0.0 108.614 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -54.47 -51.39 65.17 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.141 0.976 . . . . 0.0 110.69 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 52.1 ttm -61.49 -53.84 51.1 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.654 0.781 . . . . 0.0 111.377 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.3 -36.54 84.38 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.94 -55.8 15.0 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -57.69 -39.31 76.88 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.513 0.725 . . . . 0.0 111.687 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . 0.405 HG23 HD22 ' D' 1115 ' ' LEU . 22.6 mt -65.15 -52.25 55.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 118.483 -0.77 . . . . 0.0 109.865 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -34.61 75.66 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 118.375 -1.33 . . . . 0.0 110.794 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -61.66 -55.35 31.48 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 110.049 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.2 p -55.32 -49.09 73.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 118.094 0.407 . . . . 0.0 110.911 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.3 tt -62.24 -54.3 42.8 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.843 0.857 . . . . 0.0 111.164 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -53.95 -50.97 65.3 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.613 1.165 . . . . 0.0 110.152 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.35 -48.83 76.33 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 123.774 0.829 . . . . 0.0 110.005 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 2.2 tmt? -58.87 -22.65 59.66 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.45 1.1 . . . . 0.0 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -100.98 -12.77 18.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.058 1.743 . . . . 0.0 112.012 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.3 t80 -101.72 -13.41 17.76 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.003 1.321 . . . . 0.0 110.581 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 41.7 tp . . . . . 0 CA--C 1.536 0.411 0 C-N-CA 126.838 2.055 . . . . 0.0 108.633 -179.36 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 7.2 m170 . . . . . 0 N--CA 1.462 0.15 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 13.3 m -58.78 -51.24 70.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.716 0.807 . . . . 0.0 109.829 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.5 mt -57.03 -46.04 84.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.981 1.712 . . . . 0.0 110.206 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.4 -52.11 66.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 122.872 0.469 . . . . 0.0 111.619 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 27.7 m -63.26 -39.53 94.85 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.706 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 24.7 t80 -57.7 -52.97 63.25 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 178.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 48.0 ttt-85 -63.77 -31.81 73.11 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.665 0.666 . . . . 0.0 111.859 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -57.85 11.07 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -67.98 -37.87 82.01 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.668 1.187 . . . . 0.0 111.633 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -60.24 -47.39 86.17 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.586 -1.197 . . . . 0.0 109.834 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -64.64 -40.43 95.44 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.196 1.362 . . . . 0.0 110.012 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.4 tm0? . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.451 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.2 m . . . . . 0 C--O 1.237 0.435 0 N-CA-C 105.087 -2.19 . . . . 0.0 105.087 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -101.9 130.18 48.32 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.194 -0.942 . . . . 0.0 110.173 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -115.61 150.0 37.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.55 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 70.9 mt -142.53 142.27 32.19 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.82 98.56 3.07 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.281 1.033 . . . . 0.0 108.354 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.39 146.52 18.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 124.958 1.303 . . . . 0.0 110.81 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . 0.488 ' HB3' ' HA ' ' B' ' 98' ' ' THR . 0.0 OUTLIER -107.88 100.62 9.97 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.662 1.119 . . . . 0.0 113.284 -179.374 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.09 108.15 0.5 Allowed Glycine 0 C--O 1.226 -0.371 0 N-CA-C 106.385 -2.686 . . . . 0.0 106.385 177.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -51.08 -57.11 9.52 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 122.005 2.903 . . . . 0.0 113.728 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -67.84 -44.25 77.6 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.344 -0.848 . . . . 0.0 110.467 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 3.3 m120 -58.6 -30.05 66.92 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.296 1.439 . . . . 0.0 110.645 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . 0.513 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 45.7 t80 -74.82 -55.33 5.93 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 177.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.36 -53.93 38.27 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.497 1.044 . . . . 0.0 113.399 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -60.03 -54.47 34.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 C-N-CA 125.035 1.334 . . . . 0.0 109.119 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -35.8 81.68 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 117.442 -1.266 . . . . 0.0 110.877 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.96 -52.45 62.98 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 119.843 1.202 . . . . 0.0 108.282 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 58.0 tttp -54.96 -46.96 75.1 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.69 0.796 . . . . 0.0 109.81 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . 0.405 HD22 HG23 ' C' 1022 ' ' ILE . 33.0 mt -66.86 -52.0 48.85 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 117.907 0.321 . . . . 0.0 110.649 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -55.03 -44.65 74.82 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.399 1.079 . . . . 0.0 111.438 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.62 -57.5 11.78 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.152 1.781 . . . . 0.0 106.983 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.6 m -53.2 -43.72 67.39 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.506 0.722 . . . . 0.0 112.008 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.82 -31.08 64.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.348 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -65.16 -44.86 87.19 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.504 1.502 . . . . 0.0 107.468 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.74 -43.14 89.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.053 1.341 . . . . 0.0 107.783 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.21 -36.46 79.96 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.019 0.827 . . . . 0.0 110.752 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -45.37 52.79 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.807 0.843 . . . . 0.0 112.288 -179.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -78.42 -32.83 48.85 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -94.31 146.12 30.97 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -67.0 173.97 7.54 Favored 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 122.912 2.408 . . . . 0.0 112.799 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.23 50.85 0.67 Allowed Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 125.059 1.344 . . . . 0.0 113.858 -179.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.09 -69.73 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.213 1.942 . . . . 0.0 112.245 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.87 -32.64 73.01 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.253 0.933 . . . . 0.0 110.007 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.0 t -53.99 -50.47 53.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 124.537 1.135 . . . . 0.0 110.074 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.89 -51.25 50.22 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.482 0.583 . . . . 0.0 111.253 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 49.5 m -54.59 -42.36 70.98 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.032 0.378 . . . . 0.0 110.841 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.03 -52.57 40.72 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 117.29 -1.338 . . . . 0.0 110.282 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.86 -43.4 94.7 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 120.121 1.328 . . . . 0.0 111.331 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -62.39 -54.96 32.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 118.875 0.761 . . . . 0.0 109.841 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -61.52 -27.89 68.93 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.8 tm0? -80.51 -49.71 11.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -55.37 -33.2 63.23 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.801 1.64 . . . . 0.0 109.971 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 9.6 mt -57.12 -13.97 3.49 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.038 0.935 . . . . 0.0 113.442 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.3 tt . . . . . 0 CA--C 1.54 0.59 0 CA-C-N 119.468 1.031 . . . . 0.0 110.731 178.087 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tp -62.85 94.57 0.07 Allowed 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.674 1.19 . . . . 0.0 113.123 -177.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.01 156.2 18.12 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -130.14 142.69 50.56 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.766 1.626 . . . . 0.0 106.738 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 tp -132.12 110.47 14.14 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 119.596 1.089 . . . . 0.0 111.885 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -88.18 113.31 0.78 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.766 3.644 . . . . 0.0 111.07 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.41 HG22 ' HE3' ' C' 1023 ' ' LYS . 24.2 t -140.83 148.45 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 119.788 -1.82 . . . . 0.0 107.965 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.58 102.8 5.23 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.466 -0.771 . . . . 0.0 109.924 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.26 118.12 0.79 Allowed Glycine 0 CA--C 1.521 0.424 0 N-CA-C 104.325 -3.51 . . . . 0.0 104.325 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.98 -51.46 64.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.965 1.883 . . . . 0.0 109.878 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.51 -45.74 82.38 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.842 0.857 . . . . 0.0 109.449 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.7 m -55.31 -51.81 65.51 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.794 1.638 . . . . 0.0 110.488 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -62.0 -42.56 99.28 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.424 -0.798 . . . . 0.0 110.278 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -60.46 -42.96 97.26 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.118 1.326 . . . . 0.0 111.697 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.5 ttm -69.98 -53.83 15.96 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.038 0.535 . . . . 0.0 110.911 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.18 -47.02 82.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.654 1.581 . . . . 0.0 111.422 -178.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.69 -49.09 78.93 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -57.81 -47.65 81.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.948 0.794 . . . . 0.0 111.814 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.531 HG23 HD22 ' B' ' 115' ' ' LEU . 96.6 mt -62.12 -42.12 93.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 123.419 0.688 . . . . 0.0 109.249 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.467 ' HE3' HG22 ' C' 1010 ' ' VAL . 14.0 tmtt? -63.38 -52.41 61.76 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 123.854 0.862 . . . . 0.0 108.756 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.35 -54.69 40.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.929 2.092 . . . . 0.0 110.949 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -53.82 -51.1 64.6 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.908 0.776 . . . . 0.0 109.721 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.14 -48.71 78.88 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -178.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -59.69 -51.83 68.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.145 1.378 . . . . 0.0 111.564 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.42 ' HG ' HG22 ' B' ' 130' ' ' VAL . 4.0 mm? -65.05 -42.48 94.23 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.072 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -37.18 67.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -89.66 -17.13 28.97 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.222 1.374 . . . . 0.0 112.91 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -87.56 -57.9 2.78 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 121.149 -0.969 . . . . 0.0 113.234 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.54 0.579 0 O-C-N 121.919 -0.488 . . . . 0.0 110.826 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.2 m -66.72 -51.26 57.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.373 -0.83 . . . . 0.0 109.753 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.0 mt -58.3 -43.89 87.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 125.442 1.497 . . . . 0.0 110.939 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -55.95 -58.96 5.69 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.379 1.872 . . . . 0.0 109.677 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.9 m -62.73 -42.19 99.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.153 0.908 . . . . 0.0 110.071 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -55.3 -54.44 43.56 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.408 1.004 . . . . 0.0 111.223 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 43.3 ttt-85 -75.3 -29.87 60.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.308 -0.87 . . . . 0.0 112.209 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.73 -49.98 47.98 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.096 -1.002 . . . . 0.0 109.008 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -62.28 -44.14 97.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.658 1.183 . . . . 0.0 109.17 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -56.41 -51.9 66.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.369 0.986 . . . . 0.0 110.233 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -62.09 -34.97 77.32 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.984 -0.447 . . . . 0.0 111.241 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 . . . . . 0 CA--C 1.536 0.434 0 C-N-CA 123.859 0.864 . . . . 0.0 110.4 179.42 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 92.3 m . . . . . 0 C--O 1.238 0.495 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . 0.487 ' HB3' ' CE2' ' D' 1109 ' ' PHE . 97.1 m-85 -118.59 131.32 56.2 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -113.1 158.19 20.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.383 1.473 . . . . 0.0 110.396 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 81.3 mt -144.06 135.82 26.12 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.42 98.87 4.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.515 1.526 . . . . 0.0 107.072 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 43.4 t -149.53 141.59 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.338 0.972 . . . . 0.0 109.627 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -92.83 103.98 16.27 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.22 108.44 0.49 Allowed Glycine 0 N--CA 1.465 0.627 0 CA-C-O 114.937 -3.146 . . . . 0.0 112.729 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -67.61 -58.21 5.08 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 123.55 3.675 . . . . 0.0 112.455 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -66.82 -43.08 84.71 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.294 -0.879 . . . . 0.0 110.012 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -57.63 -47.29 82.62 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.346 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -63.39 -41.73 98.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 120.302 1.41 . . . . 0.0 111.706 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -56.67 -52.39 65.11 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.718 1.144 . . . . 0.0 110.437 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.32 -52.6 53.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 C-N-CA 124.772 1.229 . . . . 0.0 110.788 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.94 -29.44 70.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 117.564 -1.208 . . . . 0.0 111.77 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 mtp -69.68 -52.33 26.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.69 1.586 . . . . 0.0 107.524 178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -51.7 -51.82 53.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.223 0.952 . . . . 0.0 108.706 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.531 HD22 HG23 ' A' ' 22' ' ' ILE . 65.0 mt -68.99 -35.87 77.19 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -61.51 -52.13 65.74 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 120.371 1.442 . . . . 0.0 107.488 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.13 -38.05 89.38 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 124.235 0.959 . . . . 0.0 109.891 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 5.4 t -52.8 -55.05 25.75 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.144 0.978 . . . . 0.0 110.52 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.47 -33.32 71.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.076 -0.964 . . . . 0.0 112.493 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -44.53 92.0 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.852 1.205 . . . . 0.0 108.409 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 54.9 mt -67.07 -48.23 68.86 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 9.6 tpt -58.67 -26.92 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.173 0.897 . . . . 0.0 110.83 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -79.63 -44.69 20.49 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.261 1.024 . . . . 0.0 111.052 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -79.41 -26.1 41.95 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.047 1.294 . . . . 0.0 114.279 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . 0.468 HG22 ' HD2' ' B' ' 126' ' ' PRO . 0.3 OUTLIER -94.95 148.52 34.85 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.953 1.701 . . . . 0.0 108.916 -179.344 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.468 ' HD2' HG22 ' B' ' 125' ' ' VAL . 42.0 Cg_endo -73.36 179.86 5.1 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.735 2.29 . . . . 0.0 110.746 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 16.6 mp0 -121.2 44.27 0.73 Allowed Pre-proline 0 CA--C 1.563 1.47 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -63.4 -48.67 5.59 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.217 2.611 . . . . 0.0 115.284 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 69.4 tp -62.93 -41.86 99.61 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.551 1.068 . . . . 0.0 108.973 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.42 HG22 ' HG ' ' A' ' 28' ' ' LEU . 1.8 t -51.76 -48.68 37.86 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 C-N-CA 125.452 1.501 . . . . 0.0 109.706 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -61.49 -51.11 70.03 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.684 1.193 . . . . 0.0 111.767 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.5 t -62.79 -50.17 72.07 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.946 -0.471 . . . . 0.0 110.595 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -61.91 -36.12 80.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.597 1.559 . . . . 0.0 110.182 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -59.98 -48.63 80.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.31 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -69.13 -49.8 53.76 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.822 0.737 . . . . 0.0 111.706 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -54.15 -46.05 72.16 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.692 1.197 . . . . 0.0 111.185 -178.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -80.25 -27.67 38.62 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.928 0.891 . . . . 0.0 110.843 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -57.64 -39.66 77.48 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.184 1.357 . . . . 0.0 108.625 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.3 mt -58.66 -17.28 21.1 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.123 0.969 . . . . 0.0 112.459 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.541 0.62 0 CA-C-N 119.579 1.081 . . . . 0.0 111.985 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.6 tp10 . . . . . 0 C--O 1.233 0.226 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.01 95.06 0.11 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.56 1.544 . . . . 0.0 110.352 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.6 mt -94.44 135.73 35.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -104.98 152.65 22.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.28 1.032 . . . . 0.0 109.276 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 55.6 tp -146.68 102.75 3.94 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.999 1.32 . . . . 0.0 109.808 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -84.25 129.64 4.51 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.291 2.661 . . . . 0.0 110.979 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . 0.467 HG22 ' HE3' ' A' ' 23' ' ' LYS . 3.6 t -144.44 150.91 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.816 1.247 . . . . 0.0 107.65 178.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.66 99.04 3.95 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.771 1.623 . . . . 0.0 109.586 177.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -170.29 137.01 4.23 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 116.773 -2.126 . . . . 0.0 107.875 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -70.62 -52.03 24.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 121.429 2.614 . . . . 0.0 112.076 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.65 -41.41 88.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.893 0.77 . . . . 0.0 110.79 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -51.73 66.95 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 126.006 1.722 . . . . 0.0 108.742 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 36.4 t80 -68.38 -49.6 58.96 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.009 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.41 -56.8 13.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.809 1.244 . . . . 0.0 112.78 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.73 -48.44 81.68 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.236 1.015 . . . . 0.0 110.656 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.88 -39.41 91.83 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 119.09 -0.481 . . . . 0.0 111.058 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.28 -47.4 79.66 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.405 -0.807 . . . . 0.0 109.293 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.51 -49.21 73.19 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.416 0.553 . . . . 0.0 110.88 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 82.4 mt -65.41 -51.24 66.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 123.698 0.799 . . . . 0.0 110.027 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . 0.41 ' HE3' HG22 ' A' ' 10' ' ' VAL . 11.3 tmtt? -54.22 -55.55 26.97 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.609 1.164 . . . . 0.0 110.182 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.26 -42.71 95.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.329 -178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 8.3 t -58.09 -51.16 70.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.519 0.6 . . . . 0.0 109.532 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.28 -49.04 71.07 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.13 -53.12 60.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.977 0.911 . . . . 0.0 111.296 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.25 -42.47 93.27 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.015 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 16.0 tmm? -58.12 -47.25 83.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.383 0.673 . . . . 0.0 110.324 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -78.69 -18.97 53.52 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.114 0.87 . . . . 0.0 112.7 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 15.0 t80 -83.63 -53.41 5.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 119.422 1.01 . . . . 0.0 113.178 -177.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.536 0.424 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -177.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 8.4 m-70 . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 14.1 m -67.1 -51.64 51.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.813 1.245 . . . . 0.0 109.767 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 69.9 mt -60.2 -41.93 88.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.599 0.76 . . . . 0.0 109.833 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.2 -58.33 8.41 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 87.4 m -66.15 -37.08 84.8 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.354 1.061 . . . . 0.0 112.225 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.89 -54.3 46.71 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.25 1.02 . . . . 0.0 109.162 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 54.7 ttt-85 -73.43 -31.95 64.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.118 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -63.57 -57.22 10.83 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 109.037 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -65.62 -34.37 78.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.15 -0.929 . . . . 0.0 111.335 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -61.26 -54.95 37.54 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.12 1.327 . . . . 0.0 108.73 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -63.72 -33.18 75.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.853 0.461 . . . . 0.0 111.347 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 . . . . . 0 CA--C 1.528 0.11 0 C-N-CA 124.204 1.002 . . . . 0.0 109.74 179.313 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 3.9 m . . . . . 0 C--O 1.24 0.6 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -109.96 142.28 41.56 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -128.31 152.89 47.61 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.144 0.978 . . . . 0.0 111.033 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.3 mt -146.03 138.7 25.59 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.031 1.333 . . . . 0.0 107.538 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.24 105.59 5.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.816 1.247 . . . . 0.0 108.996 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 94.7 t -152.11 150.65 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 125.221 1.408 . . . . 0.0 108.925 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.15 101.78 10.79 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.743 1.156 . . . . 0.0 109.836 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.33 106.64 0.41 Allowed Glycine 0 N--CA 1.461 0.364 0 CA-C-O 114.922 -3.155 . . . . 0.0 107.034 177.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -59.0 -57.6 12.34 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 122.454 3.127 . . . . 0.0 114.92 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -65.02 -47.02 78.95 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.395 0.678 . . . . 0.0 109.897 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -62.11 -41.57 98.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.221 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . 0.487 ' CE2' ' HB3' ' B' ' 99' ' ' TYR . 80.2 t80 -66.41 -41.48 89.24 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 119.996 1.271 . . . . 0.0 111.188 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.18 -52.79 63.12 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.7 mt -58.07 -53.64 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 C-N-CA 124.417 1.087 . . . . 0.0 109.162 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 39.1 mt -56.36 -34.82 67.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 117.625 -1.179 . . . . 0.0 111.447 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.3 mtp -70.52 -43.85 68.75 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.815 1.643 . . . . 0.0 108.585 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -55.34 -51.37 66.97 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 54.0 mt -70.07 -33.28 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.335 1.054 . . . . 0.0 112.964 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -60.45 -60.15 4.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.246 1.385 . . . . 0.0 108.826 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.58 -38.07 89.72 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 117.402 -1.285 . . . . 0.0 109.116 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.4 t -52.41 -50.16 63.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 121.266 1.848 . . . . 0.0 111.757 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.88 -42.12 73.86 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.41 0.55 . . . . 0.0 111.322 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.47 87.7 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.344 0.658 . . . . 0.0 110.271 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.28 -48.42 34.77 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.826 1.65 . . . . 0.0 109.676 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.6 tpt -59.77 -30.54 68.94 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.938 1.245 . . . . 0.0 110.199 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -75.93 -41.63 51.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.325 1.05 . . . . 0.0 110.454 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.48 -32.45 54.31 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.391 0.996 . . . . 0.0 112.199 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -81.87 147.9 59.62 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.63 1.172 . . . . 0.0 108.723 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.24 172.13 13.68 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 N-CA-C 107.582 -1.738 . . . . 0.0 107.582 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -120.85 58.38 6.75 Favored Pre-proline 0 CA--C 1.546 0.812 0 O-C-N 120.676 -1.265 . . . . 0.0 111.43 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -73.29 -59.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.682 2.921 . . . . 0.0 113.749 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.8 -40.9 85.41 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -51.07 -48.03 30.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 0.0 109.53 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 10.8 t70 -65.32 -46.73 79.16 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -49.51 77.57 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.0 t80 -59.38 -44.18 92.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.346 1.458 . . . . 0.0 109.582 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -54.85 -48.82 72.42 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.269 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -68.84 -48.37 63.67 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 119.609 1.095 . . . . 0.0 111.958 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -57.26 -38.42 73.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.811 0.845 . . . . 0.0 110.283 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -81.34 -28.26 34.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.726 1.611 . . . . 0.0 110.963 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -60.36 -37.24 80.09 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.26 -9.92 5.92 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.543 0.697 0 C-N-CA 125.647 1.579 . . . . 0.0 109.926 178.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 . . . . . 0 CA--C 1.537 0.474 0 CA-C-O 119.423 -0.322 . . . . 0.0 111.556 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 14.4 tp -134.29 108.44 8.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -115.07 168.62 9.76 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 120.226 1.375 . . . . 0.0 110.25 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -145.25 138.18 26.28 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.192 1.397 . . . . 0.0 107.417 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -112.0 97.97 40.38 Favored Pre-proline 0 C--O 1.232 0.165 0 CA-C-O 118.126 -0.94 . . . . 0.0 110.58 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.2 119.76 6.36 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.118 1.878 . . . . 0.0 107.316 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.6 t -143.59 148.57 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.282 1.033 . . . . 0.0 108.77 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.3 100.27 4.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.07 111.27 0.44 Allowed Glycine 0 C--O 1.226 -0.389 0 CA-C-O 116.463 -2.299 . . . . 0.0 108.036 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -59.8 -48.95 79.64 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 122.017 2.908 . . . . 0.0 112.564 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.7 -32.04 67.39 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.056 0.455 . . . . 0.0 109.907 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.6 m -65.26 -45.14 85.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.082 1.353 . . . . 0.0 109.272 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -61.35 -48.59 80.58 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.294 1.837 . . . . 0.0 109.437 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -53.7 -48.2 69.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.437 0.637 . . . . 0.0 110.416 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -67.8 -45.26 75.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.915 -0.491 . . . . 0.0 111.221 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.2 tp -62.65 -47.47 83.59 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 123.566 0.746 . . . . 0.0 112.876 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.44 -47.11 80.29 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.085 0.554 . . . . 0.0 109.987 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.69 -45.92 85.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.625 0.648 . . . . 0.0 111.287 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 65.2 mt -62.36 -52.61 57.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -57.15 -45.74 83.34 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 123.938 0.895 . . . . 0.0 111.47 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -58.9 -51.98 67.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.903 -0.57 . . . . 0.0 110.061 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.0 p -61.15 -40.39 93.67 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -67.25 -55.54 13.57 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.692 0.797 . . . . 0.0 109.481 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -56.94 -40.89 77.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.959 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.27 -47.49 85.77 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 119.903 1.229 . . . . 0.0 111.161 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.7 tmm? -57.69 -27.83 63.26 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.569 0.622 . . . . 0.0 110.164 178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -89.55 -27.11 20.48 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.255 -0.903 . . . . 0.0 110.921 178.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.59 -35.08 46.27 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 120.372 1.442 . . . . 0.0 110.35 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 72.9 mt . . . . . 0 CA--C 1.535 0.381 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 179.16 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.2 t60 . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.555 HG23 HG11 ' B' ' 125' ' ' VAL . 2.7 m -65.21 -46.83 79.08 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.116 1.325 . . . . 0.0 109.867 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.34 -34.75 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.932 1.293 . . . . 0.0 110.733 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -63.24 -51.49 66.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.32 1.048 . . . . 0.0 108.444 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.05 -37.98 84.55 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.35 0.523 . . . . 0.0 111.999 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -53.18 61.26 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -34.98 77.05 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.586 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -57.87 -57.1 14.26 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -54.64 -41.1 69.67 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.455 1.025 . . . . 0.0 110.102 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -57.99 -54.5 46.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.174 0.59 . . . . 0.0 111.519 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -71.94 -35.83 69.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.507 0.594 . . . . 0.0 111.497 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 . . . . . 0 C--O 1.225 -0.218 0 C-N-CA 124.98 1.312 . . . . 0.0 111.031 -179.661 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.538 0.496 0 N-CA-C 105.239 -2.134 . . . . 0.0 105.239 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -100.96 130.11 46.9 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -105.92 129.84 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.938 1.695 . . . . 0.0 107.128 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.561 HD23 ' H ' ' B' ' 102' ' ' GLN . 0.6 OUTLIER -126.08 150.18 48.36 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 179.6 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . 0.561 ' H ' HD23 ' B' ' 101' ' ' LEU . 48.9 tt0 -146.33 105.65 3.92 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.951 1.3 . . . . 0.0 113.508 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.4 t -150.48 149.76 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.272 1.396 . . . . 0.0 109.401 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.57 99.27 6.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 121.353 1.888 . . . . 0.0 109.241 178.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.16 133.43 5.29 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 108.125 -1.99 . . . . 0.0 108.125 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -67.93 -58.36 4.67 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 119.563 1.681 . . . . 0.0 112.55 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -67.86 -42.48 81.27 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -51.86 -50.37 61.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.973 1.709 . . . . 0.0 111.442 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -69.67 -51.39 35.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 117.774 -1.108 . . . . 0.0 112.0 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.09 -54.45 24.86 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.125 0.97 . . . . 0.0 112.651 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.21 -55.35 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 123.413 0.685 . . . . 0.0 110.804 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 89.6 mt -64.9 -28.49 69.57 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -52.02 20.62 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.86 1.209 . . . . 0.0 108.114 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -52.59 -50.53 62.85 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 19.3 mt -63.19 -36.12 82.58 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.032 -0.985 . . . . 0.0 112.14 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . 0.545 ' HE3' HD22 ' D' 1101 ' ' LEU . 11.1 tppt? -58.18 -56.59 20.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 120.404 1.456 . . . . 0.0 109.324 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.15 -33.74 76.48 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 119.232 -0.413 . . . . 0.0 110.618 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.3 t -63.69 -47.23 82.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.286 0.948 . . . . 0.0 109.501 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.44 -48.7 71.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.842 -1.075 . . . . 0.0 109.745 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -56.33 -39.37 72.69 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.364 0.984 . . . . 0.0 110.144 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . 0.525 HD12 HG22 ' A' ' 36' ' ' THR . 2.2 mm? -67.35 -47.66 69.78 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.816 -0.552 . . . . 0.0 110.093 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -68.49 -19.42 64.54 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.308 0.504 . . . . 0.0 111.757 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.68 -43.64 20.05 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.088 -1.007 . . . . 0.0 108.692 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -76.38 -32.41 58.57 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . 0.555 HG11 HG23 ' A' ' 36' ' ' THR . 0.9 OUTLIER -94.87 147.57 33.33 Favored Pre-proline 0 N--CA 1.467 0.375 0 CA-C-N 119.45 1.023 . . . . 0.0 109.16 179.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.19 -178.41 3.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.197 1.931 . . . . 0.0 110.905 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.59 48.32 0.35 Allowed Pre-proline 0 CA--C 1.553 1.063 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 -178.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.31 -52.07 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.55 2.167 . . . . 0.0 112.593 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.53 -33.82 73.22 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.502 0.592 . . . . 0.0 109.624 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.14 -43.17 98.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -50.96 71.26 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.721 0.809 . . . . 0.0 111.202 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 74.0 m -66.85 -46.77 74.0 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -58.64 -43.9 89.88 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.733 0.813 . . . . 0.0 109.923 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -48.09 81.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 118.291 -0.861 . . . . 0.0 109.999 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.5 -54.85 40.48 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 118.766 0.712 . . . . 0.0 109.826 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -50.14 66.07 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.435 1.094 . . . . 0.0 111.632 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -65.13 -39.61 93.27 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.337 1.055 . . . . 0.0 110.62 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -56.67 -40.23 75.16 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.183 0.901 . . . . 0.0 109.936 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.4 mt -60.07 -24.39 64.54 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.528 0.731 . . . . 0.0 112.463 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.19 0 C-N-CA 123.854 0.862 . . . . 0.0 112.94 -179.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 CA--C 1.538 0.512 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -90.2 101.72 14.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -105.02 167.26 9.82 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.71 137.66 38.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 94.25 23.41 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.16 122.38 9.22 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.735 2.29 . . . . 0.0 108.508 178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 84.4 t -144.67 148.04 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 125.0 1.32 . . . . 0.0 108.496 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.56 101.86 5.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -169.7 128.28 1.63 Allowed Glycine 0 CA--C 1.524 0.612 0 CA-C-O 115.404 -2.887 . . . . 0.0 109.714 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 36.0 mmm-85 -69.91 -50.3 43.51 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 123.25 3.525 . . . . 0.0 111.45 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -69.25 -36.96 77.7 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -58.19 -52.08 67.05 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 125.455 1.502 . . . . 0.0 110.112 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.2 t80 -63.39 -47.37 82.3 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.276 1.03 . . . . 0.0 110.244 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -53.19 -57.48 10.33 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -40.3 90.42 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.239 0.615 . . . . 0.0 111.566 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.55 -44.01 93.38 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.812 -0.613 . . . . 0.0 110.02 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.02 -48.0 72.57 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.89 0.876 . . . . 0.0 109.813 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.32 -48.63 73.87 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.951 0.5 . . . . 0.0 110.362 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 97.8 mt -65.08 -50.36 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -50.46 -46.55 56.81 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.37 1.068 . . . . 0.0 110.315 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.87 -49.65 67.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.322 -0.847 . . . . 0.0 111.402 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 87.2 p -56.0 -38.87 71.05 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.593 1.088 . . . . 0.0 113.073 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -73.02 -45.83 55.48 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -57.54 -39.15 75.97 Favored 'General case' 0 C--N 1.342 0.265 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -64.04 -45.1 90.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 116.741 -1.6 . . . . 0.0 110.938 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 26.5 ttm -58.49 -43.58 89.07 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.822 1.192 . . . . 0.0 108.381 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -65.67 -34.5 78.35 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.419 0.688 . . . . 0.0 112.251 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -81.09 -36.82 29.9 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.726 1.148 . . . . 0.0 111.806 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 50.1 mt . . . . . 0 CA--C 1.545 0.751 0 C-N-CA 126.016 1.726 . . . . 0.0 111.115 -178.636 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 1.9 t60 . . . . . 0 CA--C 1.537 0.46 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . 0.576 HG23 HG21 ' D' 1125 ' ' VAL . 17.3 m -62.3 -40.53 96.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.391 1.077 . . . . 0.0 110.89 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.92 -43.8 93.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.11 -47.54 84.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.751 -1.118 . . . . 0.0 108.764 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -35.95 64.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.358 1.435 . . . . 0.0 111.929 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -53.91 32.13 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -36.63 84.64 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.727 -0.608 . . . . 0.0 111.06 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -59.31 -48.13 82.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.907 1.283 . . . . 0.0 108.75 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -63.09 -44.31 96.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.514 1.052 . . . . 0.0 109.173 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -55.03 -43.03 73.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.996 0.919 . . . . 0.0 110.623 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.56 -42.75 58.23 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.104 0.962 . . . . 0.0 110.326 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 . . . . . 0 C--O 1.224 -0.262 0 C-N-CA 123.938 0.895 . . . . 0.0 110.777 -179.853 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 17.3 m . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -101.89 128.99 48.04 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -106.58 155.28 19.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . 0.545 HD22 ' HE3' ' B' ' 116' ' ' LYS . 0.8 OUTLIER -152.48 127.97 10.01 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 179.389 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -119.93 106.2 11.81 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.026 2.13 . . . . 0.0 112.058 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 21.2 t -155.35 150.1 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.962 1.305 . . . . 0.0 110.37 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.44 103.37 11.46 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.7 116.98 1.2 Allowed Glycine 0 CA--C 1.51 -0.23 0 N-CA-C 104.615 -3.394 . . . . 0.0 104.615 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -65.76 -57.7 7.38 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.092 1.946 . . . . 0.0 113.644 -177.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -71.99 -38.85 69.58 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 119.424 1.011 . . . . 0.0 108.414 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -54.73 -50.49 68.24 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.282 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 13.9 t80 -64.69 -42.63 95.2 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 119.562 1.073 . . . . 0.0 110.432 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.12 -54.28 38.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.055 0.843 . . . . 0.0 110.942 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.73 -57.5 10.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 126.668 1.987 . . . . 0.0 111.057 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 57.1 mt -58.89 -36.34 74.51 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.651 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.9 tmt? -70.25 -52.13 25.37 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.755 1.161 . . . . 0.0 108.778 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.1 ttmm -51.97 -51.88 54.19 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 65.7 mt -65.7 -32.34 73.84 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.152 -0.928 . . . . 0.0 112.146 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -63.33 -48.29 78.62 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.586 1.539 . . . . 0.0 108.719 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -66.67 -41.53 88.0 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.77 -42.2 75.15 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.513 0.725 . . . . 0.0 110.267 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.88 -52.45 50.07 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.093 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.01 -43.01 86.44 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.588 1.086 . . . . 0.0 110.355 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.5 mm? -61.42 -48.97 78.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.44 0.696 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.45 -28.0 67.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.063 -0.398 . . . . 0.0 111.585 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -80.31 -23.29 40.76 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 126.693 1.997 . . . . 0.0 113.129 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -94.64 -27.51 15.84 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.287 0.635 . . . . 0.0 110.41 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . 0.576 HG21 HG23 ' C' 1036 ' ' THR . 81.2 t -95.2 147.46 33.07 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 124.936 1.294 . . . . 0.0 109.111 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . 0.425 ' HD2' HG13 ' D' 1125 ' ' VAL . 67.3 Cg_endo -71.3 -173.11 0.86 Allowed 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.926 2.417 . . . . 0.0 110.432 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.27 35.71 0.11 Allowed Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 117.749 2.5 . . . . 0.0 117.749 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.73 -51.41 4.97 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 123.446 2.267 . . . . 0.0 114.281 -178.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.26 -40.14 92.97 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.0 t -57.56 -47.77 84.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.434 0 C-N-CA 123.668 0.787 . . . . 0.0 109.406 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 44.5 t0 -60.58 -52.01 66.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.509 1.124 . . . . 0.0 110.465 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 41.3 m -60.9 -42.36 97.88 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.905 -0.497 . . . . 0.0 111.743 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.69 -52.33 39.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.914 0.886 . . . . 0.0 109.517 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.5 69.15 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.262 1.425 . . . . 0.0 111.193 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -67.32 -47.98 68.95 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.492 1.042 . . . . 0.0 110.86 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -58.86 -42.53 89.64 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.224 0.92 . . . . 0.0 109.692 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -65.18 -32.68 74.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.312 1.445 . . . . 0.0 109.2 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -59.54 -44.3 93.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.7 mt -64.39 -11.22 30.58 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.482 1.113 . . . . 0.0 113.577 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 13.2 tp . . . . . 0 CA--C 1.535 0.393 0 CA-C-N 119.726 1.148 . . . . 0.0 110.167 178.853 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 121.151 0.5 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tp -73.12 106.18 4.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.48 161.08 15.38 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -136.32 116.41 13.37 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.425 2.29 . . . . 0.0 105.797 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.82 105.16 15.4 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -75.23 117.13 4.75 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.325 2.683 . . . . 0.0 110.272 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.7 t -145.11 150.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 123.563 0.745 . . . . 0.0 109.532 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -135.11 102.21 5.12 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.862 -1.149 . . . . 0.0 109.837 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.0 135.2 3.53 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 107.529 -2.229 . . . . 0.0 107.529 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -70.78 -52.25 21.85 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.561 2.181 . . . . 0.0 110.419 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -30.81 64.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.68 1.192 . . . . 0.0 108.888 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.4 m -60.89 -49.92 75.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.74 1.216 . . . . 0.0 107.739 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -62.86 -39.9 95.84 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.264 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.46 -57.41 11.31 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.013 0.824 . . . . 0.0 111.704 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 35.6 ttm -57.71 -44.7 86.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.597 0.635 . . . . 0.0 110.359 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.6 mt -59.54 -48.57 81.15 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.382 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.76 -40.95 88.46 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.576 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.18 -49.45 76.99 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.247 1.385 . . . . 0.0 109.56 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.47 HD11 ' CG2' ' D' 1111 ' ' ILE . 93.5 mt -67.15 -51.57 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.701 -0.625 . . . . 0.0 109.769 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HE3' HG22 ' C' 1010 ' ' VAL . 12.3 tmtt? -56.69 -48.56 77.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 117.814 -1.089 . . . . 0.0 112.146 -178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.19 -55.79 30.37 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.4 m -56.74 -36.36 69.66 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.49 -37.89 50.29 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.981 0.81 . . . . 0.0 111.925 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -63.8 -50.36 69.27 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.269 -0.895 . . . . 0.0 108.692 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.413 HD13 ' HB ' ' B' ' 130' ' ' VAL . 77.3 mt -61.08 -52.08 66.44 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.861 1.265 . . . . 0.0 111.376 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.3 ppp? -56.93 -45.9 82.42 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.267 0.939 . . . . 0.0 111.854 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -74.34 -29.37 61.56 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.254 0.934 . . . . 0.0 112.879 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -71.03 -47.15 60.25 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.955 0.798 . . . . 0.0 110.425 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.1 tp . . . . . 0 CA--C 1.54 0.574 0 C-N-CA 124.855 1.262 . . . . 0.0 108.741 -179.337 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 . . . . . 0 C--O 1.224 -0.284 0 CA-C-O 118.52 -0.752 . . . . 0.0 112.267 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -58.2 -51.26 70.5 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.485 1.039 . . . . 0.0 110.766 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.32 -42.26 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.904 1.682 . . . . 0.0 109.704 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.56 -42.82 67.35 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.417 0.687 . . . . 0.0 111.535 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.281 1.433 . . . . 0.0 109.912 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.67 -51.11 70.76 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -55.23 -48.51 73.81 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.412 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -56.91 -42.07 79.26 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.75 0.82 . . . . 0.0 110.818 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -55.04 -54.76 38.95 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.777 1.231 . . . . 0.0 111.497 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -78.23 -40.76 36.37 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.339 0.518 . . . . 0.0 111.709 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -55.61 -41.09 72.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.51 1.124 . . . . 0.0 111.713 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 . . . . . 0 CA--C 1.534 0.33 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.159 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -102.4 130.28 49.11 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.59 116.94 27.06 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.567 1.147 . . . . 0.0 108.4 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.52 141.34 35.51 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -140.47 104.35 4.75 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.0 m -155.49 150.57 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 112.011 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -110.75 101.92 10.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.214 1.37 . . . . 0.0 108.187 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.66 116.13 0.91 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-O 116.763 -2.132 . . . . 0.0 108.916 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -66.88 -57.14 7.57 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 121.717 2.759 . . . . 0.0 113.425 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -66.29 -44.63 82.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -52.12 -50.51 61.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 125.756 1.622 . . . . 0.0 110.908 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -63.97 -47.07 81.85 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.942 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -51.21 -53.87 30.97 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 124.063 0.852 . . . . 0.0 110.427 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.7 mt -60.17 -58.22 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 125.251 1.42 . . . . 0.0 110.494 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mp -55.62 -44.24 76.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 117.824 -1.084 . . . . 0.0 113.232 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 22.4 ttp -62.73 -48.07 80.84 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 119.907 1.231 . . . . 0.0 109.961 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -55.76 -50.94 69.06 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 118.428 0.558 . . . . 0.0 110.274 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 mt -65.51 -30.73 71.53 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 24.8 tptt -64.51 -60.0 3.66 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.65 -44.6 81.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.194 0.998 . . . . 0.0 110.896 -179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 31.0 t -52.55 -46.45 66.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.041 0.937 . . . . 0.0 110.33 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.67 -45.88 56.66 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.984 0.514 . . . . 0.0 111.204 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -56.34 -39.88 73.56 Favored 'General case' 0 C--O 1.238 0.473 0 O-C-N 121.672 -0.642 . . . . 0.0 110.343 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.75 -53.88 23.75 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.137 0.975 . . . . 0.0 108.523 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.31 -39.69 67.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.833 0.742 . . . . 0.0 112.401 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -73.3 -29.27 62.6 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.372 1.069 . . . . 0.0 110.4 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 20.8 tp -86.31 -33.23 20.67 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.853 -1.154 . . . . 0.0 113.643 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 12.4 m -94.97 148.27 34.43 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 120.019 1.281 . . . . 0.0 110.883 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.62 -174.93 1.19 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.187 1.925 . . . . 0.0 109.066 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -113.58 82.13 6.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 O-C-N 121.614 -0.678 . . . . 0.0 112.244 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -80.86 -102.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.494 0 C-N-CA 124.181 3.254 . . . . 0.0 111.873 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.27 -35.7 65.31 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.541 -1.35 . . . . 0.0 109.99 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.413 ' HB ' HD13 ' A' ' 28' ' ' LEU . 3.7 m -56.39 -37.03 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 C-N-CA 124.351 1.06 . . . . 0.0 112.581 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.29 -46.67 22.27 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 6.1 m -56.23 -42.46 77.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 123.385 0.428 . . . . 0.0 110.329 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -67.78 -50.53 56.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 126.168 1.787 . . . . 0.0 108.315 178.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -52.85 -47.74 67.55 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.601 1.091 . . . . 0.0 111.134 -178.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.85 -42.2 86.12 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.172 0.897 . . . . 0.0 112.559 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.84 -38.28 82.97 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.525 -0.734 . . . . 0.0 110.517 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -46.81 78.0 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.53 -35.11 65.31 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.55 1.54 . . . . 0.0 110.975 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.32 -24.47 29.07 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.356 1.434 . . . . 0.0 111.832 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.4 tt . . . . . 0 CA--C 1.532 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 110.265 179.222 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.1 tp -69.19 95.53 0.76 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.85 0.86 . . . . 0.0 109.247 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.21 170.97 9.02 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.739 1.216 . . . . 0.0 109.519 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -146.12 154.62 42.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.973 1.309 . . . . 0.0 108.532 179.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -125.36 91.97 47.91 Favored Pre-proline 0 N--CA 1.45 -0.439 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.94 112.4 3.28 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.592 2.194 . . . . 0.0 107.033 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . 0.5 HG22 ' HE3' ' A' ' 23' ' ' LYS . 46.7 t -144.83 155.7 14.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -135.44 103.76 5.59 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.67 112.69 0.51 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 105.62 -2.992 . . . . 0.0 105.62 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -59.49 -51.91 67.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 122.172 2.986 . . . . 0.0 108.615 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -71.04 -39.95 72.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.221 1.009 . . . . 0.0 111.145 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -63.51 -42.16 98.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.45 0.7 . . . . 0.0 110.261 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 71.2 t80 -61.68 -45.14 95.29 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.769 1.228 . . . . 0.0 108.89 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -56.64 -50.43 72.08 Favored 'General case' 0 N--CA 1.462 0.161 0 O-C-N 123.28 0.363 . . . . 0.0 110.857 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.3 ttm -64.79 -46.08 83.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.117 0.567 . . . . 0.0 111.293 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 46.9 mt -60.46 -46.48 89.91 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.403 -178.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.69 -49.04 70.0 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.265 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.91 -49.7 70.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.388 0.675 . . . . 0.0 111.468 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 79.2 mt -70.17 -39.27 76.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.647 -0.658 . . . . 0.0 110.372 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -61.26 -45.47 94.37 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.56 0.744 . . . . 0.0 110.752 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -52.26 65.89 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.0 0.92 . . . . 0.0 108.654 -179.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 26.7 m -58.1 -45.87 86.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 123.479 0.712 . . . . 0.0 112.33 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.43 -36.39 81.14 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.869 0.758 . . . . 0.0 111.099 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.59 -48.49 66.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 121.638 -0.664 . . . . 0.0 111.421 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.47 -40.66 70.13 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.071 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 5.2 ppp? -62.49 -40.22 95.99 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.316 0.962 . . . . 0.0 109.928 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -76.21 -34.89 59.27 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 118.961 0.8 . . . . 0.0 111.438 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 59.9 t80 -69.56 -40.06 77.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.088 0.858 . . . . 0.0 112.626 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 28.4 tp . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.735 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 5.9 m-70 . . . . . 0 N--CA 1.466 0.352 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.0 m -56.31 -52.23 65.28 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.697 1.135 . . . . 0.0 110.22 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.96 -46.21 92.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 128.243 2.617 . . . . 0.0 111.424 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -69.87 -47.5 62.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.809 -0.615 . . . . 0.0 111.642 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.7 m -55.12 -39.28 69.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.81 0.844 . . . . 0.0 109.062 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -53.58 49.23 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.272 0.629 . . . . 0.0 110.695 178.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -57.49 -44.27 84.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 118.795 -0.621 . . . . 0.0 110.046 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -54.61 -44.09 72.77 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.147 0.579 . . . . 0.0 110.208 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -61.83 -55.29 31.41 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.0 -44.06 73.55 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.86 0.755 . . . . 0.0 112.602 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -55.99 -36.36 67.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.521 1.529 . . . . 0.0 112.308 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 . . . . . 0 CA--C 1.536 0.429 0 CA-C-N 118.635 0.652 . . . . 0.0 110.862 -179.744 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.236 0.349 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -102.38 157.23 17.06 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -137.27 158.02 45.35 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.96 0.504 . . . . 0.0 109.728 -179.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 1.3 mt -152.51 108.68 3.39 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -102.08 98.74 8.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.13 2.572 . . . . 0.0 105.874 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.3 m -151.86 151.43 12.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 C-N-CA 124.783 1.233 . . . . 0.0 110.046 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -122.26 102.35 8.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 118.994 0.815 . . . . 0.0 112.056 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.42 113.37 0.79 Allowed Glycine 0 CA--C 1.504 -0.621 0 N-CA-C 105.179 -3.168 . . . . 0.0 105.179 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.39 -56.85 16.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 119.667 1.734 . . . . 0.0 110.623 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 37.9 mttp -62.62 -49.31 75.69 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.289 1.036 . . . . 0.0 108.624 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -52.46 -49.54 64.44 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.89 1.276 . . . . 0.0 111.251 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.5 t80 -65.12 -39.92 93.76 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 119.412 1.005 . . . . 0.0 111.77 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -54.57 -53.56 52.91 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.209 0.913 . . . . 0.0 108.805 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . 0.47 ' CG2' HD11 ' A' ' 22' ' ' ILE . 37.8 mt -62.38 -57.79 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.998 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.66 -45.38 81.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 116.953 -1.499 . . . . 0.0 113.81 -178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 2.0 ttt -61.79 -49.0 78.09 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 120.851 1.66 . . . . 0.0 109.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -57.31 -52.06 66.87 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.47 -25.89 66.93 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.778 -0.576 . . . . 0.0 112.122 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.4 tptt -63.06 -60.54 3.3 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 118.901 0.773 . . . . 0.0 109.303 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.98 -31.95 73.44 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 124.679 1.237 . . . . 0.0 111.459 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 33.4 t -55.16 -51.99 64.72 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.016 0.826 . . . . 0.0 109.173 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.22 -42.89 79.12 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 122.197 0.199 . . . . 0.0 110.878 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -59.19 -45.0 92.22 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.531 -0.73 . . . . 0.0 110.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 30.6 mt -65.78 -53.82 35.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.189 0.995 . . . . 0.0 109.773 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.66 -34.24 69.17 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.885 0.766 . . . . 0.0 110.834 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -79.04 -22.21 45.74 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.712 1.142 . . . . 0.0 110.369 178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 48.9 tp -90.48 -34.3 15.63 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 120.688 -1.257 . . . . 0.0 113.124 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 13.8 m -95.28 147.45 33.04 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 119.763 1.165 . . . . 0.0 110.832 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.0 178.04 5.78 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.075 1.85 . . . . 0.0 108.721 178.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -108.89 87.85 4.93 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -84.98 -100.45 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.327 0 C-N-CA 124.048 3.165 . . . . 0.0 108.884 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.8 -32.99 64.0 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 126.545 1.938 . . . . 0.0 111.269 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.1 m -56.9 -41.33 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 118.869 0.758 . . . . 0.0 110.755 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -74.68 -45.45 44.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.416 1.086 . . . . 0.0 109.425 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 43.5 m -61.31 -38.47 86.98 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 20.2 t80 -67.28 -52.58 38.97 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.911 1.285 . . . . 0.0 107.699 178.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -48.24 69.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.394 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -61.71 -53.9 49.79 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.819 0.736 . . . . 0.0 111.42 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -58.14 -40.51 81.52 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.806 -0.558 . . . . 0.0 111.425 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.69 -33.61 71.1 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.852 0.861 . . . . 0.0 110.144 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.64 -32.86 73.97 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.912 1.285 . . . . 0.0 108.912 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 77.3 mt -54.75 -25.31 26.95 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.112 0.869 . . . . 0.0 112.387 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.535 0.375 0 C-N-CA 125.219 1.408 . . . . 0.0 111.054 -179.94 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 . . . . . 0 CA--C 1.534 0.344 0 CA-C-O 120.04 -0.028 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 47.6 tp -72.0 118.01 14.34 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.832 0.853 . . . . 0.0 108.777 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.2 mp -113.92 162.45 16.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.369 1.867 . . . . 0.0 107.388 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -135.23 124.25 24.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.13 96.05 1.13 Allowed Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.49 1.516 . . . . 0.0 108.782 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.31 103.51 1.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.489 2.793 . . . . 0.0 112.021 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -138.61 156.16 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.514 -1.366 . . . . 0.0 109.14 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -135.31 103.11 5.39 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 104.743 -2.317 . . . . 0.0 104.743 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 114.53 0.59 Allowed Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 106.716 -2.554 . . . . 0.0 106.716 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.0 tpt85 -64.52 -51.04 64.95 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 120.519 2.16 . . . . 0.0 110.535 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.46 -32.47 71.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.805 0.73 . . . . 0.0 110.684 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -66.64 -50.93 61.35 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 110.28 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -56.87 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.877 0.871 . . . . 0.0 109.015 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -55.65 -49.5 72.74 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.418 0.287 . . . . 0.0 110.587 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.6 ttm -61.17 -47.25 87.04 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.67 0.668 . . . . 0.0 111.281 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.64 -32.07 73.44 Favored 'General case' 0 C--O 1.227 -0.099 0 CA-C-O 118.53 -0.748 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -71.23 -53.97 12.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.468 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.05 -48.83 77.59 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.121 0.968 . . . . 0.0 111.181 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.0 mt -71.98 -36.96 59.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 O-C-N 121.527 -0.733 . . . . 0.0 111.574 -178.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -66.31 -52.44 47.21 Favored 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 121.063 -1.023 . . . . 0.0 109.228 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.64 -37.31 87.14 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.938 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -56.13 -52.11 65.5 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.289 0.95 . . . . 0.0 109.459 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -65.98 -48.43 71.27 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.11 0.564 . . . . 0.0 111.666 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -50.59 73.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-N 118.416 0.553 . . . . 0.0 111.149 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.11 -38.86 92.6 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 117.692 -1.147 . . . . 0.0 109.786 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.43 -28.94 67.41 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.22 1.008 . . . . 0.0 110.208 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -90.98 -30.79 16.62 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.468 -0.77 . . . . 0.0 111.018 178.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -78.67 -25.32 44.87 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 118.149 -0.929 . . . . 0.0 113.206 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 179.309 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.0 m170 . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.2 m -66.6 -32.58 74.01 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.55 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.0 mm -62.27 -47.42 93.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.99 -53.94 51.86 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.661 0.785 . . . . 0.0 110.909 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.6 m -58.08 -50.17 74.38 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.384 1.874 . . . . 0.0 110.51 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.97 -49.41 77.96 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.507 0.723 . . . . 0.0 110.014 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.0 mtp85 -58.92 -43.19 91.05 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -61.32 -55.06 36.02 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.317 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -53.19 -54.31 37.76 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.924 0.89 . . . . 0.0 110.381 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -53.6 -47.92 69.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.037 1.335 . . . . 0.0 111.153 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -67.42 -46.09 74.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.71 0.804 . . . . 0.0 111.484 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 . . . . . 0 CA--C 1.528 0.1 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.023 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 N--CA 1.465 0.321 0 N-CA-C 107.977 -1.119 . . . . 0.0 107.977 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -111.0 139.57 46.24 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -124.75 144.1 50.42 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.874 1.67 . . . . 0.0 110.691 -177.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.6 mp -131.17 145.77 52.08 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.487 1.515 . . . . 0.0 108.872 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -145.64 107.4 4.28 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.133 1.773 . . . . 0.0 108.357 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 70.7 t -155.63 151.16 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 127.306 2.242 . . . . 0.0 108.498 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -107.51 101.71 11.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 177.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.73 114.54 0.87 Allowed Glycine 0 CA--C 1.523 0.563 0 CA-C-O 116.851 -2.083 . . . . 0.0 108.092 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -68.17 -58.48 4.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.854 2.827 . . . . 0.0 113.963 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -62.74 -46.44 88.07 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -54.97 -44.53 74.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 124.302 1.001 . . . . 0.0 112.031 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -65.21 -48.58 72.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 120.078 1.308 . . . . 0.0 110.789 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -58.7 -49.44 77.58 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.645 1.111 . . . . 0.0 110.816 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 68.8 mt -61.51 -53.68 45.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.312 1.445 . . . . 0.0 111.311 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 8.8 mt -63.58 -35.83 81.79 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 117.476 -1.25 . . . . 0.0 110.573 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 30.5 mtp -62.13 -46.66 88.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 120.491 1.496 . . . . 0.0 110.87 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -64.21 -51.83 61.78 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.924 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 85.3 mt -60.68 -34.82 74.91 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.5 tppt? -63.73 -53.83 44.91 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -62.51 -45.75 91.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.7 0.625 . . . . 0.0 111.95 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 22.5 m -57.09 -38.53 73.5 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.524 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -45.28 72.59 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.851 0.751 . . . . 0.0 109.77 179.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -58.84 -44.54 90.97 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.85 -32.82 69.96 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.535 -0.728 . . . . 0.0 110.086 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 27.0 ttt -66.97 -40.99 87.6 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.73 -31.37 72.33 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 118.46 0.573 . . . . 0.0 110.638 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 tp -71.53 -34.28 69.91 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.341 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.2 m -94.51 148.95 35.82 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 119.424 1.011 . . . . 0.0 112.636 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.5 -91.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.918 0 N-CA-C 107.395 -1.809 . . . . 0.0 107.395 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -160.96 57.82 0.91 Allowed Pre-proline 0 CA--C 1.546 0.793 0 CA-C-N 120.99 1.723 . . . . 0.0 111.341 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.37 -88.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.868 2.379 . . . . 0.0 112.365 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.91 -25.77 67.3 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.365 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.6 t -56.83 -55.0 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.521 1.129 . . . . 0.0 108.712 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.16 -42.1 84.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.405 1.002 . . . . 0.0 110.53 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.6 -49.76 69.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.889 0.476 . . . . 0.0 111.256 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -70.36 -48.62 55.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.681 1.592 . . . . 0.0 110.344 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -56.54 -41.44 76.83 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.289 0.95 . . . . 0.0 110.47 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -63.58 -51.74 64.03 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.275 0.943 . . . . 0.0 108.823 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -55.3 -41.92 72.98 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.492 0.717 . . . . 0.0 109.602 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.54 -28.12 63.65 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.386 -0.821 . . . . 0.0 110.475 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -63.05 -36.36 83.32 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 34.1 mt -66.48 -2.74 4.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.798 0.839 . . . . 0.0 111.861 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 126.726 2.01 . . . . 0.0 110.11 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.8 tp10 . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 103.083 -2.932 . . . . 0.0 103.083 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.59 106.9 0.72 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.64 165.58 12.64 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 125.145 1.378 . . . . 0.0 108.973 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -135.06 149.66 50.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.251 1.421 . . . . 0.0 107.481 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.6 89.73 45.0 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.05 111.28 3.24 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.6 2.867 . . . . 0.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 50.2 t -145.61 162.28 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 124.123 0.969 . . . . 0.0 109.03 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . 0.413 ' HG2' HH11 ' C' 1011 ' ' ARG . 8.7 ptt-85 -134.91 104.76 6.1 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 103.438 -2.801 . . . . 0.0 103.438 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.04 108.94 0.33 Allowed Glycine 0 C--O 1.227 -0.292 0 CA-C-O 117.206 -1.886 . . . . 0.0 109.15 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 26.8 tpt85 -61.03 -52.76 63.61 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.818 2.309 . . . . 0.0 112.565 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.52 -30.83 53.06 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.348 -0.845 . . . . 0.0 112.192 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -40.29 76.82 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 41.3 t80 -62.33 -51.33 68.05 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -49.84 -57.36 7.56 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.011 0.924 . . . . 0.0 110.952 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 7.9 tmm? -60.39 -49.06 79.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.7 -34.42 78.26 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 119.15 0.886 . . . . 0.0 111.267 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.0 mm? -68.14 -48.28 65.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.542 1.065 . . . . 0.0 109.613 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -58.8 -48.78 80.08 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.317 0.647 . . . . 0.0 110.447 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.4 mt -67.79 -44.33 85.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 118.191 0.45 . . . . 0.0 111.292 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -63.08 -46.07 89.13 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 119.003 0.82 . . . . 0.0 109.028 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -60.37 -48.74 80.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.893 0.877 . . . . 0.0 108.773 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 20.4 t -53.45 -52.07 60.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.718 0.807 . . . . 0.0 111.247 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.44 -58.06 6.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.289 1.435 . . . . 0.0 112.831 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -46.67 88.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -177.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.29 -39.59 92.74 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 117.69 -1.148 . . . . 0.0 109.684 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -59.12 -31.75 69.22 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.034 0.833 . . . . 0.0 109.322 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -80.68 -30.56 36.48 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.846 0.748 . . . . 0.0 110.842 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -75.88 -45.63 34.49 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.318 1.047 . . . . 0.0 113.135 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 4.6 pp . . . . . 0 C--O 1.24 0.558 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -177.369 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 11.5 m170 . . . . . 0 CA--C 1.536 0.424 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 1.9 m -65.41 -36.2 83.21 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.52 -1.362 . . . . 0.0 110.948 -179.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.4 mm -59.47 -44.26 92.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 119.613 1.097 . . . . 0.0 108.209 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.29 -58.32 9.14 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.455 1.102 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 53.1 m -61.33 -31.34 71.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.609 0.764 . . . . 0.0 111.924 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.11 -53.72 18.75 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.73 -41.25 81.44 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 122.993 0.517 . . . . 0.0 110.46 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -55.67 -57.54 11.54 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.253 1.021 . . . . 0.0 110.557 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -68.2 -35.78 78.52 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.887 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -57.79 -48.6 79.23 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.391 0.996 . . . . 0.0 109.545 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -68.27 -29.81 68.69 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.492 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 . . . . . 0 CA--C 1.538 0.514 0 CA-C-N 120.248 1.386 . . . . 0.0 109.494 177.976 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 79.6 m . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.09 144.46 49.3 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.56 161.12 32.22 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.822 1.249 . . . . 0.0 112.248 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.0 mp -145.36 133.07 21.01 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.34 106.75 9.73 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 104.351 -2.463 . . . . 0.0 104.351 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 40.1 t -152.49 142.25 14.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 118.52 0.6 . . . . 0.0 109.601 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.8 100.62 9.82 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.39 115.06 0.84 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.365 -2.694 . . . . 0.0 106.365 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -57.77 10.68 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.682 2.741 . . . . 0.0 111.823 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 22.0 mmtt -63.31 -48.55 77.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -52.16 -44.17 64.48 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 123.929 0.892 . . . . 0.0 111.71 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 27.8 t80 -67.08 -50.08 62.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.061 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.33 -49.28 74.8 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.169 0.895 . . . . 0.0 110.945 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.79 -53.43 48.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 124.79 1.236 . . . . 0.0 109.61 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.75 -28.03 68.74 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.162 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 7.7 mtp -64.89 -51.8 60.0 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 120.401 1.455 . . . . 0.0 109.834 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -48.22 82.58 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 123.412 0.445 . . . . 0.0 110.245 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.211 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -55.78 -54.93 38.41 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.733 0.813 . . . . 0.0 108.896 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -58.74 -53.83 53.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.764 1.226 . . . . 0.0 110.425 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 38.2 m -56.78 -42.71 79.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.323 -0.846 . . . . 0.0 112.575 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.81 -34.8 78.98 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.761 1.164 . . . . 0.0 110.367 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -68.2 -40.35 82.21 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . 0.401 HD13 ' HA ' ' D' 1121 ' ' LEU . 3.7 mm? -69.85 -35.34 74.64 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.28 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.2 ttt -61.27 -49.98 74.87 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.2 -28.84 68.41 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.011 0.823 . . . . 0.0 111.301 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.8 tm? -68.97 -32.91 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.387 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 32.3 m -91.08 147.04 34.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 119.897 1.226 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -72.32 -79.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.927 2.418 . . . . 0.0 111.058 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -165.44 64.24 0.98 Allowed Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.003 1.321 . . . . 0.0 109.834 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -80.78 -106.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 123.664 2.909 . . . . 0.0 113.264 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.62 -32.12 68.73 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.757 1.223 . . . . 0.0 110.145 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 14.1 t -54.24 -53.79 26.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.124 1.37 . . . . 0.0 109.277 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.32 -40.41 95.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.795 1.638 . . . . 0.0 110.981 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -61.91 -50.6 71.54 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.67 -33.39 74.83 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.197 0.599 . . . . 0.0 109.945 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -59.17 -47.23 86.06 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -60.58 -51.99 67.05 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -53.75 -44.71 70.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.794 1.238 . . . . 0.0 112.509 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.23 -29.16 57.45 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.245 -0.909 . . . . 0.0 111.055 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 30.7 tp60 -63.89 -35.3 80.2 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.258 -0.901 . . . . 0.0 109.312 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.14 -31.94 61.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.446 0.699 . . . . 0.0 111.357 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 C-N-CA 123.405 0.682 . . . . 0.0 112.49 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 . . . . . 0 N--CA 1.453 -0.275 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.6 tp -76.7 101.58 5.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 124.206 1.002 . . . . 0.0 108.771 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.6 mt -94.53 158.67 15.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 106.76 -1.571 . . . . 0.0 106.76 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -129.69 123.04 30.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -98.07 99.34 6.81 Favored Pre-proline 0 N--CA 1.447 -0.586 0 C-N-CA 124.033 0.933 . . . . 0.0 109.346 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.06 126.85 10.19 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.383 2.056 . . . . 0.0 107.259 177.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.3 t -146.05 146.27 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 119.203 0.911 . . . . 0.0 109.825 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.6 ptt85 -135.97 101.17 4.64 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.44 130.96 2.22 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 105.209 -3.156 . . . . 0.0 105.209 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.6 tpp85 -70.18 -52.07 26.23 Favored 'General case' 0 CA--C 1.524 -0.047 0 CA-C-N 120.869 2.334 . . . . 0.0 111.08 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -70.37 -34.72 72.93 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -57.28 -42.66 82.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.825 0.85 . . . . 0.0 108.717 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -67.0 -53.13 34.27 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 118.521 -0.752 . . . . 0.0 109.115 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -52.84 -57.23 10.91 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.162 0.985 . . . . 0.0 111.798 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -57.76 -53.6 56.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.594 0.758 . . . . 0.0 111.683 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -46.81 83.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.946 0.899 . . . . 0.0 112.119 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tt -67.79 -55.5 12.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.809 1.643 . . . . 0.0 111.275 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.26 -48.44 74.0 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 118.505 -0.76 . . . . 0.0 111.548 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.9 mt -61.37 -46.32 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 119.289 0.95 . . . . 0.0 108.913 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.3 tmtt? -55.9 -39.24 71.31 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-O 116.889 -1.529 . . . . 0.0 110.087 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -64.98 -39.5 93.58 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.71 1.141 . . . . 0.0 111.316 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.64 -52.03 66.88 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.787 0.722 . . . . 0.0 110.996 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -70.09 -37.74 75.49 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.183 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -61.77 -54.14 46.47 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-O 117.879 -1.057 . . . . 0.0 109.136 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.43 -38.98 91.52 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.577 1.08 . . . . 0.0 110.566 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.3 ttt -58.05 -32.93 68.48 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.387 0.54 . . . . 0.0 109.8 178.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -88.91 -39.37 13.83 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.296 1.038 . . . . 0.0 111.468 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.438 1.095 . . . . 0.0 111.402 -179.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp . . . . . 0 CA--C 1.535 0.377 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 179.018 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.1 t60 . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.72 -44.18 77.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 119.19 0.904 . . . . 0.0 112.747 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.8 mm -66.37 -43.62 91.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 124.831 1.252 . . . . 0.0 110.337 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.01 -52.81 63.97 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.208 2.203 . . . . 0.0 108.488 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.9 m -65.18 -39.47 92.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.947 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.08 -46.78 87.4 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 119.974 1.261 . . . . 0.0 108.977 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -48.35 69.26 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.165 0.986 . . . . 0.0 109.258 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -64.04 -55.68 20.5 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.201 1.4 . . . . 0.0 111.531 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -58.33 -38.19 76.64 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.919 1.236 . . . . 0.0 112.346 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -63.37 -51.2 66.86 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.01 -41.24 97.85 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.276 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 . . . . . 0 CA--C 1.531 0.236 0 C-N-CA 124.919 1.288 . . . . 0.0 112.491 -179.451 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 5.1 m . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -101.37 144.84 29.7 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -126.16 159.03 34.02 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.52 0.728 . . . . 0.0 109.802 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.0 mp -139.69 152.28 46.57 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -142.89 98.49 3.29 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.167 1.787 . . . . 0.0 107.968 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.53 150.81 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.496 0.719 . . . . 0.0 111.074 -178.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -116.66 102.77 9.73 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . 0.483 ' HA3' HD22 ' B' ' 108' ' ' ASN . . . -142.81 124.36 2.35 Favored Glycine 0 C--N 1.331 0.257 0 N-CA-C 107.564 -2.214 . . . . 0.0 107.564 177.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -67.62 -58.08 5.3 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 120.481 2.14 . . . . 0.0 110.424 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.9 -40.92 91.96 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 121.533 -0.729 . . . . 0.0 109.579 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . 0.483 HD22 ' HA3' ' B' ' 105' ' ' GLY . 84.5 m-20 -55.27 -50.55 69.22 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.437 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.62 -47.39 86.41 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.671 -178.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -53.86 49.82 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.764 0.793 . . . . 0.0 111.092 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 89.9 mt -61.01 -56.06 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.104 1.761 . . . . 0.0 111.506 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -61.6 -39.53 91.55 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 118.469 -0.777 . . . . 0.0 111.219 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 15.3 ttt -66.96 -52.33 44.2 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.168 0.895 . . . . 0.0 108.873 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -52.32 -52.05 55.26 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.183 0.593 . . . . 0.0 110.466 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.85 -38.38 79.74 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.207 -0.901 . . . . 0.0 112.859 -178.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.3 tptp -66.36 -41.84 88.91 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 120.525 1.511 . . . . 0.0 110.232 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.43 -44.36 97.26 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.803 1.241 . . . . 0.0 107.831 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 24.7 t -61.12 -44.9 96.63 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.999 1.32 . . . . 0.0 109.799 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -68.42 -31.83 71.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 117.223 -1.37 . . . . 0.0 110.319 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -60.91 -43.13 99.0 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 121.222 1.828 . . . . 0.0 107.723 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.24 -53.95 41.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.823 0.849 . . . . 0.0 110.373 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 17.2 tpt -62.36 -30.25 71.04 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -77.38 -29.19 53.13 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.921 -1.112 . . . . 0.0 110.032 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.94 -33.45 22.68 Favored 'General case' 0 C--N 1.344 0.349 0 O-C-N 121.241 -0.912 . . . . 0.0 113.34 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -95.83 148.83 35.17 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 126.59 1.956 . . . . 0.0 112.184 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -70.49 -179.54 3.32 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.423 2.082 . . . . 0.0 111.037 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -113.21 46.91 0.35 Allowed Pre-proline 0 CA--C 1.557 1.232 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -64.4 -65.99 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.879 2.386 . . . . 0.0 113.036 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.48 -26.69 68.04 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.298 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.25 -56.74 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.595 1.089 . . . . 0.0 109.092 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -65.91 -31.95 73.17 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.805 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -51.15 43.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.589 -0.72 . . . . 0.0 111.479 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.63 -34.09 77.11 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.744 1.156 . . . . 0.0 109.811 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -60.32 -48.65 80.85 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.745 0.818 . . . . 0.0 109.225 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.44 -41.6 65.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 123.048 0.539 . . . . 0.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -58.13 -46.08 86.24 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.928 0.891 . . . . 0.0 109.471 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -76.1 -28.59 57.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.59 0.756 . . . . 0.0 110.084 179.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -61.74 -31.6 71.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.259 0.936 . . . . 0.0 109.12 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -6.52 0.98 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.982 1.313 . . . . 0.0 113.272 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 18.2 tp . . . . . 0 CA--C 1.546 0.824 0 C-N-CA 125.018 1.327 . . . . 0.0 109.963 177.919 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 CA--C 1.534 0.361 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 24.6 tp -72.42 102.53 3.21 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.123 0.969 . . . . 0.0 109.384 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 59.4 mt -109.42 170.85 7.8 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 124.293 1.037 . . . . 0.0 109.436 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -138.05 152.73 49.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.37 100.04 17.0 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -79.6 115.66 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.567 2.845 . . . . 0.0 110.138 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 78.1 t -144.74 152.11 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 119.649 1.113 . . . . 0.0 110.194 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.15 102.51 5.21 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.17 113.66 0.55 Allowed Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 104.107 -3.597 . . . . 0.0 104.107 179.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -51.13 69.08 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 120.057 1.928 . . . . 0.0 113.048 -177.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -75.34 -34.14 61.16 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.299 1.039 . . . . 0.0 109.358 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 5.5 m -59.28 -50.21 74.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.962 1.305 . . . . 0.0 107.963 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.0 t80 -58.7 -51.21 70.91 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.857 1.663 . . . . 0.0 109.404 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.4 -42.33 99.35 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.49 1.041 . . . . 0.0 112.752 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.0 ttm -60.64 -50.59 72.89 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.76 -44.69 93.74 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.215 1.406 . . . . 0.0 111.569 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.42 -55.75 30.73 Favored 'General case' 0 CA--C 1.512 -0.486 0 C-N-CA 124.322 1.049 . . . . 0.0 111.482 -179.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -41.38 79.29 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.982 0.356 . . . . 0.0 111.543 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . 0.479 HG23 HD22 ' D' 1115 ' ' LEU . 81.2 mt -66.99 -43.18 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 121.655 0.74 . . . . 0.0 110.3 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -66.51 -44.83 81.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 120.794 -1.191 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -62.97 -39.61 95.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 117.997 -1.002 . . . . 0.0 111.169 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 55.4 p -61.18 -50.44 73.13 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.08 0.855 . . . . 0.0 110.409 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -68.82 -42.47 77.2 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.911 -178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.62 -51.0 71.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . 0.657 HD22 HG23 ' D' 1130 ' ' VAL . 42.7 tp -62.25 -43.78 98.05 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.786 0.721 . . . . 0.0 109.744 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 22.3 ttt -57.89 -35.26 70.77 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.642 0.777 . . . . 0.0 111.137 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -79.28 -49.14 12.93 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.311 1.444 . . . . 0.0 111.14 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 24.2 t80 -71.63 -23.87 61.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.749 2.02 . . . . 0.0 113.862 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 8.4 tp . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 179.461 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -50.07 74.3 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 120.978 1.717 . . . . 0.0 111.552 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.8 mm -63.82 -34.99 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -61.19 -53.4 57.43 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.861 0.755 . . . . 0.0 109.005 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 13.2 m -67.33 -35.48 79.5 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.864 -0.522 . . . . 0.0 110.793 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.3 t80 -58.77 -52.68 64.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -37.31 81.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 123.979 0.912 . . . . 0.0 109.728 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -53.5 57.15 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.078 0.951 . . . . 0.0 109.472 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -67.02 -46.08 75.57 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.19 0.996 . . . . 0.0 111.032 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -42.23 85.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.317 1.047 . . . . 0.0 109.21 179.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -65.7 -51.47 59.1 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 . . . . . 0 C--N 1.339 0.143 0 C-N-CA 124.338 1.055 . . . . 0.0 113.429 -179.422 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 C--O 1.234 0.242 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -102.23 142.12 33.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -122.94 151.17 42.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 7.3 mp -128.33 150.06 50.24 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 105.62 -1.992 . . . . 0.0 105.62 178.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tm0? -145.33 98.37 3.14 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 125.897 1.679 . . . . 0.0 106.975 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.83 140.66 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 119.074 0.852 . . . . 0.0 111.573 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -103.91 103.95 13.87 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 105.165 -2.161 . . . . 0.0 105.165 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.16 114.08 0.86 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 104.301 -3.52 . . . . 0.0 104.301 178.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -61.95 -57.52 11.4 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.491 2.145 . . . . 0.0 111.901 -178.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mttp -72.22 -35.52 68.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.494 -0.754 . . . . 0.0 109.081 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.16 -51.32 69.79 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.013 -0.994 . . . . 0.0 111.035 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.8 t80 -66.71 -43.24 84.82 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.429 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.76 -54.0 40.09 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.407 1.003 . . . . 0.0 111.817 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.06 -54.07 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 125.614 1.565 . . . . 0.0 111.657 -178.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -37.54 87.68 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 117.719 -1.134 . . . . 0.0 111.873 -178.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 15.1 ttt -65.3 -51.26 61.83 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -52.32 -51.74 57.01 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 123.454 0.702 . . . . 0.0 109.664 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . 0.479 HD22 HG23 ' C' 1022 ' ' ILE . 68.1 mt -65.23 -36.54 84.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.397 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.6 tptp -64.98 -48.4 74.16 Favored 'General case' 0 C--O 1.228 -0.079 0 CA-C-N 120.123 1.328 . . . . 0.0 109.449 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -59.02 -46.6 87.8 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.96 1.304 . . . . 0.0 108.047 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 40.7 t -57.09 -45.95 82.96 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.53 1.132 . . . . 0.0 109.97 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 2.6 mm? -70.89 -30.52 66.9 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.578 -1.201 . . . . 0.0 111.059 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -62.88 -42.6 99.83 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 121.529 1.968 . . . . 0.0 107.982 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -54.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.105 0.962 . . . . 0.0 109.567 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 13.7 tpt -60.12 -30.09 69.05 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.307 0.643 . . . . 0.0 112.711 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -76.38 -35.45 58.64 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 119.084 0.856 . . . . 0.0 110.207 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.21 -31.71 33.81 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.801 1.038 . . . . 0.0 113.801 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.2 t -94.61 147.93 34.04 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 125.378 1.471 . . . . 0.0 112.934 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -67.31 -173.09 0.4 Allowed 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 123.674 2.916 . . . . 0.0 110.818 178.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -122.92 43.48 0.76 Allowed Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -65.62 -47.16 4.31 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.106 1.871 . . . . 0.0 113.09 -178.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 26.0 tp -68.89 -39.7 79.59 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 119.372 0.987 . . . . 0.0 109.217 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . 0.657 HG23 HD22 ' C' 1028 ' ' LEU . 2.8 t -59.26 -50.41 79.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.39 0 CA-C-O 117.377 -1.296 . . . . 0.0 109.722 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -55.09 -51.56 65.99 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.343 1.429 . . . . 0.0 109.758 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 5.3 t -57.26 -49.88 74.66 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.161 1.384 . . . . 0.0 111.549 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.6 t80 -68.95 -41.95 77.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.336 1.455 . . . . 0.0 112.041 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 10.1 tmm_? -53.3 -47.5 69.19 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.087 1.355 . . . . 0.0 109.885 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -70.82 -53.93 13.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.125 0.97 . . . . 0.0 110.125 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -51.48 -47.27 63.26 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.656 0.782 . . . . 0.0 112.658 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -73.57 -31.62 63.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.313 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -61.81 -34.02 75.17 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.674 1.124 . . . . 0.0 109.687 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.13 -14.68 1.74 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 48.7 tp . . . . . 0 CA--C 1.546 0.82 0 C-N-CA 125.8 1.64 . . . . 0.0 111.14 177.826 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.01 108.65 1.26 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.589 0.631 . . . . 0.0 110.272 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.78 168.33 10.56 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.43 1.109 . . . . 0.0 109.643 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -135.99 142.3 44.49 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.384 1.873 . . . . 0.0 106.999 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 39.3 tp -130.5 96.04 25.2 Favored Pre-proline 0 CA--C 1.539 0.527 0 C-N-CA 123.989 0.916 . . . . 0.0 108.747 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.46 116.76 3.62 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.537 2.825 . . . . 0.0 108.799 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.9 t -145.48 160.83 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.885 1.674 . . . . 0.0 109.804 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -134.4 105.02 6.37 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.9 104.88 0.23 Allowed Glycine 0 C--O 1.227 -0.334 0 N-CA-C 106.403 -2.679 . . . . 0.0 106.403 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -64.24 -52.96 56.18 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 121.196 2.498 . . . . 0.0 113.021 -177.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.91 -30.71 69.24 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.47 -0.769 . . . . 0.0 110.864 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -43.34 81.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 126.115 1.766 . . . . 0.0 109.299 -179.001 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -61.85 -49.05 77.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.138 0.975 . . . . 0.0 108.533 178.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -60.61 -43.14 97.78 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.744 0.247 . . . . 0.0 111.423 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 8.8 tmm? -63.73 -49.95 71.05 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.841 0.857 . . . . 0.0 110.359 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 mp -61.65 -52.24 65.15 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.191 -0.909 . . . . 0.0 112.179 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -42.14 94.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.463 1.029 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -59.94 -48.61 81.0 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.205 0.526 . . . . 0.0 110.48 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.3 mt -73.62 -32.15 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.021 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' C' 1010 ' ' VAL . 19.0 ttmm -59.23 -57.54 12.57 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -36.54 73.05 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 117.054 -1.45 . . . . 0.0 109.309 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 p -55.8 -48.0 76.15 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.285 1.402 . . . . 0.0 111.327 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -42.37 62.48 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.306 1.842 . . . . 0.0 113.716 -178.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -68.88 -52.47 29.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.609 -0.682 . . . . 0.0 109.988 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.94 -39.57 92.53 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.607 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.25 66.37 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.083 0.856 . . . . 0.0 109.703 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.02 -23.99 66.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.66 -23.46 29.45 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.446 1.099 . . . . 0.0 111.523 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp . . . . . 0 CA--C 1.535 0.369 0 C-N-CA 127.776 2.431 . . . . 0.0 105.909 179.909 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.5 m170 . . . . . 0 N--CA 1.465 0.282 0 CA-C-O 118.224 -0.893 . . . . 0.0 113.296 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.7 m -56.91 -50.03 73.79 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.555 1.07 . . . . 0.0 108.952 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.8 mt -65.78 -53.64 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 126.108 1.763 . . . . 0.0 108.826 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -52.43 -53.3 47.13 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.202 1.001 . . . . 0.0 111.721 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.1 m -64.83 -47.06 79.36 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.887 0.875 . . . . 0.0 110.494 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -61.35 -41.39 96.98 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 118.965 0.802 . . . . 0.0 111.28 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -60.37 -48.55 81.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.441 1.019 . . . . 0.0 110.171 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.79 -46.04 89.84 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 123.176 0.59 . . . . 0.0 110.083 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -62.02 -47.65 83.81 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 124.451 1.1 . . . . 0.0 110.821 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -54.88 -44.52 74.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.556 1.142 . . . . 0.0 110.512 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -57.4 -50.78 71.91 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.538 0.503 0 CA-C-N 117.86 0.3 . . . . 0.0 111.268 179.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 7.1 m . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.03 129.91 48.46 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -104.31 159.41 15.73 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.841 1.656 . . . . 0.0 109.466 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.9 mt -149.12 142.51 25.23 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.871 1.668 . . . . 0.0 107.831 179.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -146.03 108.21 4.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.5 m -154.51 150.18 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.106 1.362 . . . . 0.0 109.488 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.87 101.57 8.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.225 1.375 . . . . 0.0 108.916 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.0 115.85 0.88 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-O 115.887 -2.618 . . . . 0.0 109.918 178.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -65.24 -56.91 10.09 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 122.364 3.082 . . . . 0.0 111.023 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -63.55 -47.75 80.3 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 -52.64 -48.81 66.17 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.326 -0.845 . . . . 0.0 111.349 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.94 -43.74 94.93 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.954 1.252 . . . . 0.0 112.074 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.48 -48.82 79.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.863 1.21 . . . . 0.0 110.332 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 85.0 mt -61.23 -53.71 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 124.43 1.092 . . . . 0.0 110.757 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.66 -31.69 73.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 117.911 -1.042 . . . . 0.0 111.601 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 16.2 mtp -64.41 -52.38 58.42 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.265 1.393 . . . . 0.0 109.468 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -58.14 -43.23 87.18 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.6 mt -63.2 -50.67 69.38 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.419 0.688 . . . . 0.0 111.941 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -69.69 -50.84 39.96 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 119.447 1.021 . . . . 0.0 112.669 -178.52 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -56.64 -46.78 80.81 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 118.909 0.777 . . . . 0.0 110.443 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.8 t -64.21 -36.17 83.18 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.721 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.696 HD12 HD21 ' D' 1108 ' ' ASN . 1.6 tm? -69.83 -43.31 72.26 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -60.25 -33.98 73.06 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.898 1.226 . . . . 0.0 109.784 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -73.15 -44.05 60.62 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.2 tpt -63.98 -25.77 68.28 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.465 1.106 . . . . 0.0 109.7 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.5 -46.32 17.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.665 1.986 . . . . 0.0 109.606 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -75.4 -32.33 60.72 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.098 0.863 . . . . 0.0 113.118 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -91.63 147.85 36.06 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.46 -176.8 1.52 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.367 2.045 . . . . 0.0 110.429 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.96 56.58 0.37 Allowed Pre-proline 0 CA--C 1.551 1.006 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.36 -74.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.263 2.642 . . . . 0.0 113.109 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.8 tt -56.12 -44.35 79.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 25.5 t -50.97 -53.79 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 126.959 2.104 . . . . 0.0 112.103 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.52 -42.66 91.75 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.307 0.958 . . . . 0.0 111.421 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 29.5 m -64.39 -44.34 91.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.464 0.575 . . . . 0.0 109.727 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -56.92 -51.93 67.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.829 1.652 . . . . 0.0 108.78 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -54.18 -46.96 72.51 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 117.48 -1.248 . . . . 0.0 111.245 -178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -68.56 -49.83 56.46 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 120.997 1.726 . . . . 0.0 112.086 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -56.98 -37.67 71.95 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.837 0.455 . . . . 0.0 110.975 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -77.57 -41.98 36.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 110.051 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -54.23 -32.52 56.14 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.912 1.233 . . . . 0.0 110.442 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.28 -19.64 55.74 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.854 -0.529 . . . . 0.0 111.828 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 N--CA 1.463 0.2 0 O-C-N 120.727 -1.233 . . . . 0.0 110.308 178.93 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.0 tt -68.05 120.08 13.69 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.34 167.55 10.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 123.373 1.558 . . . . 0.0 109.702 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -136.12 148.01 48.04 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 126.905 2.082 . . . . 0.0 106.287 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 9.0 tp -137.11 94.57 12.43 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.38 111.17 3.22 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.209 3.273 . . . . 0.0 109.035 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . 0.419 HG21 ' HE3' ' A' ' 23' ' ' LYS . 54.0 t -145.35 156.01 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -135.65 105.04 6.01 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.132 -0.98 . . . . 0.0 109.869 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.7 114.96 0.6 Allowed Glycine 0 CA--C 1.529 0.919 0 N-CA-C 106.503 -2.639 . . . . 0.0 106.503 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -67.86 -50.68 55.16 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 122.73 3.265 . . . . 0.0 111.086 -179.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -41.49 85.86 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -48.72 79.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 124.518 1.127 . . . . 0.0 110.055 -179.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 55.0 t80 -57.26 -54.74 43.38 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.921 0.889 . . . . 0.0 110.864 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -62.57 -37.52 86.5 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 12.0 tmm? -66.14 -49.8 66.19 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.627 -0.671 . . . . 0.0 109.444 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.21 -45.2 93.99 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.494 0.717 . . . . 0.0 110.308 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -61.69 -54.37 43.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.022 0.929 . . . . 0.0 111.327 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -54.97 -48.37 73.33 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.809 0.844 . . . . 0.0 111.238 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 96.7 mt -71.46 -40.59 72.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 119.113 -0.47 . . . . 0.0 111.011 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -47.4 85.83 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 119.532 1.06 . . . . 0.0 108.16 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.03 -46.39 85.41 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.517 1.136 . . . . 0.0 108.754 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 34.1 p -54.39 -50.06 68.41 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 118.398 0.544 . . . . 0.0 111.656 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -46.47 89.14 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 122.114 0.959 . . . . 0.0 111.57 -178.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -52.64 64.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.834 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.86 -48.56 71.17 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.154 1.781 . . . . 0.0 112.937 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -41.38 63.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.845 1.658 . . . . 0.0 109.185 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -87.72 -25.09 23.63 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 118.16 -0.924 . . . . 0.0 111.671 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -75.69 -23.04 56.15 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.89 1.677 . . . . 0.0 111.15 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 39.5 tp . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 125.837 1.655 . . . . 0.0 106.907 -179.952 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 50.7 m170 . . . . . 0 N--CA 1.462 0.147 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 3.0 m -56.63 -47.44 79.67 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.2 mt -69.58 -49.94 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 C-N-CA 126.534 1.933 . . . . 0.0 109.783 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -55.02 -54.45 42.87 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.809 0.844 . . . . 0.0 111.252 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.9 m -59.92 -46.09 90.48 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.336 0.655 . . . . 0.0 109.741 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 23.0 t80 -59.1 -45.3 91.21 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.632 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -48.82 80.1 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.654 0.782 . . . . 0.0 110.435 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -44.03 91.54 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 121.876 -0.515 . . . . 0.0 110.541 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -64.44 -42.44 95.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.539 -0.743 . . . . 0.0 110.727 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -60.74 -35.19 75.74 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.644 1.178 . . . . 0.0 110.744 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -64.95 -54.42 30.92 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.531 0.247 0 O-C-N 122.4 -0.188 . . . . 0.0 110.629 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 65.6 m . . . . . 0 C--O 1.237 0.439 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -111.09 140.69 45.43 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.845 0.831 . . . . 0.0 108.78 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.56 159.71 31.39 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.474 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.9 mt -146.23 146.95 30.97 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 177.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -143.63 112.84 6.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 17.4 m -155.47 151.33 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 C-N-CA 125.806 1.642 . . . . 0.0 109.258 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 102.19 11.73 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.71 108.97 0.53 Allowed Glycine 0 C--N 1.335 0.499 0 CA-C-O 117.043 -1.976 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -58.02 9.01 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 121.425 2.613 . . . . 0.0 112.573 -179.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -71.16 -42.77 68.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.575 -0.703 . . . . 0.0 109.144 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . 0.696 HD21 HD12 ' B' ' 119' ' ' LEU . 33.6 m-80 -54.05 -49.29 69.32 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.596 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 78.1 t80 -62.31 -44.65 96.01 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.335 0.97 . . . . 0.0 110.901 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.7 -45.31 94.67 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.836 0.744 . . . . 0.0 112.4 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.9 mt -66.97 -50.9 60.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.768 1.627 . . . . 0.0 109.457 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.59 -36.94 82.11 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 118.257 -0.878 . . . . 0.0 109.985 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 22.7 mtp -60.59 -52.55 64.7 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 119.464 1.029 . . . . 0.0 109.162 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -60.77 -42.01 96.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.486 -0.769 . . . . 0.0 111.229 -179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.1 mt -66.25 -46.61 76.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.601 0.637 . . . . 0.0 111.911 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.8 tptt -69.3 -54.04 16.63 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 117.122 -1.418 . . . . 0.0 111.328 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -53.17 -47.59 68.69 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 108.376 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 30.9 t -55.15 -54.28 45.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.334 0.654 . . . . 0.0 110.43 179.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -30.76 71.79 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 118.86 -0.591 . . . . 0.0 110.741 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.27 -49.07 79.07 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 120.075 1.307 . . . . 0.0 108.093 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.59 -41.18 80.0 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.124 -0.941 . . . . 0.0 108.525 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.8 tpt -64.37 -20.9 66.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.702 1.137 . . . . 0.0 111.402 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -83.12 -37.36 23.87 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.151 0.98 . . . . 0.0 108.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.22 -32.82 17.24 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 67.1 t -89.84 141.16 28.03 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 126.16 1.784 . . . . 0.0 109.35 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.78 177.25 5.07 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 123.332 2.688 . . . . 0.0 112.28 179.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -111.31 53.2 0.36 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.81 -70.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.482 2.121 . . . . 0.0 112.666 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.39 -39.07 82.21 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.5 t -52.16 -56.34 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.033 1.733 . . . . 0.0 110.654 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.43 -44.02 75.87 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.516 1.053 . . . . 0.0 111.84 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 36.8 m -57.13 -42.15 80.37 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 47.7 t80 -69.82 -44.37 70.11 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.651 1.581 . . . . 0.0 109.012 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -54.5 -48.83 71.4 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 117.911 -1.043 . . . . 0.0 110.362 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -66.48 -53.9 29.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.952 0.796 . . . . 0.0 110.992 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -54.86 -38.83 67.96 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.779 0.832 . . . . 0.0 113.203 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.47 -37.39 31.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.422 0.689 . . . . 0.0 109.966 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -57.74 -38.05 74.65 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.667 0.667 . . . . 0.0 110.049 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.4 mt -59.48 -15.23 16.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.895 0.878 . . . . 0.0 113.194 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.542 0.651 0 C-N-CA 124.171 0.988 . . . . 0.0 110.365 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 103.768 -2.678 . . . . 0.0 103.768 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.12 101.08 0.26 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.188 0.995 . . . . 0.0 109.895 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mp -92.74 173.73 7.62 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -133.35 120.31 20.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.11 0.964 . . . . 0.0 108.902 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.6 tp -104.22 101.21 25.2 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 124.178 0.991 . . . . 0.0 109.442 179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -80.8 118.92 3.52 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.312 2.675 . . . . 0.0 110.248 178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -144.64 156.49 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 125.483 1.513 . . . . 0.0 107.03 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.6 103.67 5.53 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.082 -1.011 . . . . 0.0 109.497 178.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.11 125.19 1.29 Allowed Glycine 0 C--O 1.226 -0.349 0 N-CA-C 106.013 -2.835 . . . . 0.0 106.013 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -51.26 59.79 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 121.129 2.465 . . . . 0.0 109.642 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -72.63 -30.77 64.6 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.211 1.004 . . . . 0.0 110.559 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 m -66.83 -51.56 54.14 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.297 1.439 . . . . 0.0 109.277 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -63.69 -50.37 69.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.478 0.711 . . . . 0.0 109.774 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -57.99 -57.54 12.38 Favored 'General case' 0 C--O 1.231 0.1 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -63.16 -39.29 94.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.697 0.681 . . . . 0.0 112.751 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.2 mt -72.85 -35.1 67.16 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 118.134 -0.936 . . . . 0.0 111.125 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -69.71 -41.47 75.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.095 1.316 . . . . 0.0 107.765 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -56.38 -48.75 76.22 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.473 1.109 . . . . 0.0 109.713 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.69 -46.76 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.482 0.713 . . . . 0.0 109.983 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -53.94 -50.18 67.02 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 124.003 0.921 . . . . 0.0 110.103 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -71.57 -42.89 67.25 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.77 -1.11 . . . . 0.0 111.623 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.8 t -53.7 -51.48 63.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.573 1.078 . . . . 0.0 108.79 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.47 -56.91 14.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 124.695 1.247 . . . . 0.0 110.553 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -56.24 -43.24 78.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.972 0.806 . . . . 0.0 112.58 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.62 -43.91 75.34 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.85 1.204 . . . . 0.0 110.454 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.54 -38.5 84.69 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.029 0.932 . . . . 0.0 109.258 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.99 -37.72 84.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.689 1.196 . . . . 0.0 110.214 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -79.72 -24.04 41.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.556 1.142 . . . . 0.0 112.92 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 27.6 tp . . . . . 0 CA--C 1.538 0.489 0 CA-C-N 120.297 1.408 . . . . 0.0 112.439 -178.944 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.0 m -55.83 -43.84 77.35 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.104 1.32 . . . . 0.0 110.808 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.07 -55.03 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.039 1.335 . . . . 0.0 109.594 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.3 -42.85 99.36 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 m -65.72 -31.9 73.16 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -49.98 70.43 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 178.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -55.87 -48.5 75.44 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.003 0.921 . . . . 0.0 109.862 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -64.07 -41.81 97.21 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.63 0.772 . . . . 0.0 111.24 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.332 -0.162 0 O-C-N 121.137 -0.977 . . . . 0.0 110.66 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -66.5 -35.53 80.48 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -69.76 -31.22 69.05 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.532 1.133 . . . . 0.0 111.525 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? . . . . . 0 N--CA 1.464 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 111.979 -179.562 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.238 0.481 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -102.02 137.02 40.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.626 1.171 . . . . 0.0 108.901 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -114.15 149.83 35.08 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.931 1.693 . . . . 0.0 108.466 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mt -144.91 145.87 31.76 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.126 1.37 . . . . 0.0 108.041 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -151.73 110.76 3.88 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.413 0.685 . . . . 0.0 111.514 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -154.02 150.87 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.246 1.818 . . . . 0.0 107.704 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 24.2 ptt85 -99.18 101.86 13.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.79 1.177 . . . . 0.0 110.092 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.35 114.55 0.81 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 116.128 -2.484 . . . . 0.0 113.323 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 tpp85 -67.35 -56.77 8.37 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 122.751 3.275 . . . . 0.0 111.052 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -64.99 -50.62 65.61 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.996 1.718 . . . . 0.0 108.503 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -47.35 64.73 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.743 2.817 . . . . 0.0 109.393 -178.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -66.64 -47.39 72.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.157 0.89 . . . . 0.0 111.187 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -57.04 -43.08 81.61 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.342 0.973 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 60.2 mt -61.25 -54.69 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.813 1.245 . . . . 0.0 107.727 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.81 -37.36 76.21 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 117.871 -1.061 . . . . 0.0 112.524 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 60.0 mtp -65.44 -54.23 31.52 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 119.921 1.237 . . . . 0.0 111.298 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 13.9 ptpt -61.85 -43.0 99.72 Favored 'General case' 0 C--N 1.34 0.175 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.74 -51.48 58.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.427 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . 0.405 ' HE3' HG11 ' D' 1103 ' ' VAL . 41.4 tptt -54.84 -58.86 5.87 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.466 0.707 . . . . 0.0 110.672 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -52.68 -49.22 65.73 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.659 1.984 . . . . 0.0 111.432 -179.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 12.4 t -62.07 -43.58 98.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.086 0.403 . . . . 0.0 110.987 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' B' ' 119' ' ' LEU . 11.7 tp -62.98 -40.15 96.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.587 -0.721 . . . . 0.0 109.149 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -47.06 86.91 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -59.35 -52.3 66.22 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.717 0.807 . . . . 0.0 111.692 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 8.0 tmm? -62.73 -28.22 69.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.678 0.791 . . . . 0.0 111.349 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.78 -22.18 22.27 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.302 1.441 . . . . 0.0 113.214 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.93 -33.73 17.16 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.39 1.45 . . . . 0.0 111.145 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 3.7 t -94.94 147.5 33.17 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -65.79 -170.83 0.19 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.604 2.869 . . . . 0.0 111.182 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -112.19 78.0 2.32 Favored Pre-proline 0 CA--C 1.544 0.738 0 O-C-N 120.214 -1.554 . . . . 0.0 113.226 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -77.97 -97.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.73 2.953 . . . . 0.0 112.483 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.1 tt -55.76 -40.73 72.98 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.744 1.218 . . . . 0.0 109.881 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -53.37 -46.11 57.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.48 1.112 . . . . 0.0 111.238 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.15 -42.05 73.03 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 121.1 -1.0 . . . . 0.0 110.36 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.5 t -57.83 -46.62 84.47 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -67.29 -39.48 85.98 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.623 1.569 . . . . 0.0 111.11 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -47.8 70.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 119.311 0.96 . . . . 0.0 109.024 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.44 -50.96 61.61 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -51.22 -44.15 61.59 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.309 1.043 . . . . 0.0 112.422 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.1 tm0? -76.59 -40.68 48.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.85 0.86 . . . . 0.0 110.666 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -53.64 -34.84 59.96 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.885 0.874 . . . . 0.0 111.435 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.02 -10.21 3.98 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 126.439 1.895 . . . . 0.0 109.94 178.765 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 CA--C 1.523 -0.08 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 5.0 tp -61.49 105.08 0.48 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.0 1.32 . . . . 0.0 111.366 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 14.4 mt -93.36 133.73 36.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -103.45 103.34 13.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.937 1.295 . . . . 0.0 107.824 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.6 tp -97.79 111.8 59.89 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 117.609 -1.186 . . . . 0.0 110.586 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -81.89 115.74 2.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.504 2.803 . . . . 0.0 111.686 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 37.6 t -143.88 148.97 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 120.039 1.291 . . . . 0.0 109.357 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.42 102.74 5.05 Favored 'General case' 0 C--N 1.346 0.428 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 179.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.06 136.36 4.06 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-O 115.104 -3.053 . . . . 0.0 105.475 176.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -53.46 14.69 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 122.991 3.396 . . . . 0.0 106.96 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.62 -30.23 66.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 2.4 m -66.58 -52.23 47.73 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.14 0.882 . . . . 0.0 108.947 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.48 -52.65 62.65 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -57.27 -56.54 20.53 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 124.025 0.93 . . . . 0.0 112.829 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ttm -60.53 -34.8 74.64 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.165 1.348 . . . . 0.0 112.045 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.1 mt -68.66 -53.06 24.73 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -50.09 74.85 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 124.131 0.972 . . . . 0.0 111.523 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -55.59 -48.45 74.82 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.885 1.274 . . . . 0.0 110.243 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . 0.442 ' CG2' HD22 ' D' 1115 ' ' LEU . 54.7 mt -70.09 -37.25 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 121.695 -0.628 . . . . 0.0 109.963 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -62.64 -51.64 66.47 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.247 1.019 . . . . 0.0 110.791 179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.63 -36.99 76.63 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.368 1.067 . . . . 0.0 108.617 -178.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 42.4 t -56.5 -48.6 76.83 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.829 1.195 . . . . 0.0 107.854 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tm? -67.55 -54.05 23.18 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.479 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.26 -52.26 63.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.692 0.678 . . . . 0.0 112.644 -178.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 85.3 mt -64.9 -47.7 76.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.233 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -57.59 -41.7 81.69 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.38 -33.46 74.3 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.085 -1.01 . . . . 0.0 110.004 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -72.16 -18.61 61.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.072 0.949 . . . . 0.0 109.766 178.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 45.6 tp . . . . . 0 CA--C 1.54 0.59 0 C-N-CA 124.842 1.257 . . . . 0.0 109.11 178.018 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 CA--C 1.531 0.24 0 CA-C-O 116.087 -1.911 . . . . 0.0 114.171 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 85.5 m -57.64 -45.2 85.76 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 122.29 2.314 . . . . 0.0 109.534 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.86 -54.59 32.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 C-N-CA 125.297 1.439 . . . . 0.0 108.623 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.31 -33.88 73.0 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 51.5 m -69.92 -52.56 23.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -47.3 76.9 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.699 0.682 . . . . 0.0 110.397 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -61.42 -49.36 77.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.626 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -68.97 -29.28 67.47 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 118.943 0.792 . . . . 0.0 112.939 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -66.97 -35.69 80.52 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.324 0.965 . . . . 0.0 108.584 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -78.61 -40.93 33.07 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -54.81 -40.93 70.01 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.803 1.241 . . . . 0.0 110.357 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.0 tm0? . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 125.047 1.339 . . . . 0.0 112.193 -179.68 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 30.1 m . . . . . 0 C--O 1.237 0.434 0 N-CA-C 110.805 -0.072 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -107.83 130.28 55.0 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.127 0.971 . . . . 0.0 110.913 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -109.96 144.02 39.08 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 127.584 2.354 . . . . 0.0 107.636 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 12.5 mt -140.98 143.48 34.51 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.267 1.427 . . . . 0.0 109.211 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -145.37 110.32 5.16 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.773 1.229 . . . . 0.0 110.21 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . 0.405 HG11 ' HE3' ' B' ' 116' ' ' LYS . 26.2 t -151.11 151.27 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.492 1.517 . . . . 0.0 110.316 -179.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -110.9 101.89 10.43 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 120.346 1.43 . . . . 0.0 107.312 176.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.55 108.93 0.51 Allowed Glycine 0 CA--C 1.521 0.451 0 CA-C-O 116.607 -2.219 . . . . 0.0 109.649 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -59.91 -58.2 9.58 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 121.697 2.749 . . . . 0.0 115.434 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.76 -47.47 66.15 Favored 'General case' 0 CA--C 1.508 -0.649 0 O-C-N 121.124 -0.985 . . . . 0.0 108.927 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -53.96 -43.4 69.87 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.998 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.6 t80 -66.12 -49.22 68.26 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.377 0.99 . . . . 0.0 110.886 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -52.76 -49.64 65.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.877 0.846 . . . . 0.0 110.625 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 64.4 mt -57.8 -53.78 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 126.058 1.743 . . . . 0.0 107.994 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.1 mp -59.0 -40.5 85.08 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.659 -1.162 . . . . 0.0 112.279 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 58.2 mtp -58.68 -53.22 60.79 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 120.442 1.474 . . . . 0.0 110.577 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -64.15 -40.57 96.43 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 119.981 -0.688 . . . . 0.0 112.313 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . 0.442 HD22 ' CG2' ' C' 1022 ' ' ILE . 55.3 mt -70.95 -33.39 70.43 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.705 -0.622 . . . . 0.0 112.518 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 23.9 tptt -64.88 -58.6 5.74 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -49.74 -48.76 49.97 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 127.693 2.397 . . . . 0.0 110.93 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 20.7 t -56.3 -54.05 50.02 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.474 1.11 . . . . 0.0 111.695 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . 0.4 HD12 ' HA ' ' D' 1119 ' ' LEU . 5.7 tp -59.19 -42.61 91.27 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.862 0.465 . . . . 0.0 110.842 -178.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.05 -41.24 91.89 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.223 1.009 . . . . 0.0 110.988 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 1.1 mm? -65.24 -53.63 41.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.854 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 55.8 mmm -57.8 -27.62 63.29 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -85.12 -36.71 20.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.67 -32.14 28.29 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.275 0.943 . . . . 0.0 113.19 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.37 149.22 40.69 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 126.446 1.898 . . . . 0.0 108.134 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -65.44 174.09 5.65 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.993 2.462 . . . . 0.0 111.036 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . 0.413 ' HA ' HG22 ' D' 1130 ' ' VAL . 16.4 mp0 -112.51 61.89 0.65 Allowed Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.359 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.68 -86.87 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.1 3.2 . . . . 0.0 111.408 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.1 -43.53 82.32 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.131 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . 0.413 HG22 ' HA ' ' D' 1127 ' ' GLN . 3.0 m -51.24 -40.86 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-O 118.213 -0.898 . . . . 0.0 112.124 -177.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.45 -41.84 45.99 Favored 'General case' 0 C--N 1.338 0.102 0 CA-C-N 118.748 0.704 . . . . 0.0 110.165 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -49.91 73.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 77.3 t80 -64.91 -40.01 94.4 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 127.028 2.131 . . . . 0.0 108.813 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -43.51 67.84 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.599 1.091 . . . . 0.0 108.238 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -77.62 -44.92 26.69 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.86 0.864 . . . . 0.0 111.867 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -56.79 -49.85 74.09 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.53 1.132 . . . . 0.0 110.441 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -64.02 -46.58 83.82 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.425 2.29 . . . . 0.0 108.787 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -55.32 -32.02 62.15 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.22 1.008 . . . . 0.0 111.57 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -2.42 1.37 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.546 0.804 0 C-N-CA 126.044 1.738 . . . . 0.0 108.854 177.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.567 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.2 tp -65.68 94.88 0.21 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.935 1.694 . . . . 0.0 108.847 -179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.76 137.25 36.91 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.754 1.221 . . . . 0.0 112.182 -178.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -104.19 159.23 15.87 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -142.08 101.04 5.82 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.36 125.88 10.55 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.256 1.971 . . . . 0.0 110.105 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.2 t -144.99 134.95 18.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 123.237 0.615 . . . . 0.0 110.179 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 ptt85 -136.91 102.85 4.99 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.92 117.63 0.75 Allowed Glycine 0 N--CA 1.45 -0.427 1 N-CA-C 102.786 -4.126 . . . . 0.0 102.786 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmm-85 -57.89 -51.37 69.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 121.359 2.58 . . . . 0.0 111.457 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -66.48 -40.82 89.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.906 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.86 -45.64 92.92 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.46 -0.775 . . . . 0.0 111.361 -179.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -58.93 -47.49 84.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.71 1.204 . . . . 0.0 109.814 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.67 -57.16 12.58 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.933 0.77 . . . . 0.0 110.736 179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.0 ptm -65.16 -42.84 93.36 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.26 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.01 -45.29 87.09 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.21 0.913 . . . . 0.0 111.175 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.5 -53.39 58.12 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 123.611 0.764 . . . . 0.0 109.496 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -40.91 97.17 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -178.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.439 HD11 ' CG2' ' D' 1111 ' ' ILE . 91.5 mt -67.91 -45.33 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -63.96 -44.35 93.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.281 -0.636 . . . . 0.0 109.281 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -61.03 -50.87 71.56 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.146 -0.93 . . . . 0.0 109.428 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.3 p -53.19 -40.0 64.09 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.84 1.2 . . . . 0.0 111.177 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.09 -49.96 25.56 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.475 0.58 . . . . 0.0 111.664 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.44 -53.76 53.62 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.889 1.676 . . . . 0.0 110.61 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.96 -43.33 95.11 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.499 1.519 . . . . 0.0 109.718 -179.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.8 ttt -63.47 -35.82 81.73 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.413 0.685 . . . . 0.0 110.55 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -78.29 -31.14 48.77 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.347 -0.845 . . . . 0.0 111.57 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -76.46 -35.04 58.66 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.424 0.69 . . . . 0.0 111.252 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 tp . . . . . 0 C--O 1.234 0.244 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.534 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 119.082 -0.485 . . . . 0.0 109.927 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.2 m -63.91 -52.4 60.06 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 117.988 -1.006 . . . . 0.0 111.065 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 35.7 mm -71.68 -42.04 71.1 Favored 'Isoleucine or valine' 0 C--N 1.346 0.413 0 CA-C-N 120.134 1.334 . . . . 0.0 108.934 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -57.1 -42.26 80.44 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.347 0.522 . . . . 0.0 111.071 -178.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.3 m -64.28 -52.44 58.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 109.667 178.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -50.75 71.25 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 123.628 0.771 . . . . 0.0 111.738 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 18.4 ttp85 -62.6 -38.6 90.81 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 118.2 -0.905 . . . . 0.0 109.777 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -56.62 -52.81 63.45 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 119.63 1.104 . . . . 0.0 110.564 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -65.28 -41.73 93.87 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 123.339 0.399 . . . . 0.0 110.635 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -61.77 -41.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.989 0.813 . . . . 0.0 110.254 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -66.0 -29.96 70.42 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.099 0.96 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.475 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -129.56 129.64 44.71 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -114.38 167.81 10.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.339 1.055 . . . . 0.0 109.567 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 20.1 tp -149.22 154.71 39.51 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.882 178.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -150.41 98.81 2.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.957 1.703 . . . . 0.0 110.342 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.9 t -146.74 150.05 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 119.899 -1.751 . . . . 0.0 108.62 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -116.34 100.24 7.75 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 122.284 1.04 . . . . 0.0 108.701 177.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.38 107.79 0.46 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 106.819 -2.513 . . . . 0.0 106.819 177.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -56.78 15.16 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 121.512 2.656 . . . . 0.0 111.932 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -67.01 -47.0 72.79 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -52.06 -45.51 64.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.017 1.327 . . . . 0.0 112.269 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -69.96 -43.44 71.52 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.238 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -56.74 -48.18 78.37 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.948 0.88 . . . . 0.0 110.42 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 63.9 mt -65.12 -52.35 54.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 125.29 1.436 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -36.02 82.29 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.392 -1.766 . . . . 0.0 112.269 -178.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 9.5 mtm -64.12 -52.29 59.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.86 1.664 . . . . 0.0 108.55 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -48.24 -52.13 22.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.039 0.936 . . . . 0.0 109.423 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.401 HD22 HG23 ' A' ' 22' ' ' ILE . 80.6 mt -68.33 -32.8 73.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . 0.451 ' HE3' HG11 ' D' 1103 ' ' VAL . 30.3 tptt -70.35 -52.08 25.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.32 -1.487 . . . . 0.0 109.451 -178.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -54.45 -52.34 62.15 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 127.783 2.433 . . . . 0.0 106.165 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 29.3 t -52.76 -48.11 66.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.733 1.213 . . . . 0.0 112.595 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -52.47 57.73 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.66 -37.96 83.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.332 0.969 . . . . 0.0 111.263 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.49 -40.82 93.53 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 117.983 -1.008 . . . . 0.0 109.486 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 54.3 ttp -66.46 -28.94 68.98 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.868 0.758 . . . . 0.0 109.546 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.18 -32.75 65.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.462 1.028 . . . . 0.0 112.075 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 -32.76 26.08 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . 0.458 HG22 ' HD2' ' B' ' 126' ' ' PRO . 4.0 p -85.26 148.1 49.1 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.08 0.952 . . . . 0.0 109.664 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.458 ' HD2' HG22 ' B' ' 125' ' ' VAL . 60.5 Cg_endo -63.31 173.6 4.07 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.939 1.371 . . . . 0.0 110.133 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.43 55.16 1.71 Allowed Pre-proline 0 CA--C 1.548 0.877 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.73 -49.61 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 123.116 2.544 . . . . 0.0 114.35 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -28.51 69.55 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.118 -0.989 . . . . 0.0 108.46 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 11.4 t -61.4 -49.84 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -55.2 -51.36 66.78 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.602 1.561 . . . . 0.0 111.152 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 m -67.91 -46.31 71.91 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -57.98 -49.22 77.57 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.244 0.617 . . . . 0.0 109.409 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -43.26 67.87 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.903 1.681 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.09 -57.08 5.37 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.122 0.487 . . . . 0.0 111.844 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -61.09 -29.72 69.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.309 0.643 . . . . 0.0 112.094 -178.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.22 -37.73 52.73 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 178.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -58.55 -33.07 69.5 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.741 1.155 . . . . 0.0 109.395 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.43 -21.02 49.48 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 119.11 -0.471 . . . . 0.0 111.243 178.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.54 0.584 0 C-N-CA 125.144 1.378 . . . . 0.0 112.075 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.9 tp10 . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 18.9 tp -67.37 108.99 2.97 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.838 0.855 . . . . 0.0 109.283 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.4 mt -104.42 153.3 21.27 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -126.08 101.4 6.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.43 1.092 . . . . 0.0 109.175 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.03 113.0 40.05 Favored Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -91.49 122.44 0.71 Allowed 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 123.21 2.607 . . . . 0.0 109.751 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.1 t -142.27 154.59 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 125.834 1.653 . . . . 0.0 109.398 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 26.0 ptt180 -136.73 101.81 4.72 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 121.399 1.909 . . . . 0.0 111.034 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.18 138.28 5.05 Favored Glycine 0 N--CA 1.46 0.235 0 CA-C-O 116.326 -2.374 . . . . 0.0 107.645 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -52.1 27.62 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 121.008 2.404 . . . . 0.0 111.294 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.46 -41.9 92.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.364 0.529 . . . . 0.0 109.796 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -47.63 84.87 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 52.8 t80 -65.11 -40.81 95.04 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.439 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -55.11 -57.68 10.73 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.986 0.812 . . . . 0.0 108.994 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 24.6 ptm -67.65 -35.42 78.86 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.8 -41.63 91.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.533 1.061 . . . . 0.0 110.844 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.33 -47.93 58.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 178.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -56.6 -48.61 77.05 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.128 0.971 . . . . 0.0 112.888 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 93.3 mt -70.33 -35.89 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 119.304 0.956 . . . . 0.0 110.242 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -36.34 83.46 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.6 -54.84 10.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 117.871 -1.062 . . . . 0.0 110.607 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.5 p -53.51 -43.59 68.43 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.363 1.438 . . . . 0.0 113.856 -178.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.98 -47.52 51.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.812 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -64.35 -46.09 84.94 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 67.5 mt -62.16 -44.9 95.6 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.963 0.905 . . . . 0.0 109.909 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -59.25 -41.68 89.34 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.755 0.822 . . . . 0.0 109.079 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -75.08 -25.28 58.47 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.784 0.434 . . . . 0.0 111.169 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.56 -39.17 58.57 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.373 0.988 . . . . 0.0 110.849 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 C--O 1.236 0.347 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.069 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.25 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.828 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.41 58.25 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.448 1.022 . . . . 0.0 111.883 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 47.6 mm -73.25 -40.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-O 118.548 -0.739 . . . . 0.0 110.51 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -58.98 -49.2 78.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.874 0.761 . . . . 0.0 110.474 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.0 m -61.45 -40.16 93.46 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.972 0.509 . . . . 0.0 110.965 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -53.83 26.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.825 0.45 . . . . 0.0 111.196 -179.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 16.7 ttp85 -62.26 -40.71 97.09 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.212 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -59.05 -47.87 83.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.646 0.657 . . . . 0.0 109.334 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -65.09 -45.54 84.79 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.612 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -56.37 -48.32 77.07 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.71 0.804 . . . . 0.0 110.0 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -58.49 -40.36 82.55 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.978 0.911 . . . . 0.0 110.22 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 CA--C 1.534 0.343 0 C-N-CA 123.976 0.91 . . . . 0.0 110.771 179.605 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.242 0.658 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -131.74 129.74 41.02 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -112.43 174.11 6.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.258 0.623 . . . . 0.0 112.317 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 17.4 tp -150.32 153.35 35.95 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.713 178.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.15 98.82 2.74 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.88 2.072 . . . . 0.0 109.065 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . 0.451 HG11 ' HE3' ' B' ' 116' ' ' LYS . 60.9 t -153.18 147.03 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.384 -0.823 . . . . 0.0 108.861 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -103.98 102.84 12.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.659 -1.276 . . . . 0.0 108.406 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.13 110.53 0.63 Allowed Glycine 0 C--O 1.223 -0.586 0 CA-C-O 117.289 -1.839 . . . . 0.0 111.695 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -67.42 -57.17 7.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 121.225 2.512 . . . . 0.0 110.189 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -69.79 -42.57 73.59 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 122.143 0.973 . . . . 0.0 109.538 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.05 -43.06 99.45 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.764 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 10.2 t80 -69.99 -37.96 75.88 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 120.086 1.312 . . . . 0.0 110.829 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -56.17 -47.49 78.16 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.425 1.011 . . . . 0.0 109.493 178.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . 0.439 ' CG2' HD11 ' A' ' 22' ' ' ILE . 22.5 mt -62.42 -50.16 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.826 1.25 . . . . 0.0 109.15 178.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -49.04 77.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 125.457 1.503 . . . . 0.0 112.082 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.31 -52.16 63.09 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 120.957 1.708 . . . . 0.0 109.114 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -48.79 -51.82 27.23 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.157 0.583 . . . . 0.0 111.12 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 41.8 mt -71.25 -39.67 71.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 33.6 tptt -65.27 -46.1 81.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 120.121 1.328 . . . . 0.0 110.161 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -57.18 -54.92 41.36 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.856 1.662 . . . . 0.0 106.691 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 5.5 t -52.74 -43.93 66.07 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.081 0.952 . . . . 0.0 111.765 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.81 -49.01 62.06 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -63.07 -42.05 99.57 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 5.3 mp -65.42 -45.66 83.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.846 -1.074 . . . . 0.0 108.852 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 22.7 ttp -64.35 -22.57 67.0 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.749 1.613 . . . . 0.0 111.362 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -72.25 -40.36 67.75 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.71 -33.08 35.56 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.53 147.98 68.89 Favored Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 124.752 1.221 . . . . 0.0 109.867 -179.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.92 -174.16 1.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.543 2.162 . . . . 0.0 110.162 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.253 13.3 pt20 -126.63 54.04 10.84 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.48 -52.51 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.935 2.423 . . . . 0.0 112.51 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.45 -41.78 85.9 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . 0.426 HG23 ' H ' ' D' 1130 ' ' VAL . 3.4 t -53.74 -50.27 52.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 C-N-CA 124.401 1.08 . . . . 0.0 110.529 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.29 70.22 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.491 0.662 . . . . 0.0 111.606 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 27.8 t -60.46 -46.28 90.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.792 0.837 . . . . 0.0 110.786 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.25 -45.24 81.29 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 124.716 1.206 . . . . 0.0 110.926 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.74 -45.26 66.92 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 124.5 1.12 . . . . 0.0 108.747 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -65.75 -55.96 14.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.229 0.468 . . . . 0.0 111.02 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.74 -30.88 64.0 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.579 -0.701 . . . . 0.0 112.408 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 -35.58 34.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.103 0.961 . . . . 0.0 108.772 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -58.12 -33.17 68.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.45 1.023 . . . . 0.0 108.935 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.42 -17.68 59.86 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.191 0.451 . . . . 0.0 112.135 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tt . . . . . 0 CA--C 1.538 0.51 0 C-N-CA 125.411 1.484 . . . . 0.0 108.912 179.036 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 . . . . . 0 N--CA 1.449 -0.482 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.5 tp -64.13 102.74 0.53 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.6 mt -112.77 167.71 10.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.833 2.053 . . . . 0.0 107.709 -179.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -130.26 159.43 36.92 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.808 0.843 . . . . 0.0 109.799 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.4 tp -140.39 94.72 8.41 Favored Pre-proline 0 CA--C 1.538 0.482 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.115 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.85 110.3 3.0 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 124.303 3.336 . . . . 0.0 111.653 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -139.32 151.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.535 1.134 . . . . 0.0 109.215 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -135.98 101.81 4.84 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.3 115.79 0.64 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 106.269 -2.732 . . . . 0.0 106.269 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.55 -52.01 66.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 121.315 2.558 . . . . 0.0 109.828 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -68.96 -30.72 69.2 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.4 m -63.39 -53.13 57.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.068 0.947 . . . . 0.0 109.182 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -64.87 -47.6 77.28 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.73 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -53.41 -44.87 69.07 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.422 0.556 . . . . 0.0 111.722 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.5 mtp -73.79 -43.78 57.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.554 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mp -55.24 -50.88 68.33 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.058 0.845 . . . . 0.0 109.186 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -52.71 63.2 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 126.759 2.023 . . . . 0.0 111.289 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -55.5 -49.38 72.71 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.005 0.821 . . . . 0.0 112.225 -178.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.438 HG23 HD22 ' B' ' 115' ' ' LEU . 80.9 mt -66.12 -48.84 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -55.13 -47.21 75.36 Favored 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.06 0.944 . . . . 0.0 111.0 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -59.03 -50.14 75.2 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.047 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.8 p -53.81 -51.44 63.5 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.937 1.244 . . . . 0.0 112.936 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -62.57 -49.74 74.06 Favored 'General case' 0 C--N 1.345 0.41 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.47 -43.31 94.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.638 -178.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.87 -36.71 85.22 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.634 -0.666 . . . . 0.0 109.778 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -60.26 -44.39 95.34 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -78.69 -17.33 56.08 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.987 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -81.46 -24.13 37.0 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.003 1.274 . . . . 0.0 109.735 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.8 tp . . . . . 0 CA--C 1.534 0.339 0 C-N-CA 124.14 0.976 . . . . 0.0 109.006 -179.963 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 120.302 0.096 . . . . 0.0 111.098 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.3 m -57.08 -51.13 70.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.234 1.414 . . . . 0.0 109.905 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 66.8 mt -59.1 -45.19 92.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 124.99 1.316 . . . . 0.0 108.92 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -60.23 -45.46 93.14 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.4 m -61.26 -48.19 82.58 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.109 0.963 . . . . 0.0 108.525 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.4 -50.42 71.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.784 0.833 . . . . 0.0 109.179 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttt-85 -56.09 -47.04 78.8 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 119.221 -0.419 . . . . 0.0 110.985 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -56.93 15.03 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.429 1.092 . . . . 0.0 110.423 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -55.76 -35.86 66.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.357 1.063 . . . . 0.0 111.352 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -69.51 -48.74 59.52 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -60.26 -38.8 84.65 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.59 1.156 . . . . 0.0 111.183 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 C-N-CA 124.037 0.935 . . . . 0.0 110.715 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 51.7 m . . . . . 0 N--CA 1.447 -0.614 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . 0.43 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 37.7 m-85 -120.68 130.58 54.15 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 121.675 0.75 . . . . 0.0 109.445 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -112.26 159.12 18.93 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 127.529 2.332 . . . . 0.0 109.846 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.445 ' HB3' ' HE2' ' D' 1116 ' ' LYS . 28.5 mt -150.65 142.27 23.59 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 179.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -147.69 106.92 3.87 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.117 1.767 . . . . 0.0 112.068 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.433 ' CG2' ' HE3' ' D' 1116 ' ' LYS . 53.2 t -155.22 149.75 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 120.39 1.45 . . . . 0.0 110.425 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.1 102.42 14.95 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 102.575 -3.12 . . . . 0.0 102.575 176.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.65 109.78 0.56 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 115.671 -2.738 . . . . 0.0 106.44 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -68.32 -56.98 6.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 121.873 2.837 . . . . 0.0 112.002 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -64.31 -46.55 83.06 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.29 -51.19 60.0 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 125.062 1.345 . . . . 0.0 110.781 -178.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' D' 1099 ' ' TYR . 57.4 t80 -65.78 -45.74 81.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 119.753 1.161 . . . . 0.0 112.497 -178.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -55.55 -53.65 53.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.964 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.0 -57.17 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 124.902 1.281 . . . . 0.0 109.452 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 49.6 mt -57.08 -27.99 62.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.823 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.5 mmm -72.39 -52.16 17.25 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.35 -45.44 69.13 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.438 HD22 HG23 ' A' ' 22' ' ' ILE . 42.6 mt -67.03 -31.47 72.02 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -68.01 -56.55 8.51 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -52.89 -57.0 11.72 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 128.64 2.776 . . . . 0.0 110.319 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 11.6 t -54.47 -52.12 62.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.083 1.353 . . . . 0.0 111.6 -179.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.441 ' HB3' HD21 ' D' 1108 ' ' ASN . 4.3 mm? -66.99 -30.75 70.95 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.485 1.039 . . . . 0.0 111.161 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -65.8 -45.43 82.41 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 120.998 1.726 . . . . 0.0 108.347 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 30.1 mt -63.14 -49.86 72.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.13 0.972 . . . . 0.0 109.582 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 ttt -56.86 -35.49 68.95 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.654 0.782 . . . . 0.0 110.605 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -72.43 -33.03 66.8 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.383 1.073 . . . . 0.0 112.458 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.1 pp -93.15 -31.37 14.81 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 66.3 t -84.32 145.68 46.03 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 125.476 1.51 . . . . 0.0 108.392 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.74 -176.7 1.01 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.549 2.833 . . . . 0.0 111.959 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.78 34.76 0.21 Allowed Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.1 -44.87 21.85 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 122.857 2.056 . . . . 0.0 112.766 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.5 -26.17 67.04 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 13.9 t -72.23 -47.76 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -59.24 -51.7 68.84 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.785 1.234 . . . . 0.0 111.319 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 19.4 m -62.08 -49.15 77.09 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 122.358 -0.214 . . . . 0.0 110.822 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -63.09 -38.37 90.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.306 -0.246 . . . . 0.0 110.996 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -44.69 87.57 Favored 'General case' 0 C--N 1.337 0.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -66.18 -44.44 83.98 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.244 0.618 . . . . 0.0 109.996 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -59.66 -55.29 36.29 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.172 0.989 . . . . 0.0 111.233 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -37.49 84.8 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -58.21 -34.84 70.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.719 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.86 -25.33 68.23 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 120.314 1.415 . . . . 0.0 111.457 178.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp . . . . . 0 N--CA 1.464 0.265 0 CA-C-N 119.461 1.028 . . . . 0.0 112.911 -179.903 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.73 109.32 0.9 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.14 151.36 34.5 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 105.709 -1.96 . . . . 0.0 105.709 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -117.83 101.28 8.18 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.36 0.982 . . . . 0.0 109.461 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 10.3 tp -75.52 112.04 17.22 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 117.154 -1.403 . . . . 0.0 109.845 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -88.84 117.46 0.88 Allowed 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 124.46 3.44 . . . . 0.0 111.514 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.8 t -145.75 149.24 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.129 0.877 . . . . 0.0 112.981 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -133.64 100.41 4.78 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 175.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.57 104.19 0.22 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 105.633 -2.987 . . . . 0.0 105.633 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 24.2 tpt180 -57.27 -51.43 69.41 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 121.122 2.461 . . . . 0.0 111.8 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.7 -41.5 87.92 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 118.593 0.633 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -62.53 -35.98 81.14 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.131 0.972 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 35.0 t80 -69.45 -50.45 45.47 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.825 -1.172 . . . . 0.0 109.298 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -56.33 -54.51 44.65 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.502 1.121 . . . . 0.0 110.297 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 45.9 mtp -63.45 -38.05 89.64 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.506 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.88 -46.15 86.18 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.106 1.321 . . . . 0.0 110.021 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.33 -48.21 76.42 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 123.924 0.89 . . . . 0.0 111.431 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -55.65 -49.09 73.82 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.612 0.765 . . . . 0.0 110.783 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 95.6 mt -66.54 -49.62 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -53.38 -44.43 68.61 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 124.132 0.973 . . . . 0.0 111.164 -179.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -62.65 -48.67 78.32 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.42 -179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 86.4 p -53.64 -46.85 70.66 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.822 1.192 . . . . 0.0 112.781 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.93 -58.08 5.14 Favored 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 123.331 0.652 . . . . 0.0 112.552 -179.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.94 -52.47 62.89 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.372 1.069 . . . . 0.0 111.398 -178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.9 -43.33 94.88 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.496 -0.752 . . . . 0.0 111.757 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 17.0 tmm? -62.95 -43.76 97.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 118.72 0.691 . . . . 0.0 110.956 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -67.51 -23.45 65.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.684 0.675 . . . . 0.0 111.02 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.93 -23.01 39.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.282 0.633 . . . . 0.0 110.407 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 24.5 tp . . . . . 0 CA--C 1.537 0.453 0 C-N-CA 124.687 1.195 . . . . 0.0 110.609 179.899 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 14.9 m-70 . . . . . 0 CA--C 1.534 0.344 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 57.0 m -61.63 -50.62 71.81 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 72.1 mt -59.79 -47.12 92.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 126.341 1.856 . . . . 0.0 108.726 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -54.51 -48.22 72.17 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.779 1.632 . . . . 0.0 111.033 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.0 m -66.3 -46.13 78.02 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.122 0.969 . . . . 0.0 108.87 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -42.72 81.11 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 124.011 0.925 . . . . 0.0 110.192 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -58.54 -46.76 86.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.51 -41.81 96.2 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.643 -1.17 . . . . 0.0 111.0 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.34 -49.46 72.16 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.951 1.25 . . . . 0.0 109.111 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -60.33 -47.25 86.82 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.072 0.949 . . . . 0.0 110.28 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -64.65 -29.73 70.73 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.73 0.812 . . . . 0.0 111.977 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.336 0 C-N-CA 124.685 1.194 . . . . 0.0 110.764 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 29.0 m . . . . . 0 C--O 1.235 0.32 0 CA-C-O 121.448 0.642 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . 0.426 ' HB3' ' CD2' ' B' ' 109' ' ' PHE . 43.8 m-85 -107.16 134.8 49.73 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.59 144.67 47.99 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 128.206 2.602 . . . . 0.0 112.437 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 62.2 mt -147.57 155.16 41.55 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.353 1.461 . . . . 0.0 110.145 178.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -152.16 108.84 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.565 1.546 . . . . 0.0 111.927 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 95.0 t -153.19 150.15 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-N 120.344 1.429 . . . . 0.0 109.757 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.54 102.92 12.82 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.2 113.68 0.79 Allowed Glycine 0 N--CA 1.454 -0.141 0 N-CA-C 106.65 -2.58 . . . . 0.0 106.65 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -64.92 -57.03 9.86 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 121.265 2.533 . . . . 0.0 110.538 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 19.8 mttp -63.18 -42.5 99.37 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.965 0.802 . . . . 0.0 108.98 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . 0.441 HD21 ' HB3' ' B' ' 119' ' ' LEU . 88.7 m-20 -60.03 -40.75 90.42 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.296 -178.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . 0.43 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 28.8 t80 -65.25 -43.7 90.51 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 120.372 1.442 . . . . 0.0 109.23 178.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -58.37 -53.75 54.82 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.113 0.87 . . . . 0.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.75 -57.91 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.197 1.399 . . . . 0.0 110.132 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 66.8 mt -59.47 -35.85 74.87 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 117.15 -1.405 . . . . 0.0 111.309 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -49.46 74.42 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 120.557 1.526 . . . . 0.0 108.602 178.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 51.8 mttm -53.57 -50.94 64.47 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.29 -33.01 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' B' ' 101' ' ' LEU . 27.8 tptt -64.79 -57.96 7.52 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -52.28 -49.39 64.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.487 1.915 . . . . 0.0 108.319 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 28.7 t -52.96 -55.02 26.54 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.238 1.815 . . . . 0.0 114.281 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.56 -36.47 82.73 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.473 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -68.81 -38.1 79.68 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.738 1.154 . . . . 0.0 110.222 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 46.7 mt -65.33 -44.93 86.24 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.923 -0.486 . . . . 0.0 109.882 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttt -61.86 -38.32 87.8 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.244 1.018 . . . . 0.0 110.693 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.47 -44.08 79.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.749 -0.594 . . . . 0.0 110.643 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.3 pp -75.65 -31.78 59.95 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.42 147.37 34.28 Favored Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 120.105 1.32 . . . . 0.0 110.064 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -73.2 177.48 7.78 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.057 1.838 . . . . 0.0 108.95 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.61 47.12 0.28 Allowed Pre-proline 0 CA--C 1.556 1.178 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -178.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.45 -48.03 0.64 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.091 1.861 . . . . 0.0 112.981 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.92 -25.89 68.35 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 17.2 t -72.12 -48.15 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 126.22 1.808 . . . . 0.0 108.755 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.67 -41.41 81.48 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.505 0.722 . . . . 0.0 110.145 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 50.8 m -70.84 -50.23 37.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.352 1.061 . . . . 0.0 110.877 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.53 -35.59 78.16 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.323 0.965 . . . . 0.0 110.368 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.61 -47.16 86.68 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -60.84 -48.12 83.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.499 1.045 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -56.57 -57.86 10.56 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.312 1.045 . . . . 0.0 111.448 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -34.86 78.95 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.859 -0.526 . . . . 0.0 111.976 -178.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.87 -27.53 68.29 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.42 -38.75 85.05 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.714 0 C-N-CA 126.581 1.952 . . . . 0.0 112.338 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 121.917 0.865 . . . . 0.0 111.574 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 13.0 tp -73.16 94.7 1.98 Allowed 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mt -93.32 161.24 14.48 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.029 0.931 . . . . 0.0 110.761 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -134.16 118.61 17.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.627 1.571 . . . . 0.0 108.756 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 43.6 tp -108.96 100.2 38.87 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 123.796 0.838 . . . . 0.0 110.532 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.74 125.42 7.45 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.202 2.601 . . . . 0.0 111.16 178.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.2 t -145.15 146.18 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.788 1.635 . . . . 0.0 107.919 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -126.01 100.19 6.25 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.4 126.14 1.37 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -66.99 -52.68 39.75 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 120.781 2.291 . . . . 0.0 109.712 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.95 -33.72 75.2 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 122.4 0.28 . . . . 0.0 110.751 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -45.87 92.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -67.03 -40.05 87.11 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.089 0.404 . . . . 0.0 111.435 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -60.48 -57.36 13.07 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.588 0.755 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.4 ppp? -62.87 -38.94 92.88 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.822 -0.608 . . . . 0.0 110.591 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.38 -50.6 72.24 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mt -59.51 -47.31 86.03 Favored 'General case' 0 C--O 1.23 0.066 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.298 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -62.59 -47.37 84.11 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.489 1.04 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.5 mt -65.03 -41.03 90.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 123.707 0.803 . . . . 0.0 110.371 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -62.47 -60.07 4.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.569 1.148 . . . . 0.0 108.726 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.19 -47.14 84.35 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.192 0.932 . . . . 0.0 110.557 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.7 t -52.46 -51.61 58.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.287 0.949 . . . . 0.0 112.631 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.46 -47.67 69.44 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.462 0.574 . . . . 0.0 109.484 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -55.25 -49.44 72.03 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 118.203 0.456 . . . . 0.0 111.665 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.26 -46.23 67.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 117.541 -1.219 . . . . 0.0 110.112 -178.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -36.02 72.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 120.134 1.334 . . . . 0.0 110.596 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -69.64 -35.59 75.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.104 1.362 . . . . 0.0 110.678 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -83.72 -36.86 23.36 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.673 0.789 . . . . 0.0 113.016 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 CA--C 1.536 0.406 0 CA-C-N 119.228 0.922 . . . . 0.0 108.55 179.549 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 83.0 t60 . . . . . 0 CA--C 1.535 0.38 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.9 m -59.84 -38.24 81.51 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.751 0.705 . . . . 0.0 110.963 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.58 -42.45 96.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.95 0.9 . . . . 0.0 109.16 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -62.82 -50.08 72.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.557 0.743 . . . . 0.0 109.132 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.46 -37.52 83.87 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.265 0.555 . . . . 0.0 110.191 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -66.73 -54.08 26.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.318 1.047 . . . . 0.0 111.362 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -63.94 -33.23 75.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.845 1.202 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -61.32 -57.99 10.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.678 -1.231 . . . . 0.0 107.678 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -65.17 -30.71 71.64 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.205 0.911 . . . . 0.0 113.206 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -58.17 -46.72 85.24 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -76.11 -51.34 12.43 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 111.593 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 . . . . . 0 C--O 1.222 -0.376 0 CA-C-O 116.698 -1.62 . . . . 0.0 113.649 -177.922 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.445 0 CA-C-O 121.051 0.453 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -122.65 148.75 44.91 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.094 0.957 . . . . 0.0 109.425 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -134.3 160.18 38.69 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 124.603 1.161 . . . . 0.0 109.292 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 79.1 mt -144.3 161.19 39.57 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -150.57 110.11 4.02 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.287 1.835 . . . . 0.0 106.954 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 1.9 m -155.89 151.32 9.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.115 0.966 . . . . 0.0 111.473 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.443 ' HB3' ' HA ' ' D' 1098 ' ' THR . 3.7 ptt180 -117.6 100.62 7.75 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 119.744 1.156 . . . . 0.0 111.682 178.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.4 119.65 1.25 Allowed Glycine 0 CA--C 1.521 0.427 0 CA-C-O 116.429 -2.317 . . . . 0.0 109.058 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -61.55 -56.89 15.09 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 121.451 2.626 . . . . 0.0 109.298 178.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -58.59 -47.13 85.33 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.23 0.612 . . . . 0.0 109.652 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -58.89 -44.71 91.22 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 112.525 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -64.13 -44.92 90.72 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 120.645 1.566 . . . . 0.0 110.596 -178.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -56.37 -54.16 48.78 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 122.016 0.912 . . . . 0.0 111.694 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.519 HG21 HD11 ' C' 1022 ' ' ILE . 57.6 mt -69.1 -49.18 64.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -177.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 76.7 mt -61.44 -38.17 86.2 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 119.75 1.159 . . . . 0.0 110.657 -179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 69.4 mtp -61.42 -52.89 62.71 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.316 0.962 . . . . 0.0 110.032 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -63.34 -40.73 98.11 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.379 -178.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.84 -36.45 78.17 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.547 1.067 . . . . 0.0 111.207 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 7.2 tptp -70.66 -47.34 60.45 Favored 'General case' 0 N--CA 1.462 0.152 0 O-C-N 120.343 -1.473 . . . . 0.0 108.484 178.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -58.16 -51.59 69.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.411 1.485 . . . . 0.0 110.233 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.3 m -61.0 -39.94 91.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.509 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -41.96 89.92 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 119.128 0.876 . . . . 0.0 109.122 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.16 -36.72 84.97 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.48 0.582 . . . . 0.0 111.149 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -68.17 -47.97 66.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 33.1 ttp -65.9 -27.97 68.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 118.728 0.695 . . . . 0.0 109.993 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -68.63 -39.57 80.69 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.061 -0.971 . . . . 0.0 109.191 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.9 -24.23 44.3 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.993 1.27 . . . . 0.0 111.55 179.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.54 145.05 66.64 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.21 -84.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.841 0 N-CA-C 108.377 -1.432 . . . . 0.0 108.377 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -167.65 63.04 0.63 Allowed Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 125.013 1.325 . . . . 0.0 110.14 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -70.93 -106.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 124.049 3.166 . . . . 0.0 112.178 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.41 -25.6 66.06 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 120.906 -1.122 . . . . 0.0 109.168 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 t -54.98 -45.15 76.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.509 1.124 . . . . 0.0 108.559 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -74.9 -44.17 50.3 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.861 0.865 . . . . 0.0 110.998 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 22.9 t -61.96 -51.55 67.63 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.288 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.6 -39.5 93.83 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.072 0.949 . . . . 0.0 110.488 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -55.83 -46.98 77.99 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-N 118.999 0.818 . . . . 0.0 109.152 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -65.36 -51.89 57.44 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.89 -47.69 70.84 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.148 0.979 . . . . 0.0 112.996 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.98 -34.5 75.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.576 1.08 . . . . 0.0 109.053 179.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -28.05 69.2 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.039 -1.038 . . . . 0.0 109.536 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 58.9 mt -63.45 -15.65 58.34 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.087 0.858 . . . . 0.0 112.235 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.8 tt . . . . . 0 CA--C 1.536 0.428 0 C-N-CA 124.917 1.287 . . . . 0.0 110.302 178.822 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 7.3 tp10 . . . . . 0 N--CA 1.441 -0.923 0 CA-C-O 121.969 0.89 . . . . 0.0 112.673 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.5 tp -72.86 95.91 2.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.881 1.672 . . . . 0.0 106.787 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 46.3 mt -100.31 168.81 9.54 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -140.23 147.23 39.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.878 1.271 . . . . 0.0 108.743 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 33.3 tp -124.02 94.5 45.48 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.037 1.335 . . . . 0.0 108.02 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.56 121.48 5.59 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.764 2.309 . . . . 0.0 109.505 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.9 t -144.94 159.92 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.298 1.039 . . . . 0.0 109.674 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 12.7 ptt-85 -136.52 102.9 5.08 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.988 1.267 . . . . 0.0 109.186 176.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.97 139.01 5.5 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 117.613 -1.66 . . . . 0.0 110.274 178.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -71.03 -52.09 21.55 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.618 2.209 . . . . 0.0 106.901 177.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.3 -46.5 67.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.669 1.188 . . . . 0.0 107.817 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -56.41 -44.93 80.83 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.217 0.462 . . . . 0.0 111.308 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.2 t80 -65.29 -51.57 59.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.765 0.712 . . . . 0.0 111.0 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -54.97 -57.11 12.99 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.477 1.111 . . . . 0.0 111.414 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ppp? -61.02 -46.78 89.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.513 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 33.9 mt -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 117.747 -1.121 . . . . 0.0 110.427 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.63 -53.14 61.11 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 120.048 1.295 . . . . 0.0 110.632 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -55.58 -48.62 74.52 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . 0.519 HD11 HG21 ' B' ' 111' ' ' ILE . 84.5 mt -67.69 -43.07 86.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 122.996 0.518 . . . . 0.0 112.264 -178.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -66.57 -48.92 68.08 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 118.159 -0.924 . . . . 0.0 109.817 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.83 -44.86 91.96 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.238 -0.887 . . . . 0.0 108.611 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 16.2 t -56.97 -38.09 72.52 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.661 1.119 . . . . 0.0 111.737 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.5 tm? -71.09 -57.75 4.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.195 0.598 . . . . 0.0 110.743 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -56.35 -48.04 77.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.875 0.47 . . . . 0.0 110.119 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.14 -47.04 86.75 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 118.279 -0.867 . . . . 0.0 109.523 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.3 68.66 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.372 0.987 . . . . 0.0 110.907 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -71.58 -34.59 70.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.663 0.785 . . . . 0.0 111.734 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -77.84 -27.51 49.91 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.887 1.221 . . . . 0.0 110.637 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 CA--C 1.537 0.454 0 C-N-CA 123.946 0.898 . . . . 0.0 109.357 178.95 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.5 t-160 . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 23.8 m -65.49 -34.1 77.47 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.981 -1.074 . . . . 0.0 111.123 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.91 -44.94 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.268 1.427 . . . . 0.0 109.921 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.77 -56.75 13.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.584 1.153 . . . . 0.0 108.759 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 83.0 m -59.24 -36.43 75.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.339 -0.838 . . . . 0.0 110.67 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 32.0 t80 -61.09 -53.89 51.46 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.293 0.951 . . . . 0.0 109.158 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -41.67 94.47 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.975 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.58 -46.58 89.69 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.061 0.846 . . . . 0.0 110.708 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -66.41 -40.23 89.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.957 0.799 . . . . 0.0 110.625 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -57.74 -52.62 64.72 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.701 1.2 . . . . 0.0 108.822 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -64.15 -43.86 93.92 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.069 0.948 . . . . 0.0 111.017 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 . . . . . 0 C--N 1.339 0.121 0 CA-C-O 117.078 -1.439 . . . . 0.0 113.108 -179.125 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . 0.443 ' HA ' ' HB3' ' B' ' 104' ' ' ARG . 40.6 m . . . . . 0 C--O 1.233 0.199 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -115.69 158.27 23.03 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -138.13 161.26 37.26 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.973 0.909 . . . . 0.0 108.961 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 69.3 mt -139.08 153.36 48.03 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -146.94 99.49 3.19 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 127.861 2.465 . . . . 0.0 105.798 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.49 151.09 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 124.467 1.107 . . . . 0.0 111.146 -178.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.49 102.06 8.01 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 122.212 1.006 . . . . 0.0 110.266 178.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.63 110.02 0.57 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.848 -2.501 . . . . 0.0 106.848 178.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 -55.53 -57.46 11.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 121.358 2.579 . . . . 0.0 112.43 -179.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 98.7 mttt -66.37 -39.51 89.16 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.001 -0.437 . . . . 0.0 110.026 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -56.5 -50.71 71.0 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.976 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.08 -43.88 97.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.15 0.886 . . . . 0.0 111.464 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.33 -51.62 69.01 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.551 0.614 . . . . 0.0 110.823 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 83.9 mt -66.9 -54.53 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.58 1.152 . . . . 0.0 110.742 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.34 -32.66 68.73 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.189 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 31.4 mtp -66.3 -52.08 50.92 Favored 'General case' 0 C--N 1.345 0.383 0 CA-C-N 119.764 1.166 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -60.69 -41.56 95.4 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 119.303 -0.959 . . . . 0.0 110.712 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.07 -60.79 2.64 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.659 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 15.7 tptp -53.88 -45.11 70.94 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.298 0.954 . . . . 0.0 112.724 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.05 -49.75 74.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.661 0.6 . . . . 0.0 109.481 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.9 m -61.71 -34.84 76.5 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.85 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -66.07 -42.07 89.91 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.928 1.291 . . . . 0.0 108.508 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.32 -44.01 89.19 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.83 -38.02 89.09 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.424 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttp -77.26 -20.05 55.69 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 120.548 1.522 . . . . 0.0 109.957 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -81.89 -26.07 34.45 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.077 -1.014 . . . . 0.0 111.079 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -92.08 -33.55 14.74 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.316 -0.865 . . . . 0.0 110.441 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 80.5 t -85.32 147.14 46.47 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.93 -88.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.018 3.145 . . . . 0.0 114.818 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -170.64 58.64 0.29 Allowed Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.341 1.456 . . . . 0.0 110.864 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.3 -90.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.421 2.747 . . . . 0.0 113.39 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.6 -25.1 67.24 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.7 t -54.61 -56.4 10.54 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.675 1.19 . . . . 0.0 108.937 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 13.2 t0 -69.4 -44.64 71.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.683 0.674 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 7.6 t -55.82 -50.44 70.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.118 0.567 . . . . 0.0 111.621 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 17.9 t80 -69.08 -43.75 73.92 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -45.58 69.51 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 119.411 1.005 . . . . 0.0 110.56 179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -64.76 -53.12 52.15 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 119.623 1.101 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.5 -40.89 75.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.44 1.496 . . . . 0.0 111.39 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.04 -32.29 39.5 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.341 1.856 . . . . 0.0 110.251 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -57.08 -39.25 74.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 58.0 mt -53.62 -21.44 6.74 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.565 0 C-N-CA 124.489 1.116 . . . . 0.0 111.99 179.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 . . . . . 0 C--O 1.233 0.225 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.94 127.29 32.12 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 43.0 mt -120.47 173.91 6.87 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.297 1.439 . . . . 0.0 109.634 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -139.84 149.82 43.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -116.12 96.55 47.57 Favored Pre-proline 0 CA--C 1.536 0.439 0 C-N-CA 124.772 1.229 . . . . 0.0 108.653 -179.437 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.71 110.97 1.69 Allowed 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.3 3.333 . . . . 0.0 112.9 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.9 t -144.84 158.77 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.849 1.204 . . . . 0.0 110.46 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 50.0 ttt-85 -135.05 103.44 5.56 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.062 1.345 . . . . 0.0 108.651 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.22 132.6 2.65 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 108.181 -1.968 . . . . 0.0 108.181 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt85 -70.63 -51.35 28.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 121.132 2.466 . . . . 0.0 109.885 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.09 -36.3 77.43 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 m -63.29 -52.22 62.86 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.218 -0.896 . . . . 0.0 109.787 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -58.17 -47.79 82.3 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 119.719 1.145 . . . . 0.0 110.337 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -54.15 -57.19 12.07 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.803 0.69 . . . . 0.0 112.319 -179.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -66.95 -43.8 82.22 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.076 0.55 . . . . 0.0 111.929 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.2 tp -55.83 -49.21 73.89 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.785 0.834 . . . . 0.0 110.016 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 tt -70.48 -47.87 58.5 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.032 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -55.35 -44.84 76.33 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.887 1.221 . . . . 0.0 113.657 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -75.4 -32.17 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -68.29 -41.88 80.32 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.462 -1.399 . . . . 0.0 109.252 178.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.34 -55.5 17.88 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 125.653 1.581 . . . . 0.0 110.791 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 p -54.16 -43.41 70.59 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.626 0.648 . . . . 0.0 110.594 179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.01 -56.49 8.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.808 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -53.71 -43.39 68.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.406 1.003 . . . . 0.0 111.743 -178.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.9 -53.68 19.79 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.165 -0.922 . . . . 0.0 108.842 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -54.93 -49.08 72.19 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.122 1.328 . . . . 0.0 110.835 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -64.03 -27.18 68.94 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.047 0.84 . . . . 0.0 110.995 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -77.39 -49.26 15.26 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.516 1.053 . . . . 0.0 110.687 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.494 HD22 HD22 ' B' ' 129' ' ' LEU . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.537 0 C-N-CA 125.084 1.353 . . . . 0.0 113.027 -179.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 t60 . . . . . 0 CA--C 1.534 0.36 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.74 -49.12 78.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.331 1.452 . . . . 0.0 111.813 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.6 mm -60.68 -43.51 95.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 124.924 1.289 . . . . 0.0 109.699 -178.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.62 -53.16 61.44 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 125.524 1.53 . . . . 0.0 108.407 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.6 m -63.3 -34.67 78.2 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.085 -0.96 . . . . 0.0 110.96 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -61.53 -49.16 77.81 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 120.618 1.554 . . . . 0.0 107.942 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.61 -45.86 92.28 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.238 1.015 . . . . 0.0 109.093 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -60.34 -44.8 95.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.543 1.537 . . . . 0.0 111.93 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.24 -45.89 91.29 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.076 1.351 . . . . 0.0 110.528 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -60.05 -50.95 71.7 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.05 -0.66 . . . . 0.0 110.635 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.52 -35.27 80.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 118.505 -0.759 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 . . . . . 0 C--O 1.225 -0.221 0 CA-C-N 119.293 0.951 . . . . 0.0 111.022 179.759 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.239 0.521 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -113.16 131.08 55.99 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -107.22 159.74 16.12 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.016 0.926 . . . . 0.0 112.574 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 mp -143.65 156.17 44.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 126.004 1.722 . . . . 0.0 106.97 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 100.85 2.86 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.452 1.901 . . . . 0.0 106.574 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.584 HG21 ' HD2' ' D' 1116 ' ' LYS . 3.6 m -149.22 151.55 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -178.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt85 -118.52 101.7 8.34 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 122.68 1.228 . . . . 0.0 109.066 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.13 106.59 0.42 Allowed Glycine 0 N--CA 1.451 -0.366 1 N-CA-C 102.924 -4.07 . . . . 0.0 102.924 176.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -60.26 -56.69 18.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.099 2.949 . . . . 0.0 111.353 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -62.93 -39.9 95.98 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -61.99 -52.38 64.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.019 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.5 -51.39 59.73 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 120.206 1.366 . . . . 0.0 111.819 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -58.36 -53.49 57.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.671 0.668 . . . . 0.0 111.03 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.2 mt -61.3 -54.11 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 O-C-N 121.438 -0.789 . . . . 0.0 110.731 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 82.8 mt -54.97 -41.7 71.49 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.384 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 14.2 mtp -57.2 -51.26 70.05 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 120.928 1.695 . . . . 0.0 108.848 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.33 -52.33 66.1 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 122.611 0.365 . . . . 0.0 110.291 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 43.2 mt -58.6 -42.89 89.17 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 122.775 0.43 . . . . 0.0 111.12 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . 0.538 ' HD2' HG11 ' D' 1103 ' ' VAL . 25.5 ttpt -62.5 -57.43 11.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.6 1.16 . . . . 0.0 110.889 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -60.45 -41.17 93.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 118.649 0.658 . . . . 0.0 110.016 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 2.9 t -61.02 -42.24 98.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.986 -0.446 . . . . 0.0 109.874 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.26 -35.92 71.57 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 117.351 -1.309 . . . . 0.0 109.92 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -63.52 -40.01 95.91 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.252 1.387 . . . . 0.0 108.931 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 36.3 mt -66.89 -53.35 33.07 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 5.7 tpt -56.89 -34.66 68.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.041 0.936 . . . . 0.0 110.355 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.43 -41.73 84.32 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.485 1.514 . . . . 0.0 110.857 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.45 -33.03 64.68 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.529 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 20.3 m -86.79 148.7 46.52 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-N 119.521 1.055 . . . . 0.0 111.831 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -75.94 -106.1 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.05 2.5 . . . . 0.0 106.875 178.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.73 74.44 7.12 Favored Pre-proline 0 CA--C 1.542 0.638 0 O-C-N 119.71 -1.869 . . . . 0.0 111.431 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -81.12 -100.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 124.725 3.617 . . . . 0.0 111.539 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . 0.494 HD22 HD22 ' A' ' 32' ' ' LEU . 9.7 tt -56.11 -34.71 66.3 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 120.724 -1.235 . . . . 0.0 109.499 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 73.5 t -51.83 -54.44 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 126.114 1.765 . . . . 0.0 109.698 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.09 -49.52 77.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.036 0.934 . . . . 0.0 110.007 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 25.9 t -56.03 -50.54 70.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.363 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -67.01 -35.01 78.97 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.541 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -58.08 -48.53 79.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.643 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.75 -42.6 70.27 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.078 0.854 . . . . 0.0 111.763 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -57.17 -45.42 83.69 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 118.64 0.655 . . . . 0.0 111.233 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -77.32 -31.72 54.8 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.092 0.957 . . . . 0.0 110.773 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -57.72 -37.78 74.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 119.792 1.178 . . . . 0.0 109.188 178.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.8 -18.21 53.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.737 0.815 . . . . 0.0 112.237 179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 19.9 tp . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 124.461 1.104 . . . . 0.0 111.141 179.074 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 26.9 tp -78.22 108.29 11.43 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.99 165.04 11.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.288 0.949 . . . . 0.0 111.456 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -142.58 156.67 45.12 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.455 1.502 . . . . 0.0 108.17 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -135.0 105.79 10.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.393 -179.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -79.58 116.5 3.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.437 2.758 . . . . 0.0 110.941 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.8 t -145.03 147.13 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.593 1.088 . . . . 0.0 111.039 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -133.97 101.61 5.12 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.5 126.97 1.49 Allowed Glycine 0 CA--C 1.519 0.315 0 N-CA-C 105.447 -3.061 . . . . 0.0 105.447 177.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -65.68 -51.57 58.4 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 121.54 2.67 . . . . 0.0 108.791 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.22 -42.82 83.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.338 0.655 . . . . 0.0 109.758 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 8.0 m -55.78 -47.71 76.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.213 1.405 . . . . 0.0 108.785 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.0 t80 -69.32 -50.48 46.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.515 1.126 . . . . 0.0 111.068 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.68 -51.0 66.88 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.952 1.301 . . . . 0.0 112.761 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.4 ttm -65.6 -51.3 60.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.804 0.442 . . . . 0.0 110.147 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -41.54 95.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.253 -178.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.79 -38.25 79.84 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.502 1.501 . . . . 0.0 108.85 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -59.38 -42.14 90.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.164 0.893 . . . . 0.0 108.735 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . 0.478 HG23 HD22 ' D' 1115 ' ' LEU . 94.1 mt -72.66 -38.28 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.797 0.839 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -61.45 -54.43 43.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 O-C-N 121.071 -1.018 . . . . 0.0 109.492 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -53.08 60.86 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.132 1.373 . . . . 0.0 111.058 -178.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 35.7 p -55.24 -51.56 66.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.99 -41.58 82.06 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 118.774 -0.632 . . . . 0.0 112.439 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.33 -44.93 95.36 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.59 -48.86 65.62 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.665 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 7.7 tmm? -55.36 -44.64 76.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.587 0.63 . . . . 0.0 109.977 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -79.9 -19.9 47.1 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 118.122 -0.942 . . . . 0.0 113.43 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 72.1 t80 -86.3 -27.73 24.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.437 1.017 . . . . 0.0 110.169 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 25.3 tp . . . . . 0 CA--C 1.541 0.614 0 C-N-CA 125.548 1.539 . . . . 0.0 110.177 179.541 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 71.2 t60 . . . . . 0 C--O 1.224 -0.242 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -45.19 83.73 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.113 -0.992 . . . . 0.0 111.686 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 9.4 mm -64.13 -34.45 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 124.908 1.283 . . . . 0.0 110.037 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -69.77 -56.69 6.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 14.0 m -54.01 -40.87 67.38 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.571 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 3.7 t80 -60.25 -54.41 46.11 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.69 1.586 . . . . 0.0 109.819 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -34.72 78.03 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.518 0.727 . . . . 0.0 111.908 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -72.29 -46.64 54.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.811 1.244 . . . . 0.0 109.841 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -60.01 -42.12 93.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.336 1.054 . . . . 0.0 110.937 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -67.31 -47.59 70.12 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.136 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -57.74 -40.83 80.6 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.124 0.57 . . . . 0.0 110.493 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 . . . . . 0 C--O 1.225 -0.185 0 C-N-CA 124.036 0.934 . . . . 0.0 111.623 179.568 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.38 0 CA-C-O 120.785 0.326 . . . . 0.0 110.914 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -101.58 128.45 47.83 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.903 -2.629 . . . . 0.0 103.903 178.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -103.59 145.04 30.63 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.984 1.314 . . . . 0.0 108.874 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.6 mp -140.1 151.39 45.31 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -139.95 111.1 6.99 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.712 1.605 . . . . 0.0 108.861 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . 0.538 HG11 ' HD2' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -155.82 150.86 10.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 124.485 1.114 . . . . 0.0 111.805 179.394 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -124.53 99.73 6.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 122.093 0.949 . . . . 0.0 108.501 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.43 119.76 1.4 Allowed Glycine 0 CA--C 1.509 -0.318 0 N-CA-C 105.932 -2.867 . . . . 0.0 105.932 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -63.52 -56.91 12.29 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 121.533 2.666 . . . . 0.0 108.426 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -69.36 -38.29 78.0 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.155 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.63 -52.57 65.1 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.709 -178.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.39 -41.86 98.97 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.149 -0.969 . . . . 0.0 111.832 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -60.66 -53.94 51.33 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.507 0.723 . . . . 0.0 111.555 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 55.1 mt -70.32 -45.92 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 118.459 -0.782 . . . . 0.0 109.679 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.66 -44.71 81.62 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 119.576 1.08 . . . . 0.0 110.363 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 27.1 mtp -60.53 -45.98 91.83 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.008 1.276 . . . . 0.0 109.736 178.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -56.63 -49.63 74.41 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . 0.478 HD22 HG23 ' C' 1022 ' ' ILE . 34.1 mt -60.17 -48.46 81.63 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.58 0.752 . . . . 0.0 111.243 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . 0.584 ' HD2' HG21 ' B' ' 103' ' ' VAL . 24.3 ttpt -54.62 -59.62 4.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 110.653 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.54 -47.97 75.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.008 0.923 . . . . 0.0 110.07 -179.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 34.4 t -53.35 -53.22 54.21 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.005 0.922 . . . . 0.0 111.119 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.82 -30.94 66.02 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 117.614 -1.184 . . . . 0.0 111.89 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -62.41 -41.65 98.84 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.969 1.713 . . . . 0.0 108.384 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 35.8 mt -67.95 -47.04 69.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.6 tpt -57.01 -35.84 69.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.377 0.671 . . . . 0.0 111.639 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.23 -43.08 74.77 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.872 1.669 . . . . 0.0 110.438 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.33 -25.32 60.58 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 33.5 m -92.65 148.85 36.97 Favored Pre-proline 0 CA--C 1.537 0.474 0 CA-C-N 119.226 0.921 . . . . 0.0 108.992 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -74.13 -105.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.059 2.506 . . . . 0.0 108.041 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -151.07 66.04 7.05 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 120.239 -1.538 . . . . 0.0 106.946 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.22 -103.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.427 2.751 . . . . 0.0 113.064 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.3 tt -62.52 -25.73 68.18 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.96 -1.088 . . . . 0.0 109.438 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 45.8 t -53.86 -56.96 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 C-N-CA 125.69 1.596 . . . . 0.0 109.192 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.22 -39.12 86.23 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.08 0.237 . . . . 0.0 111.08 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 1.9 t -60.12 -50.9 71.87 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.609 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.23 -33.09 74.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.097 0.959 . . . . 0.0 109.345 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -48.5 80.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 117.089 -1.434 . . . . 0.0 110.009 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -72.13 -46.42 56.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 120.052 1.296 . . . . 0.0 110.918 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -46.54 64.72 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.497 0.719 . . . . 0.0 110.324 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . 0.295 1.7 tp60 -81.08 -26.03 36.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -59.46 -36.2 75.51 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 120.403 1.456 . . . . 0.0 107.183 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 31.0 mt -61.97 -18.08 59.17 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.103 0.961 . . . . 0.0 112.243 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 8.3 tp . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 125.239 1.415 . . . . 0.0 111.635 179.625 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 . . . . . 0 C--O 1.233 0.2 0 N-CA-C 111.233 0.086 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -84.74 121.52 27.8 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 45.2 mt -108.15 161.94 14.52 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -140.5 104.89 4.85 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tp -87.87 110.22 33.42 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.362 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -87.04 123.26 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.424 3.416 . . . . 0.0 112.045 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 t -146.1 154.81 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 O-C-N 120.546 -1.346 . . . . 0.0 107.682 178.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 -135.08 100.67 4.63 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 134.72 3.37 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 106.674 -2.571 . . . . 0.0 106.674 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -69.87 -52.76 22.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 121.397 2.599 . . . . 0.0 110.595 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -66.43 -42.94 86.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.598 0.759 . . . . 0.0 110.004 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 62.8 m -65.32 -34.04 77.39 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.213 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -73.07 -48.35 36.67 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.96 1.709 . . . . 0.0 108.774 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -53.43 -56.08 19.78 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 123.936 0.894 . . . . 0.0 110.553 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 20.9 ptm -60.85 -42.68 98.28 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.127 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.07 -47.01 81.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 119.989 1.268 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -55.84 19.81 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.538 0.608 . . . . 0.0 110.278 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.68 -47.7 79.27 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 125.614 1.566 . . . . 0.0 112.828 -178.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.42 -36.18 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.333 0.653 . . . . 0.0 109.89 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.7 -48.89 65.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.17 -1.581 . . . . 0.0 108.197 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -55.22 -52.03 64.68 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.426 1.49 . . . . 0.0 110.327 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.2 p -56.72 -41.53 77.63 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.7 0.682 . . . . 0.0 111.572 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.1 -48.72 61.82 Favored 'General case' 0 CA--C 1.521 -0.163 0 O-C-N 121.412 -0.805 . . . . 0.0 111.432 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.39 -53.98 51.08 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 126.762 2.025 . . . . 0.0 111.928 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.53 -38.72 90.47 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 117.303 -1.332 . . . . 0.0 110.184 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 10.8 tmm? -63.44 -45.17 92.13 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.034 1.288 . . . . 0.0 107.792 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.89 -22.41 66.99 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.59 0.632 . . . . 0.0 110.508 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.82 -25.7 22.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.478 -1.389 . . . . 0.0 111.132 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 mt . . . . . 0 C--O 1.236 0.351 0 C-N-CA 126.926 2.09 . . . . 0.0 107.722 -179.24 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.43 -48.46 77.67 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.815 -0.553 . . . . 0.0 111.768 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.2 mm -62.52 -34.43 64.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.732 0.813 . . . . 0.0 111.203 -179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -61.72 -56.73 16.56 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.583 1.553 . . . . 0.0 108.472 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.7 m -61.35 -42.26 98.39 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' B' ' 121' ' ' LEU . 2.4 t80 -56.69 -53.42 57.94 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.438 0.695 . . . . 0.0 111.982 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -65.17 -39.62 93.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 118.762 -0.637 . . . . 0.0 110.821 -178.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.26 -49.26 78.33 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.34 -48.79 79.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.2 1.8 . . . . 0.0 110.559 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.16 -46.06 79.42 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 123.898 0.879 . . . . 0.0 110.148 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 tt0 -69.18 -42.64 75.58 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.021 1.328 . . . . 0.0 111.114 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 . . . . . 0 N--CA 1.465 0.316 0 C-N-CA 125.69 1.596 . . . . 0.0 108.864 179.523 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -109.45 143.79 38.57 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -117.48 161.64 19.25 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.175 1.39 . . . . 0.0 110.23 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' B' ' 101' ' ' LEU . 12.0 tp -161.22 117.32 2.18 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.16 103.17 9.29 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.214 1.406 . . . . 0.0 109.367 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.485 HG11 ' HE2' ' D' 1116 ' ' LYS . 93.4 t -150.03 150.62 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.29 1.036 . . . . 0.0 110.318 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -108.44 102.67 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.806 1.242 . . . . 0.0 108.673 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.5 122.16 1.72 Allowed Glycine 0 N--CA 1.467 0.723 0 CA-C-O 115.802 -2.665 . . . . 0.0 109.067 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -68.03 -59.62 3.12 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 122.504 3.152 . . . . 0.0 113.387 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -73.24 -43.86 60.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -51.39 -51.0 58.52 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.799 1.639 . . . . 0.0 110.471 -178.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -72.11 -39.77 68.63 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.764 1.165 . . . . 0.0 111.411 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.53 -53.48 50.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.871 0.843 . . . . 0.0 109.544 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.488 HG21 HD11 ' C' 1022 ' ' ILE . 12.5 mt -61.6 -48.27 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.752 1.621 . . . . 0.0 109.427 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -57.49 -41.04 79.94 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 117.983 -1.008 . . . . 0.0 111.311 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 20.2 mtp -66.25 -44.73 82.86 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.357 1.435 . . . . 0.0 110.179 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -55.63 -45.98 77.5 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 73.3 mt -72.59 -27.39 62.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.032 1.333 . . . . 0.0 112.84 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 116' ' ' LYS . . . . . 0.417 ' HE2' HG11 ' D' 1103 ' ' VAL . 0.0 OUTLIER -64.13 -60.68 2.92 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.46 1.104 . . . . 0.0 109.032 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -63.09 -38.14 90.01 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 124.403 1.065 . . . . 0.0 108.755 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 41.9 t -52.78 -54.25 36.64 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.922 0.783 . . . . 0.0 112.219 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.15 -33.09 72.88 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.036 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.7 -43.08 97.68 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.02 1.282 . . . . 0.0 109.601 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 40' ' ' TYR . 80.8 mt -65.26 -50.22 66.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.742 1.217 . . . . 0.0 109.566 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 10.4 tpt -62.77 -29.94 71.08 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.668 0.387 . . . . 0.0 110.936 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -76.13 -41.7 49.21 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.637 0.775 . . . . 0.0 110.714 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 pp -78.12 -33.47 50.53 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -86.74 146.63 41.66 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 119.298 0.954 . . . . 0.0 109.208 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.31 -172.74 0.37 Allowed 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.2 2.6 . . . . 0.0 109.575 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -107.64 62.51 0.22 Allowed Pre-proline 0 CA--C 1.548 0.876 0 O-C-N 120.288 -1.507 . . . . 0.0 113.519 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.37 -87.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.757 2.304 . . . . 0.0 112.792 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.3 -39.48 83.14 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 121.486 -0.759 . . . . 0.0 110.239 -178.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 m -56.05 -48.02 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 117.051 -1.452 . . . . 0.0 111.716 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -75.39 -32.22 60.71 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 120.869 1.668 . . . . 0.0 111.795 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 t -65.41 -46.89 78.21 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -69.35 -39.39 78.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.168 0.987 . . . . 0.0 109.459 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.02 -48.68 77.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 119.24 0.927 . . . . 0.0 110.122 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -68.85 -46.53 68.26 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -57.89 -44.17 86.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.393 0.542 . . . . 0.0 111.404 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -72.99 -33.61 65.91 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.864 1.666 . . . . 0.0 110.626 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -61.8 -37.24 83.65 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 119.524 1.056 . . . . 0.0 110.08 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.79 -24.21 63.92 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.675 0.39 . . . . 0.0 110.474 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 11.8 tp . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.623 1.169 . . . . 0.0 110.959 179.316 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 16.3 tp10 . . . . . 0 N--CA 1.452 -0.372 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 58.1 tp -73.39 112.84 9.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 177.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.3 mt -107.43 162.18 14.16 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.067 1.347 . . . . 0.0 108.783 -179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -137.71 144.35 41.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.202 1.001 . . . . 0.0 108.544 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 13.8 tp -118.57 96.25 49.73 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.79 115.27 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 123.298 2.665 . . . . 0.0 109.452 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.7 t -143.51 153.14 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 123.677 0.791 . . . . 0.0 110.462 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 41.5 ttt-85 -132.93 101.79 5.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 103.92 -2.622 . . . . 0.0 103.92 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.66 121.94 1.0 Allowed Glycine 0 CA--C 1.516 0.155 0 N-CA-C 105.479 -3.048 . . . . 0.0 105.479 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -66.43 -52.32 47.71 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 121.913 2.856 . . . . 0.0 109.801 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.37 -47.76 75.29 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -55.26 -41.47 72.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.343 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 29.8 t80 -73.9 -50.0 22.22 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.799 1.181 . . . . 0.0 111.095 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -54.47 -50.71 67.1 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.87 0.759 . . . . 0.0 110.707 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1018 ' ' MET . . . . . . . . . . . . . 25.7 ptm -65.52 -43.06 91.22 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.433 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.66 -42.08 99.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 120.014 1.279 . . . . 0.0 109.804 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.48 -56.46 21.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -56.74 -48.8 76.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.247 0.619 . . . . 0.0 112.5 -178.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1022 ' ' ILE . . . . . 0.488 HD11 HG21 ' B' ' 111' ' ' ILE . 97.9 mt -67.36 -36.32 76.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.362 1.065 . . . . 0.0 112.143 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -48.8 46.33 Favored 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 120.44 -1.412 . . . . 0.0 108.267 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.14 -41.94 97.65 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.727 0.811 . . . . 0.0 109.298 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1025 ' ' SER . . . . . . . . . . . . . 95.4 p -59.97 -46.38 89.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.495 1.043 . . . . 0.0 110.818 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 8.1 tt -67.89 -51.07 52.29 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.745 0.818 . . . . 0.0 111.647 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -59.91 -53.73 54.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 124.009 0.924 . . . . 0.0 111.513 -178.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.72 -31.65 72.77 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 119.112 0.869 . . . . 0.0 111.581 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -69.01 -45.57 70.19 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 178.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -65.34 -29.85 70.63 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.611 -0.68 . . . . 0.0 110.222 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.9 t80 -80.28 -31.87 38.24 Favored 'General case' 0 C--N 1.339 0.116 0 C-N-CA 124.193 0.997 . . . . 0.0 111.267 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1032 ' ' LEU . . . . . 0.554 HD11 HD22 ' D' 1129 ' ' LEU . 15.6 mt . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.999 1.32 . . . . 0.0 110.812 -178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 77.8 m80 . . . . . 0 CA--C 1.534 0.35 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.87 -51.6 66.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.882 0.765 . . . . 0.0 111.573 -178.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.48 -37.75 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 124.254 1.021 . . . . 0.0 112.35 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -69.21 -53.84 17.86 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.285 0.948 . . . . 0.0 109.076 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.2 m -52.61 -43.69 65.53 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.447 0.567 . . . . 0.0 110.425 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1040 ' ' TYR . . . . . 0.406 ' CD2' HD21 ' D' 1121 ' ' LEU . 3.5 t80 -61.68 -54.27 44.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.306 1.442 . . . . 0.0 111.049 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -62.74 -33.46 75.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.959 0.345 . . . . 0.0 110.487 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -65.3 -44.93 86.35 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -59.14 -48.72 80.59 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 119.78 1.173 . . . . 0.0 109.535 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -53.81 -51.61 62.98 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.386 0.674 . . . . 0.0 111.16 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.84 -41.64 82.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.061 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 15.0 mm100 . . . . . 0 N--CA 1.462 0.137 0 CA-C-N 119.1 0.864 . . . . 0.0 109.307 179.182 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' D' D 1098 ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -102.64 145.42 29.68 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.918 -1.114 . . . . 0.0 108.894 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -124.58 143.64 50.59 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 125.274 1.43 . . . . 0.0 107.324 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 9.4 tp -144.9 142.26 29.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 118.327 -0.844 . . . . 0.0 108.928 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -139.51 107.97 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.031 1.332 . . . . 0.0 109.138 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1103 ' ' VAL . . . . . 0.417 HG11 ' HE2' ' B' ' 116' ' ' LYS . 82.7 t -149.81 147.12 16.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 119.001 0.818 . . . . 0.0 109.095 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -102.19 103.61 14.14 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.775 0.83 . . . . 0.0 111.598 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.82 117.34 1.06 Allowed Glycine 0 N--CA 1.464 0.52 0 CA-C-O 115.994 -2.559 . . . . 0.0 108.125 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -67.48 -57.07 7.19 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 122.827 3.314 . . . . 0.0 111.452 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 30.7 mttp -68.44 -44.8 74.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -51.76 -50.88 59.8 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.025 1.33 . . . . 0.0 110.265 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.68 -45.91 77.36 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.88 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -58.42 -48.37 80.91 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.881 1.219 . . . . 0.0 109.931 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 65.7 mt -56.34 -53.95 33.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 C-N-CA 124.858 1.263 . . . . 0.0 108.658 179.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.85 -39.44 81.32 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.927 -179.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.6 mtp -65.21 -49.54 69.31 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 120.607 1.548 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -53.8 -46.6 71.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.88 0.848 . . . . 0.0 109.433 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.8 -27.2 61.01 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.404 0.682 . . . . 0.0 112.215 -179.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1116 ' ' LYS . . . . . 0.485 ' HE2' HG11 ' B' ' 103' ' ' VAL . 0.1 OUTLIER -63.04 -60.01 4.03 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.555 1.07 . . . . 0.0 109.696 -179.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.12 -42.74 99.08 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1118 ' ' SER . . . . . . . . . . . . . 31.1 t -52.76 -52.36 56.88 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.69 0.677 . . . . 0.0 112.55 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.21 -35.46 76.23 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.665 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -64.37 -48.39 75.65 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.013 1.279 . . . . 0.0 109.183 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1121 ' ' LEU . . . . . 0.406 HD21 ' CD2' ' C' 1040 ' ' TYR . 59.3 mt -58.16 -52.34 65.95 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.078 1.351 . . . . 0.0 111.548 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.9 tpt -64.16 -26.34 68.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.146 0.979 . . . . 0.0 111.392 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.86 -40.47 28.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.179 0.9 . . . . 0.0 109.85 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1124 ' ' LEU . . . . . . . . . . . . 0.32 2.0 pp -73.71 -32.42 63.89 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.2 t -94.31 148.39 34.97 Favored Pre-proline 0 CA--C 1.537 0.455 0 CA-C-N 119.068 0.849 . . . . 0.0 108.81 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.17 -164.21 0.09 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 123.715 2.944 . . . . 0.0 110.747 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -116.14 66.2 3.0 Favored Pre-proline 0 CA--C 1.547 0.851 0 O-C-N 120.183 -1.573 . . . . 0.0 113.737 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -79.96 -85.62 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 121.813 1.675 . . . . 0.0 112.662 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1129 ' ' LEU . . . . . 0.554 HD22 HD11 ' C' 1032 ' ' LEU . 7.9 tt -64.86 -38.12 89.93 Favored 'General case' 0 C--N 1.347 0.497 0 O-C-N 121.095 -1.003 . . . . 0.0 109.721 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 m -54.71 -36.06 35.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.542 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.39 -41.95 38.22 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 119.06 0.845 . . . . 0.0 109.433 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.95 -47.64 82.33 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.08 -51.38 68.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.985 0.914 . . . . 0.0 108.561 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -43.55 67.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 123.651 0.78 . . . . 0.0 110.447 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -62.84 -54.06 44.69 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 118.493 0.588 . . . . 0.0 110.031 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 10.0 tp60 -59.63 -37.28 78.2 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -40.82 43.94 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.082 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -58.91 -39.49 81.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.344 1.429 . . . . 0.0 107.397 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.03 -15.23 55.77 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.187 -0.946 . . . . 0.0 112.75 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 15.5 tp . . . . . 0 CA--C 1.538 0.49 0 C-N-CA 125.094 1.358 . . . . 0.0 110.855 179.171 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -67.05 -55.64 13.48 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 178.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -72.54 24.9 0.05 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.999 2.12 . . . . 0.0 114.257 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -55.16 106.51 0.23 Allowed 'General case' 0 C--O 1.233 0.211 0 C-N-CA 126.006 1.722 . . . . 0.0 109.5 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.5 tp -74.02 94.32 2.36 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.3 mt -93.03 167.45 11.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -134.0 159.58 40.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.44 90.29 49.04 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -71.28 108.27 2.32 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 125.249 3.966 . . . . 0.0 108.645 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.0 t -138.5 148.64 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 124.338 1.055 . . . . 0.0 110.516 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.2 102.06 4.88 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 175.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.46 124.49 1.25 Allowed Glycine 0 CA--C 1.522 0.472 0 N-CA-C 104.955 -3.258 . . . . 0.0 104.955 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -52.19 26.84 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 120.34 2.07 . . . . 0.0 111.476 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.84 -42.17 95.14 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -56.9 -47.79 79.7 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.24 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.93 -53.99 51.74 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.835 0.743 . . . . 0.0 111.211 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -55.33 -47.59 75.45 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -69.68 -44.16 71.02 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 118.237 0.472 . . . . 0.0 112.267 -179.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.88 -44.11 94.04 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.22 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -50.36 63.27 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-N 118.947 0.794 . . . . 0.0 109.757 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.59 -50.1 73.95 Favored 'General case' 0 C--O 1.225 -0.202 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.83 -32.25 57.35 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 CA-C-N 119.672 1.124 . . . . 0.0 110.155 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.561 ' HE2' HG11 ' C' 1010 ' ' VAL . 19.3 tptp -66.59 -46.55 75.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.69 -54.24 34.73 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.786 1.234 . . . . 0.0 110.924 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 m -53.61 -44.72 69.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 119.941 1.246 . . . . 0.0 112.086 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.53 -50.95 48.18 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.616 0.644 . . . . 0.0 110.017 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -54.42 -47.88 72.27 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.386 1.074 . . . . 0.0 110.817 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -64.62 -43.77 92.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.907 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 54.2 ttp -55.61 -48.19 75.3 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.115 0.87 . . . . 0.0 109.676 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -76.54 -14.39 60.02 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -86.33 -54.26 4.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 119.631 1.105 . . . . 0.0 109.79 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 pp -65.85 151.34 95.21 Favored Pre-proline 0 CA--C 1.534 0.35 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.98 111.97 2.81 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.478 2.119 . . . . 0.0 107.036 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -66.61 37.76 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.494 2.317 . . . . 0.0 114.054 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -53.51 -57.82 9.34 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.361 -1.462 . . . . 0.0 111.837 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.0 m -59.79 -47.52 85.35 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 123.417 0.687 . . . . 0.0 111.006 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.408 HG13 ' H ' ' A' ' 37' ' ' ILE . 8.3 mt -60.3 -44.55 95.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 126.395 1.878 . . . . 0.0 111.933 -177.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.07 -58.72 7.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.5 m -55.83 -41.01 73.59 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.622 0.769 . . . . 0.0 111.162 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -65.34 -53.93 36.43 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.986 0.914 . . . . 0.0 110.993 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -61.73 -41.58 97.82 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.582 -0.699 . . . . 0.0 110.502 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.94 -54.24 33.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.014 0.926 . . . . 0.0 109.415 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -58.5 -44.39 89.42 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 119.649 1.113 . . . . 0.0 110.707 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -58.03 -36.39 72.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.441 1.019 . . . . 0.0 109.662 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.27 -53.73 33.35 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -57.64 -35.72 70.88 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.815 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -60.43 -33.33 72.38 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-O 118.436 -0.793 . . . . 0.0 111.069 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -44.03 78.48 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.306 0.957 . . . . 0.0 111.238 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -70.13 -26.3 63.88 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.648 0.779 . . . . 0.0 112.364 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -88.24 -21.56 24.44 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.611 0.765 . . . . 0.0 110.937 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -16.6 15.37 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.648 1.979 . . . . 0.0 112.902 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.7 mp -64.69 -24.31 67.53 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 95.09 106.47 0.02 OUTLIER 'General case' 0 C--N 1.342 0.273 1 C-N-CA 132.052 4.141 . . . . 0.0 108.08 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -143.29 -13.03 0.71 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -90.84 155.97 18.37 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 120.088 1.313 . . . . 0.0 109.09 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 12.5 t -71.01 -38.46 72.64 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 122.735 0.414 . . . . 0.0 110.285 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.7 m -146.87 139.03 24.67 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.414 1.086 . . . . 0.0 109.172 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.9 mt -141.66 146.97 22.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 126.813 2.045 . . . . 0.0 105.576 178.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -146.71 158.57 43.94 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.95 1.3 . . . . 0.0 109.016 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.254 1.313 0 C-N-CA 125.041 1.336 . . . . 0.0 108.649 179.589 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.89 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 17.4 m 145.45 -166.25 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.644 1 C-N-CA 133.493 4.717 . . . . 0.0 105.992 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -66.05 -163.23 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 127.439 2.295 . . . . 0.0 111.406 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -109.22 -0.26 19.32 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.291 1.837 . . . . 0.0 110.091 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -95.17 157.18 16.0 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.962 1.305 . . . . 0.0 111.801 -179.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 56.4 m -141.65 148.72 39.61 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.912 1.685 . . . . 0.0 107.609 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -101.62 138.52 38.5 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 178.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -117.22 145.63 43.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.428 1.491 . . . . 0.0 109.577 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.3 mt -136.06 128.83 30.97 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 125.027 1.331 . . . . 0.0 107.469 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -129.46 100.52 5.58 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.22 149.87 11.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 124.065 0.946 . . . . 0.0 108.797 -179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -114.11 102.36 10.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.4 0.68 . . . . 0.0 110.739 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.57 113.76 0.75 Allowed Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 116.396 -2.335 . . . . 0.0 108.72 177.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -60.59 -56.42 21.55 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.669 2.735 . . . . 0.0 110.501 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -63.06 -52.03 64.36 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -51.96 -49.62 62.85 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.825 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -63.24 -44.84 94.09 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 120.623 1.556 . . . . 0.0 111.596 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -57.06 -50.69 71.98 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.346 0.976 . . . . 0.0 110.4 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.472 HG21 HD11 ' C' 1022 ' ' ILE . 81.2 mt -62.01 -58.27 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 127.058 2.143 . . . . 0.0 110.609 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.61 -36.79 77.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 116.647 -1.644 . . . . 0.0 110.043 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 64.0 mtp -63.08 -52.88 60.97 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 121.423 1.919 . . . . 0.0 110.316 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.45 -43.21 97.1 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.513 0.597 . . . . 0.0 111.827 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 74.6 mt -69.66 -34.49 74.07 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.67 0.668 . . . . 0.0 110.815 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . 0.42 ' HB2' HD21 ' D' 1112 ' ' LEU . 0.2 OUTLIER -66.24 -54.16 28.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.684 0.794 . . . . 0.0 109.78 180.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -60.93 -41.94 97.21 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.011 1.325 . . . . 0.0 108.818 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.6 t -52.78 -52.97 54.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.827 0.851 . . . . 0.0 110.992 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -68.2 -38.64 82.17 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.83 -0.605 . . . . 0.0 110.92 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -46.09 88.37 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.577 1.081 . . . . 0.0 109.071 178.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' B' ' 121' ' ' LEU . 3.7 mm? -67.45 -45.07 77.08 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 117.151 -1.404 . . . . 0.0 108.01 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 6.3 tpt -53.89 -33.35 56.27 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 120.101 1.319 . . . . 0.0 110.383 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.47 -31.92 48.08 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.847 0.859 . . . . 0.0 111.107 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 51.1 tp -87.88 -33.43 18.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 4.1 m -93.46 148.08 34.85 Favored Pre-proline 0 C--O 1.235 0.313 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.59 175.41 9.56 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 120.981 1.121 . . . . 0.0 110.071 -179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.36 33.47 0.05 OUTLIER Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 117.538 2.422 . . . . 0.0 117.538 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.26 -57.23 0.79 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 123.07 2.132 . . . . 0.0 112.551 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -28.89 69.9 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.974 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 9.9 t -63.25 -56.54 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.109 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.218 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.46 -35.68 77.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.329 0.585 . . . . 0.0 111.157 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 9.6 t -61.71 -50.26 73.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.585 0.754 . . . . 0.0 109.247 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -70.79 -40.41 72.58 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.896 -0.502 . . . . 0.0 109.759 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -52.89 -48.22 67.34 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.145 1.378 . . . . 0.0 111.448 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -77.7 -46.18 22.62 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 123.362 0.665 . . . . 0.0 112.09 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -55.59 -39.03 70.19 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.8 tm0? -80.55 -29.61 37.12 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 125.306 1.443 . . . . 0.0 109.048 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.28 -30.06 64.38 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.546 1.521 . . . . 0.0 108.035 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 14.3 mt -59.38 -13.66 9.2 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 118.917 0.78 . . . . 0.0 112.797 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.39 -21.03 27.39 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.218 1.807 . . . . 0.0 108.94 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -89.12 157.49 18.28 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 . . . . . 0 C--O 1.249 1.069 0 C-N-CA 124.084 0.954 . . . . 0.0 109.746 -179.507 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 11.6 t70 -66.93 -30.0 70.02 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.709 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -95.0 27.98 2.95 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.322 2.249 . . . . 0.0 112.973 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.52 119.18 7.55 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 121.804 -0.56 . . . . 0.0 109.672 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 61.5 tp -77.17 95.29 4.24 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 105.924 -1.88 . . . . 0.0 105.924 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 16.7 mt -96.48 127.41 42.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.723 2.009 . . . . 0.0 108.874 -178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -106.2 122.61 46.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 123.591 0.756 . . . . 0.0 109.465 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.3 mt -95.72 100.24 5.99 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 117.552 -1.213 . . . . 0.0 108.842 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -75.33 121.94 6.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.809 2.34 . . . . 0.0 110.252 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . 0.561 HG11 ' HE2' ' A' ' 23' ' ' LYS . 4.8 t -145.63 152.37 14.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 O-C-N 120.951 -1.093 . . . . 0.0 110.716 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.18 102.02 4.87 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 176.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.22 130.49 2.13 Favored Glycine 0 CA--C 1.52 0.365 0 CA-C-O 116.311 -2.383 . . . . 0.0 107.646 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -52.53 22.77 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.655 2.727 . . . . 0.0 111.911 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -72.54 -31.14 65.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.54 -41.55 98.45 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.822 0.849 . . . . 0.0 110.203 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 11.1 t80 -69.61 -52.04 29.57 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.057 0.844 . . . . 0.0 108.947 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -54.3 -57.42 11.29 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.81 -45.87 91.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.03 0.532 . . . . 0.0 111.999 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.5 mm? -67.29 -38.2 84.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.962 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.24 -49.03 47.52 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 119.988 1.267 . . . . 0.0 111.079 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.21 -46.97 75.93 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.407 1.003 . . . . 0.0 110.959 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . 0.472 HD11 HG21 ' B' ' 111' ' ' ILE . 84.5 mt -68.69 -45.39 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.2 tptp -58.02 -45.84 86.25 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 124.537 1.135 . . . . 0.0 110.615 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -67.36 -50.98 57.55 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.434 1.094 . . . . 0.0 108.894 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 30.2 m -53.96 -42.6 69.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.368 0.985 . . . . 0.0 111.134 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -68.89 -52.13 32.82 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.452 1.101 . . . . 0.0 109.894 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -58.55 -43.55 89.36 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 122.956 0.502 . . . . 0.0 110.886 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.09 -40.02 86.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.762 -1.113 . . . . 0.0 109.516 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . 0.432 ' HA ' HE21 ' C' 1034 ' ' GLN . 49.0 ttp -63.13 -35.73 81.26 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.005 0.821 . . . . 0.0 110.163 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -87.6 -12.87 44.37 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.28 0.945 . . . . 0.0 112.496 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 7.2 t80 -98.58 -57.85 2.1 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.859 1.264 . . . . 0.0 113.029 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.73 156.26 91.38 Favored Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 123.727 0.811 . . . . 0.0 111.933 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.21 78.89 1.82 Allowed 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 124.139 3.226 . . . . 0.0 110.805 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . 0.432 HE21 ' HA ' ' C' 1029 ' ' MET . 22.7 mm-40 -75.27 65.01 1.55 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.466 1.106 . . . . 0.0 113.103 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.0 t60 -67.86 -40.09 83.67 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.246 -0.909 . . . . 0.0 110.241 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 44.4 m -59.14 -43.51 92.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.044 -0.979 . . . . 0.0 108.463 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 42.4 mt -61.54 -45.41 98.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 119.791 1.178 . . . . 0.0 109.334 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -56.26 -55.37 34.09 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.806 0.842 . . . . 0.0 110.266 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 41.2 m -65.24 -34.85 79.35 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.819 -0.55 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.68 -52.61 56.32 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.473 1.109 . . . . 0.0 109.929 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -55.65 -47.33 76.83 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -59.32 -57.15 14.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.915 0.886 . . . . 0.0 109.966 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -50.2 -50.47 49.39 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.722 0.809 . . . . 0.0 111.349 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -63.13 -40.7 98.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.612 0.642 . . . . 0.0 110.97 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -62.89 -43.95 97.42 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.545 0.738 . . . . 0.0 109.455 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -67.41 -46.79 72.17 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.62 -0.705 . . . . 0.0 110.135 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -52.88 -45.72 67.62 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 124.137 0.975 . . . . 0.0 111.874 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 17.4 t60 -53.79 -37.56 63.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.667 0.667 . . . . 0.0 112.527 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -70.74 -31.85 68.83 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.025 0.93 . . . . 0.0 111.595 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 31.3 m170 -88.34 -8.88 54.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.837 1.255 . . . . 0.0 112.18 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.48 -11.63 3.12 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.746 2.019 . . . . 0.0 112.818 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 1.9 tp -71.9 16.57 0.11 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.928 2.091 . . . . 0.0 111.554 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 51.89 71.63 0.44 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 129.373 3.069 . . . . 0.0 112.438 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -113.61 3.06 15.5 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.329 1.052 . . . . 0.0 113.661 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -87.88 166.19 14.73 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 119.247 0.93 . . . . 0.0 109.816 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 14.8 t -75.48 -50.26 16.27 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 106.568 -1.642 . . . . 0.0 106.568 178.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 50.8 m -139.31 151.09 46.14 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 126.208 1.803 . . . . 0.0 107.77 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 65.4 mt -136.73 137.33 47.5 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -146.93 158.55 43.95 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.196 0.999 . . . . 0.0 109.846 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.256 1.397 0 C-N-CA 126.917 2.087 . . . . 0.0 106.86 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.73 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 17.6 t -162.79 -169.01 1.94 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.422 2.689 . . . . 0.0 105.929 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -61.15 162.17 7.73 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -83.11 -9.84 59.0 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.793 -1.192 . . . . 0.0 112.66 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 24.4 t0 -80.15 169.93 17.14 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.602 -1.311 . . . . 0.0 109.29 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.5 m -158.41 156.96 31.37 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 119.472 -2.017 . . . . 0.0 108.569 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -101.82 134.38 45.09 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -120.84 123.3 42.23 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 125.837 1.655 . . . . 0.0 109.209 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . 0.435 HD23 ' H ' ' D' 1102 ' ' GLN . 0.5 OUTLIER -126.65 147.83 49.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.174 0.99 . . . . 0.0 108.884 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . 0.435 ' H ' HD23 ' D' 1101 ' ' LEU . 7.4 pm0 -136.06 110.87 8.73 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.098 2.159 . . . . 0.0 109.428 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -155.2 151.21 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.471 1.509 . . . . 0.0 110.639 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.67 102.44 7.6 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.732 1.151 . . . . 0.0 110.535 177.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.56 122.87 2.04 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 105.197 -3.161 . . . . 0.0 105.197 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.57 -58.19 5.7 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 120.989 2.395 . . . . 0.0 114.3 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -63.06 -41.02 99.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.596 0.635 . . . . 0.0 109.327 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -53.02 -48.58 67.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.288 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.6 t80 -63.76 -48.38 77.2 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 119.514 1.052 . . . . 0.0 111.727 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.0 -47.29 68.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.197 0.908 . . . . 0.0 111.313 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.4 mt -68.57 -57.56 8.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 126.104 1.762 . . . . 0.0 110.79 -179.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . 0.42 HD21 ' HB2' ' B' ' 116' ' ' LYS . 5.1 mp -56.68 -39.0 73.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 118.925 0.784 . . . . 0.0 110.797 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 42.1 mtp -63.55 -52.67 60.08 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.362 0.983 . . . . 0.0 110.237 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.08 -33.33 75.25 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.428 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . 0.429 HD22 ' CG2' ' C' 1022 ' ' ILE . 31.6 mt -70.32 -38.37 74.91 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 120.215 1.37 . . . . 0.0 109.951 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . 0.403 ' HE3' ' CG ' ' D' 1120 ' ' GLU . 21.8 tptt -62.67 -52.49 63.08 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -57.01 -42.37 80.22 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.412 1.485 . . . . 0.0 109.693 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 44.8 t -52.64 -54.63 30.71 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.529 1.132 . . . . 0.0 110.255 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.09 -43.39 74.61 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.411 -0.805 . . . . 0.0 110.977 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . 0.403 ' CG ' ' HE3' ' D' 1116 ' ' LYS . 2.0 mm-40 -55.36 -48.15 74.69 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 119.172 0.896 . . . . 0.0 111.7 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . 0.457 ' HA ' HD13 ' D' 1121 ' ' LEU . 3.4 mm? -72.35 -48.76 39.4 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 116.208 -1.853 . . . . 0.0 109.058 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.5 tpt -54.51 -33.06 59.2 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.846 1.657 . . . . 0.0 109.436 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -74.87 -32.96 62.01 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 117.897 -1.049 . . . . 0.0 110.572 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 43.7 tp -87.03 -32.55 19.95 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.179 1.354 . . . . 0.0 113.624 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 9.7 m -92.41 148.45 36.44 Favored Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 120.752 -1.218 . . . . 0.0 108.322 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -68.84 177.34 5.03 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 N-CA-C 109.426 -1.028 . . . . 0.0 109.426 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -113.4 47.71 0.38 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 116.361 1.986 . . . . 0.0 116.361 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.41 -51.18 0.77 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.744 2.296 . . . . 0.0 113.014 -178.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.06 -29.6 69.43 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.136 -0.978 . . . . 0.0 110.625 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.6 t -61.17 -54.48 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 124.034 0.934 . . . . 0.0 108.669 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.63 -45.73 92.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.02 0.827 . . . . 0.0 111.428 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.8 t -59.07 -50.46 74.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.095 0.958 . . . . 0.0 110.484 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.1 t80 -68.39 -42.16 79.48 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.035 1.334 . . . . 0.0 110.853 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.49 -49.15 68.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 119.107 0.867 . . . . 0.0 111.023 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -74.43 -39.93 62.29 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.1 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -62.79 -29.9 71.06 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.822 0.449 . . . . 0.0 111.42 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -80.19 -39.06 29.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -56.75 -32.67 65.8 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.814 -0.554 . . . . 0.0 109.518 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 15.1 mt -64.26 -12.19 38.83 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.605 1.162 . . . . 0.0 113.097 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 3.0 tt -83.03 -21.54 33.81 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.618 1.167 . . . . 0.0 109.122 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -94.35 177.26 6.01 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 127.619 2.368 . . . . 0.0 109.166 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 123.4 0.68 . . . . 0.0 109.589 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.2 t . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.299 0.095 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -72.27 -10.66 60.08 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.058 0.943 . . . . 0.0 112.039 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -113.72 9.61 17.77 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.018 1.727 . . . . 0.0 111.297 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.25 112.28 4.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.691 0.796 . . . . 0.0 109.288 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.3 95.4 0.43 Allowed 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -104.14 129.16 51.85 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.292 1.037 . . . . 0.0 110.243 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -103.38 118.6 37.12 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -101.93 96.02 6.23 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 125.806 1.642 . . . . 0.0 111.118 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -75.38 113.95 3.88 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 125.12 3.88 . . . . 0.0 111.466 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.9 t -145.11 154.91 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.278 -0.889 . . . . 0.0 109.487 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -135.34 101.88 4.97 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 125.046 1.339 . . . . 0.0 107.817 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.94 121.36 0.97 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 107.64 -2.184 . . . . 0.0 107.64 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.92 -51.57 31.81 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 120.232 2.016 . . . . 0.0 108.45 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.98 -32.82 73.5 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -61.52 -53.37 57.27 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 118.208 -0.901 . . . . 0.0 109.135 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -67.65 -39.16 84.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -55.02 -57.23 12.56 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.332 0.515 . . . . 0.0 110.397 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -71.48 -33.38 69.24 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 119.322 -0.37 . . . . 0.0 111.494 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 tp -61.22 -53.34 58.11 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.172 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.88 -34.95 77.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.225 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.25 -49.22 72.6 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.602 1.092 . . . . 0.0 110.607 -178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.0 mt -83.25 -35.05 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 123.612 0.765 . . . . 0.0 112.169 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.52 -46.63 87.54 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 120.186 -1.571 . . . . 0.0 109.359 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -67.83 -48.9 64.9 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 117.346 -1.311 . . . . 0.0 109.812 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.3 p -53.03 -41.26 64.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 120.04 1.291 . . . . 0.0 112.158 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 26' ' ' LEU . 1.1 tm? -74.19 -49.67 22.53 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.898 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -54.46 -47.61 72.71 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.031 0.832 . . . . 0.0 109.913 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.426 HD22 HG22 ' B' ' 130' ' ' VAL . 55.8 mt -62.9 -49.22 75.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.709 1.604 . . . . 0.0 110.857 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.9 ttt -56.75 -47.1 80.84 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.586 1.154 . . . . 0.0 109.079 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -64.84 -40.28 94.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.866 1.267 . . . . 0.0 111.532 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.8 -30.33 65.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.696 1.199 . . . . 0.0 112.307 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.3 tp -126.3 70.06 69.08 Favored Pre-proline 0 C--O 1.238 0.449 0 C-N-CA 123.657 0.783 . . . . 0.0 109.918 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.29 77.92 3.4 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.235 2.624 . . . . 0.0 111.487 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 62.9 mm-40 -69.27 167.95 15.25 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.0 m80 -59.25 -28.07 66.37 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.593 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.6 m -57.15 -48.53 78.46 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.252 1.387 . . . . 0.0 107.798 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.4 mt -65.35 -44.48 94.69 Favored 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 124.38 1.072 . . . . 0.0 108.616 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.04 -39.27 77.97 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.449 0.568 . . . . 0.0 111.98 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.4 m -66.6 -52.48 44.81 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -55.76 -51.38 67.59 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 123.408 0.683 . . . . 0.0 111.042 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -53.21 -48.44 68.13 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 122.737 0.415 . . . . 0.0 111.3 -178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -64.02 -50.81 67.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.539 0.735 . . . . 0.0 111.924 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -61.53 -40.49 94.84 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.019 0.928 . . . . 0.0 111.846 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -45.37 67.95 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -58.02 -29.15 65.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.412 1.005 . . . . 0.0 111.709 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -59.46 -46.29 89.19 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -60.21 -31.88 70.58 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.559 -0.713 . . . . 0.0 111.372 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -70.33 -57.12 5.21 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -55.52 -36.61 66.91 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.152 0.581 . . . . 0.0 110.811 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -68.19 -44.62 75.46 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.081 -0.961 . . . . 0.0 111.345 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.5 mt -73.99 -44.02 56.1 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.95 1.25 . . . . 0.0 111.601 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.88 -46.0 92.34 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 49.16 69.04 0.62 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.094 1.357 . . . . 0.0 111.094 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.478 ' HE2' ' HA ' ' A' ' 54' ' ' LYS . 9.1 mmpt? -133.46 170.99 14.68 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.353 1.061 . . . . 0.0 111.877 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -144.38 90.36 2.09 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.336 1.454 . . . . 0.0 109.969 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.2 p -143.3 -24.65 0.6 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.154 0.981 . . . . 0.0 111.57 178.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 56.7 m -128.84 99.12 5.19 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.186 1.795 . . . . 0.0 106.411 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 pp -81.47 7.44 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 123.223 0.609 . . . . 0.0 111.063 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.444 ' NE2' ' H ' ' A' ' 60' ' ' SER . 0.0 OUTLIER -120.0 158.46 26.72 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.196 2.999 . . . . 0.0 106.294 -179.642 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.444 ' H ' ' NE2' ' A' ' 59' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.154 0 C-N-CA 125.034 1.334 . . . . 0.0 109.195 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.816 0 N-CA-C 111.919 -0.472 . . . . 0.0 111.919 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -163.52 165.01 24.12 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.41 1.884 . . . . 0.0 108.606 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -90.94 101.96 14.73 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -72.55 8.63 1.34 Allowed 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 126.636 1.974 . . . . 0.0 114.582 -178.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 28.1 t0 72.17 167.81 0.31 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.778 2.431 . . . . 0.0 112.5 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 59.2 m -86.04 167.05 15.36 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.539 1.936 . . . . 0.0 110.896 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -123.37 142.24 51.17 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 124.488 1.115 . . . . 0.0 108.567 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -127.2 147.45 50.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.06 0.944 . . . . 0.0 109.777 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.16 144.87 51.15 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.357 1.863 . . . . 0.0 107.371 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.08 98.92 4.12 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.223 1.009 . . . . 0.0 112.321 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -151.72 150.35 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 120.174 -1.579 . . . . 0.0 112.108 -178.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.428 ' HB3' ' HA ' ' D' 1098 ' ' THR . 0.0 OUTLIER -124.2 100.85 6.9 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 121.924 0.869 . . . . 0.0 108.883 177.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.64 116.54 1.04 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 103.753 -3.739 . . . . 0.0 103.753 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.7 -56.78 14.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 120.473 2.137 . . . . 0.0 111.002 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -61.11 -48.96 79.25 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 -54.86 -45.5 74.57 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.428 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -61.83 -55.05 33.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.356 -1.307 . . . . 0.0 111.216 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -48.45 -54.32 14.6 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.291 1.036 . . . . 0.0 111.049 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.3 mt -60.62 -57.73 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 126.13 1.772 . . . . 0.0 110.028 -179.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.44 -25.77 67.44 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.195 -0.94 . . . . 0.0 112.136 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 5.5 ttt -68.91 -52.42 29.63 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 119.657 1.117 . . . . 0.0 108.218 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -65.58 -37.67 87.31 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 118.894 -1.123 . . . . 0.0 110.344 -179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.0 mt -63.89 -38.89 92.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.756 -0.59 . . . . 0.0 111.241 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -54.21 28.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 O-C-N 121.344 -0.848 . . . . 0.0 110.025 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -54.66 -42.83 71.79 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 125.377 1.673 . . . . 0.0 108.337 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 40.8 t -58.04 -48.65 79.45 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.242 1.017 . . . . 0.0 110.899 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.26 -43.43 86.48 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.65 0.659 . . . . 0.0 111.26 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.07 -45.63 91.24 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.198 0.908 . . . . 0.0 109.598 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -48.05 75.02 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.635 -0.666 . . . . 0.0 109.818 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -24.0 67.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.129 0.972 . . . . 0.0 111.098 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -89.31 -20.65 23.8 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.747 1.158 . . . . 0.0 110.521 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.08 -33.18 11.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 120.034 1.288 . . . . 0.0 112.149 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.1 t -95.49 148.08 34.04 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.729 1.612 . . . . 0.0 108.487 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.25 -178.1 3.98 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 123.481 2.788 . . . . 0.0 111.635 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -129.0 62.84 64.43 Favored Pre-proline 0 CA--C 1.55 0.951 0 N-CA-C 116.752 2.13 . . . . 0.0 116.752 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.19 -54.83 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.517 2.811 . . . . 0.0 113.728 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 tt -56.33 -34.09 66.24 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.627 0.771 . . . . 0.0 109.767 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.426 HG22 HD22 ' A' ' 28' ' ' LEU . 14.8 t -61.25 -47.57 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 126.101 1.76 . . . . 0.0 109.3 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -63.49 -36.29 83.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.646 1.112 . . . . 0.0 109.74 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 2.8 t -70.62 -39.05 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.881 0.472 . . . . 0.0 110.166 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -70.1 -50.76 37.57 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.315 1.446 . . . . 0.0 109.371 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.17 -48.12 68.25 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.447 1.499 . . . . 0.0 110.445 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 -68.34 -48.05 65.87 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.732 1.151 . . . . 0.0 110.648 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -56.0 -40.47 73.41 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 122.004 -0.435 . . . . 0.0 110.924 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -80.74 -27.71 36.74 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.541 1.137 . . . . 0.0 111.264 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -63.68 -33.3 75.32 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.654 1.57 . . . . 0.0 108.483 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.7 mt -63.96 -15.68 59.78 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.043 0.937 . . . . 0.0 111.756 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.4 tt -73.37 -16.45 61.34 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.094 1.357 . . . . 0.0 109.433 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.82 169.83 8.31 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.801 1.64 . . . . 0.0 110.183 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 49.0 mtt-85 . . . . . 0 C--O 1.249 1.056 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 178.299 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.685 0 CA-C-O 121.173 0.511 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 23.1 t0 -70.9 -33.73 70.85 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.439 1.095 . . . . 0.0 109.639 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -87.81 4.77 43.21 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.719 2.007 . . . . 0.0 111.85 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -71.97 104.72 3.61 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 21.9 tp -73.78 95.15 2.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.82 176.36 5.32 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.306 2.242 . . . . 0.0 109.276 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -138.42 144.83 40.36 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.633 1.573 . . . . 0.0 107.224 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.9 tp -126.11 105.78 25.32 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.418 1.487 . . . . 0.0 110.494 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -82.66 115.43 2.47 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 123.868 3.045 . . . . 0.0 111.43 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 96.4 t -139.93 150.86 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 120.299 -1.501 . . . . 0.0 108.056 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.39 104.77 5.71 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.205 0.602 . . . . 0.0 110.775 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -165.96 125.42 1.34 Allowed Glycine 0 CA--C 1.519 0.319 0 N-CA-C 105.881 -2.888 . . . . 0.0 105.881 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -68.52 -51.78 39.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 121.779 2.79 . . . . 0.0 109.881 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.0 -41.71 97.4 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.561 0.696 . . . . 0.0 109.138 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -61.93 -46.82 87.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 124.344 1.057 . . . . 0.0 111.647 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 17.1 t80 -66.77 -41.91 86.93 Favored 'General case' 0 C--O 1.23 0.065 0 CA-C-N 120.157 1.344 . . . . 0.0 111.863 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -55.54 -56.99 13.86 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.563 0.745 . . . . 0.0 110.716 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 tmm? -70.47 -40.26 73.77 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 118.507 -0.758 . . . . 0.0 112.594 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 8.5 tp -58.11 -40.95 82.49 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.242 0.928 . . . . 0.0 108.904 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 6.6 mt -66.87 -47.14 72.8 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.919 -1.039 . . . . 0.0 109.142 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -55.52 -49.14 73.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.382 0.992 . . . . 0.0 111.976 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.76 -36.89 66.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 O-C-N 121.866 -0.521 . . . . 0.0 111.183 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -66.59 -57.9 6.29 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.108 -0.995 . . . . 0.0 109.122 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -54.96 -55.23 33.08 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.327 1.451 . . . . 0.0 109.731 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 33.1 p -53.37 -49.9 66.2 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.958 1.254 . . . . 0.0 112.49 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.28 -52.07 63.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 118.197 0.453 . . . . 0.0 110.767 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.84 -40.67 80.66 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.452 0.701 . . . . 0.0 112.089 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 31.5 mt -71.36 -44.5 64.91 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.036 -1.04 . . . . 0.0 110.012 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -43.25 85.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -66.61 -44.45 82.06 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.404 1.882 . . . . 0.0 110.951 179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 t80 -68.64 -44.46 74.12 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 12.6 tp -116.04 73.92 5.13 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.621 1.168 . . . . 0.0 110.869 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.38 99.47 1.21 Allowed 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 122.129 1.886 . . . . 0.0 109.023 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . 0.483 ' H ' HD12 ' C' 1037 ' ' ILE . 36.6 mm-40 -85.07 167.03 16.17 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.511 1.124 . . . . 0.0 108.206 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 13.3 m80 -54.2 -36.98 64.03 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.126 0.421 . . . . 0.0 111.344 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.63 -51.55 66.81 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.75 1.22 . . . . 0.0 108.801 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . 0.483 HD12 ' H ' ' C' 1034 ' ' GLN . 48.3 mt -65.39 -45.31 93.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 125.743 1.617 . . . . 0.0 108.676 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.48 -45.3 69.57 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 124.911 1.284 . . . . 0.0 111.314 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.7 m -65.68 -52.9 47.88 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.752 1.221 . . . . 0.0 109.784 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -55.78 -48.97 74.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.027 0.931 . . . . 0.0 111.208 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -55.22 -48.53 73.76 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.3 0.64 . . . . 0.0 110.468 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -33.72 75.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.97 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -62.76 -48.74 77.86 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.522 0.729 . . . . 0.0 109.089 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -60.25 -46.58 89.3 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.896 0.479 . . . . 0.0 109.718 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -58.64 -33.49 70.12 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.198 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -60.44 -45.38 93.88 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.826 1.194 . . . . 0.0 108.443 178.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -70.42 -29.84 66.55 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.574 -0.704 . . . . 0.0 111.756 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -64.29 -47.1 80.8 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.303 0.956 . . . . 0.0 108.628 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -65.39 -39.81 92.68 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.187 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 63.3 m170 -59.67 -43.55 93.92 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.083 1.31 . . . . 0.0 113.238 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 8.6 mt -75.51 -45.75 36.38 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 56.1 tp -75.12 -31.26 61.06 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 13.8 tt0 53.66 7.01 0.09 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 128.543 2.737 . . . . 0.0 116.238 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -67.65 164.43 19.24 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 119.614 -1.929 . . . . 0.0 111.692 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -141.61 83.2 1.85 Allowed 'General case' 0 C--N 1.33 -0.279 1 N-CA-C 99.644 -4.206 . . . . 0.0 99.644 178.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 46.5 p -133.99 -15.14 2.33 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.101 1.76 . . . . 0.0 112.915 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 15.8 m -143.6 118.4 9.91 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 104.249 -2.5 . . . . 0.0 104.249 179.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 2.3 pp -100.77 10.56 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 124.506 1.122 . . . . 0.0 113.307 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.39 153.28 47.61 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 126.01 1.724 . . . . 0.0 106.563 178.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.251 1.134 0 C-N-CA 126.556 1.942 . . . . 0.0 105.836 179.982 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.61 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.17 177.97 4.73 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.352 1.061 . . . . 0.0 109.763 178.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 1.4 t70 -77.36 153.68 33.52 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -122.83 22.74 9.64 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.601 0.76 . . . . 0.0 111.592 -177.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 3.0 t70 68.0 -165.59 0.2 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.453 1.101 . . . . 0.0 111.012 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . 0.428 ' HA ' ' HB3' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -121.3 167.69 12.46 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.051 1.34 . . . . 0.0 108.533 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -119.83 130.49 54.93 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -120.6 142.79 49.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.401 1.08 . . . . 0.0 109.227 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.31 134.83 54.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.703 1.201 . . . . 0.0 108.197 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -128.25 111.52 13.49 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.7 m -155.38 151.68 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 126.209 1.804 . . . . 0.0 108.71 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.88 101.68 7.38 Favored 'General case' 0 CA--C 1.527 0.065 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.86 122.32 1.81 Allowed Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 106.833 -2.507 . . . . 0.0 106.833 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -67.51 -58.0 5.51 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 120.799 2.299 . . . . 0.0 113.683 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 51.6 mttm -65.83 -42.93 89.93 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -51.98 -49.01 64.08 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.227 -0.892 . . . . 0.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 75.2 t80 -62.94 -49.63 73.99 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 119.301 0.955 . . . . 0.0 112.558 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -56.77 -49.71 74.47 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.208 0.913 . . . . 0.0 110.551 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 81.8 mt -58.98 -48.81 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 1.8 mm? -62.3 -34.7 77.1 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.313 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -52.85 57.51 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.189 0.904 . . . . 0.0 108.562 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -62.97 -42.47 99.84 Favored 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.72 -0.792 . . . . 0.0 111.232 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 34.9 mt -64.1 -44.59 91.85 Favored 'General case' 0 N--CA 1.458 -0.064 0 CA-C-N 118.209 0.459 . . . . 0.0 112.157 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.62 -51.96 55.6 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 118.703 0.683 . . . . 0.0 110.475 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.05 -52.12 59.55 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.583 1.177 . . . . 0.0 108.815 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 42.2 t -56.5 -44.7 80.94 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.143 -1.408 . . . . 0.0 112.839 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.87 -44.9 91.68 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.899 1.227 . . . . 0.0 110.487 -179.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.77 -48.26 81.45 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.635 0.774 . . . . 0.0 109.511 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -44.95 89.26 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.2 1.0 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.4 -30.55 70.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.769 1.227 . . . . 0.0 111.47 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 40.0 tp10 -78.7 -34.69 45.85 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.843 -0.599 . . . . 0.0 109.914 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.1 pp -85.75 -29.81 23.58 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.1 p -94.2 144.26 27.74 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 119.917 1.235 . . . . 0.0 109.059 -178.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.65 175.51 7.92 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.484 1.456 . . . . 0.0 110.667 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -117.93 39.96 0.31 Allowed Pre-proline 0 CA--C 1.553 1.083 0 N-CA-C 118.07 2.619 . . . . 0.0 118.07 -176.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -57.54 -48.76 15.8 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.727 2.284 . . . . 0.0 115.08 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 9.1 tt -65.1 -38.98 92.45 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.4 t -58.11 -48.32 84.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 123.773 0.829 . . . . 0.0 109.01 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.85 -45.08 78.55 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 2.5 m -63.05 -48.0 80.58 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 119.183 -0.437 . . . . 0.0 110.238 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.38 -52.59 64.73 Favored 'General case' 0 C--O 1.227 -0.109 0 C-N-CA 124.834 1.253 . . . . 0.0 110.948 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -53.23 -46.04 68.94 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.37 1.868 . . . . 0.0 110.822 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.75 -50.78 26.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.626 0.648 . . . . 0.0 110.226 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -56.08 -35.15 66.66 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.818 -0.552 . . . . 0.0 110.888 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -78.1 -32.89 50.84 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.165 0.986 . . . . 0.0 110.286 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -59.57 -33.09 71.0 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.7 mt -61.2 -9.93 5.75 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.423 0.689 . . . . 0.0 112.544 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.71 12.48 36.49 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.582 1.953 . . . . 0.0 109.665 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -134.0 157.36 46.27 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 126.292 1.837 . . . . 0.0 108.887 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 75.9 mtt-85 . . . . . 0 C--O 1.246 0.908 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 179.435 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.4 p . . . . . 0 CA--C 1.533 0.294 0 CA-C-O 119.683 -0.198 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -2.62 1.18 Allowed 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -89.16 1.58 55.43 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 128.575 2.75 . . . . 0.0 113.388 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.83 107.81 0.57 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.314 0.961 . . . . 0.0 108.84 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.9 tp -77.58 108.91 11.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 125.034 1.334 . . . . 0.0 111.429 -178.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -103.34 162.64 12.84 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -135.97 102.25 4.98 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 121.338 -0.852 . . . . 0.0 111.094 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mp -75.73 119.4 76.97 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 119.897 1.226 . . . . 0.0 108.626 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -86.85 117.42 1.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 122.836 2.358 . . . . 0.0 107.839 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.4 t -141.13 152.07 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 119.955 1.252 . . . . 0.0 108.763 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.16 102.9 5.34 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.93 124.58 1.24 Allowed Glycine 0 C--O 1.225 -0.444 0 CA-C-O 115.695 -2.725 . . . . 0.0 107.682 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -69.88 -52.0 28.45 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 122.617 3.209 . . . . 0.0 111.288 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -76.17 -30.85 58.24 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.816 1.246 . . . . 0.0 109.29 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 m -67.0 -51.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -58.88 -37.9 77.61 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 119.036 0.835 . . . . 0.0 109.912 179.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -57.64 9.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.472 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -64.95 -44.09 90.57 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.497 0.59 . . . . 0.0 111.705 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.04 -51.4 69.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.2 1.0 . . . . 0.0 108.49 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -70.77 -45.56 64.51 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 119.323 0.965 . . . . 0.0 111.85 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -56.31 -48.85 75.87 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.657 1.117 . . . . 0.0 113.367 -177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.7 mt -74.4 -32.97 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.718 -0.614 . . . . 0.0 109.352 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.89 -48.23 79.89 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.98 -45.46 93.55 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 125.554 1.541 . . . . 0.0 109.139 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.2 t -53.17 -51.35 62.33 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.747 0.819 . . . . 0.0 110.72 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tt -61.6 -55.56 29.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 123.865 0.866 . . . . 0.0 109.946 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.89 -51.63 65.4 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 124.547 1.139 . . . . 0.0 112.588 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.05 -41.55 86.31 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.141 -0.974 . . . . 0.0 112.521 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -61.89 -45.5 93.48 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -67.23 -31.51 71.92 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 118.36 -0.829 . . . . 0.0 111.378 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -71.39 -27.59 63.43 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.159 0.89 . . . . 0.0 109.767 178.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.2 mt -126.34 76.58 73.01 Favored Pre-proline 0 C--O 1.241 0.631 0 CA-C-N 119.743 1.156 . . . . 0.0 109.417 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -72.91 2.52 5.32 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.249 3.299 . . . . 0.0 113.208 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -113.14 -65.01 1.23 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.472 1.109 . . . . 0.0 108.895 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -47.84 -50.1 27.25 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.454 1.502 . . . . 0.0 113.902 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -45.68 79.02 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.759 -0.588 . . . . 0.0 112.026 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.2 mm -67.49 -34.76 70.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 123.849 0.86 . . . . 0.0 111.048 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -58.7 -54.85 42.47 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.7 m -58.74 -41.11 85.72 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.649 0.78 . . . . 0.0 110.032 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -60.42 -53.4 57.99 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.22 0.918 . . . . 0.0 110.558 179.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.07 -40.46 81.09 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.074 0.55 . . . . 0.0 109.867 -178.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.55 -47.92 65.64 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 118.77 -0.633 . . . . 0.0 109.712 179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.41 -46.8 76.6 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.41 1.484 . . . . 0.0 110.995 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -62.36 -49.72 74.45 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.713 0.805 . . . . 0.0 110.47 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.08 -41.87 98.62 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.635 1.174 . . . . 0.0 111.253 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -60.8 -32.61 71.96 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.064 0.546 . . . . 0.0 111.896 -179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -61.84 -36.83 82.36 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -73.62 -37.61 65.34 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 -61.14 -33.02 72.74 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.689 -0.632 . . . . 0.0 109.965 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -61.72 -51.31 68.9 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 24.9 tp -62.05 -19.6 63.08 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.284 1.034 . . . . 0.0 112.409 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.39 -15.99 60.41 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.733 0.813 . . . . 0.0 110.013 178.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 37.9 52.96 1.53 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 128.489 2.716 . . . . 0.0 112.68 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -144.82 9.84 1.34 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 114.798 1.406 . . . . 0.0 114.798 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -130.1 155.19 46.59 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 121.051 1.75 . . . . 0.0 109.687 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 p -91.83 -47.17 7.47 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.753 1.221 . . . . 0.0 108.152 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.1 t -157.28 -169.57 2.96 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.38 1.872 . . . . 0.0 107.248 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.4 tt -66.9 -12.74 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 125.635 1.574 . . . . 0.0 110.953 178.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -131.9 158.35 41.6 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 128.341 2.656 . . . . 0.0 105.397 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 m . . . . . 0 C--O 1.256 1.409 0 C-N-CA 127.082 2.153 . . . . 0.0 106.328 179.673 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.548 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 5.2 m -138.38 151.05 47.15 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 123.303 0.641 . . . . 0.0 110.002 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -161.78 117.43 2.04 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 104.783 -2.303 . . . . 0.0 104.783 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -132.44 -15.3 2.83 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 125.782 1.633 . . . . 0.0 110.685 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.79 91.47 3.51 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 103.125 -2.917 . . . . 0.0 103.125 178.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.3 m -148.82 151.5 34.87 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -102.74 129.61 49.43 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 178.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -105.68 155.14 19.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.71 145.91 26.94 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.27 108.6 5.27 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.367 1.867 . . . . 0.0 109.892 -179.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.576 HG11 ' HE3' ' D' 1116 ' ' LYS . 54.6 t -155.37 146.37 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.54 1.136 . . . . 0.0 109.372 178.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -97.27 104.77 16.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.07 108.06 0.5 Allowed Glycine 0 C--O 1.225 -0.45 0 CA-C-O 116.448 -2.306 . . . . 0.0 111.451 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -64.53 -57.23 9.74 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.546 3.173 . . . . 0.0 110.775 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -50.09 66.64 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.927 0.891 . . . . 0.0 109.908 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -56.71 -43.57 80.69 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 118.481 -0.771 . . . . 0.0 112.031 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -61.47 -49.96 74.69 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.225 0.921 . . . . 0.0 109.483 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.62 -53.73 54.28 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 124.04 0.837 . . . . 0.0 112.349 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 74.9 mt -60.34 -58.03 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.601 1.56 . . . . 0.0 110.921 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.31 -31.73 72.96 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 117.606 -1.188 . . . . 0.0 111.184 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -70.25 -44.81 67.72 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 120.821 1.646 . . . . 0.0 108.169 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.04 -47.6 71.4 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 18.5 mt -67.99 -39.54 83.23 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.013 0.925 . . . . 0.0 111.454 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -57.93 -59.07 5.81 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.751 1.62 . . . . 0.0 109.012 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -54.27 -50.3 67.57 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.769 2.028 . . . . 0.0 110.369 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 16.4 m -59.07 -36.25 74.75 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -38.42 64.14 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.097 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.96 -42.75 98.9 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.48 -42.64 99.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.25 -38.11 89.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.64 0.776 . . . . 0.0 110.85 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.63 -38.16 70.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.775 0.83 . . . . 0.0 111.404 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.57 -32.97 28.24 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -178.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 65.4 t -93.72 141.28 23.59 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 119.3 0.955 . . . . 0.0 108.524 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -67.72 -164.38 0.1 OUTLIER 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 122.841 2.361 . . . . 0.0 110.389 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -108.77 47.3 0.2 Allowed Pre-proline 0 CA--C 1.555 1.154 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -67.89 -71.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.314 2.676 . . . . 0.0 112.602 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.76 -38.69 79.01 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 7.5 t -52.89 -55.86 10.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 126.777 2.031 . . . . 0.0 109.975 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -66.01 -43.39 87.84 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.314 1.046 . . . . 0.0 111.583 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.1 t -56.73 -49.92 73.77 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.513 0.725 . . . . 0.0 109.986 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -64.77 -48.79 73.24 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.686 1.594 . . . . 0.0 108.111 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.52 -48.0 66.3 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.761 1.224 . . . . 0.0 112.098 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.32 -56.62 10.26 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.91 0.777 . . . . 0.0 110.692 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -53.98 -41.39 67.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.096 0.558 . . . . 0.0 110.94 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -69.56 -41.63 75.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.569 1.148 . . . . 0.0 110.261 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -56.96 -31.45 65.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 119.434 1.015 . . . . 0.0 109.871 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.37 -11.49 6.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.15 0.886 . . . . 0.0 112.45 178.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 tt -76.94 -12.37 59.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.57 1.548 . . . . 0.0 109.638 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -141.13 177.11 8.3 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.577 1.551 . . . . 0.0 110.792 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . 0.544 ' H ' ' HD3' ' B' ' 142' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.239 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 121.291 0.567 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.05 -22.1 16.44 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.797 2.439 . . . . 0.0 112.465 -178.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.58 7.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 126.38 1.872 . . . . 0.0 114.969 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.92 113.27 4.82 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.261 0.937 . . . . 0.0 109.119 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.59 106.58 8.32 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.373 1.869 . . . . 0.0 110.462 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.07 154.27 19.9 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.025 1.73 . . . . 0.0 109.072 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -119.16 145.32 46.09 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.217 0.917 . . . . 0.0 111.519 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 16.8 mt -117.79 90.3 35.89 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.711 1.604 . . . . 0.0 110.661 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.0 106.72 2.27 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.952 3.768 . . . . 0.0 110.769 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 15.3 t -139.41 156.91 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.339 1.456 . . . . 0.0 108.917 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.57 101.56 4.83 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 123.156 0.583 . . . . 0.0 110.026 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.87 121.92 1.02 Allowed Glycine 0 CA--C 1.522 0.512 0 N-CA-C 108.363 -1.895 . . . . 0.0 108.363 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -69.19 -51.84 33.96 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.277 2.039 . . . . 0.0 111.255 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -70.7 -33.46 70.91 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.48 0.657 . . . . 0.0 109.465 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 33.1 m -60.1 -51.29 70.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.319 1.448 . . . . 0.0 108.552 178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 54.1 t80 -63.12 -44.52 95.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.751 1.221 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -55.91 -57.18 13.16 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.6 ppp? -65.24 -39.12 92.28 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.682 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 19.7 tp -60.07 -49.6 77.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.671 -0.681 . . . . 0.0 112.078 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.63 -45.86 88.33 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.594 0.634 . . . . 0.0 109.856 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -55.2 -45.58 75.86 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.266 0.626 . . . . 0.0 111.549 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 25.8 mt -76.27 -46.73 32.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.207 0.603 . . . . 0.0 111.169 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -59.6 -37.24 78.02 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.35 0.66 . . . . 0.0 110.221 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -66.64 -51.97 50.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.3 t -53.44 -51.52 62.4 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.693 0.797 . . . . 0.0 112.131 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.18 -53.64 54.42 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.609 0.764 . . . . 0.0 110.764 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -58.84 -51.03 71.74 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.159 0.584 . . . . 0.0 111.967 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.8 -38.03 89.6 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.655 0.782 . . . . 0.0 111.4 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.2 tmt? -62.04 -46.79 87.58 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -74.93 -20.27 59.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.702 0.683 . . . . 0.0 110.888 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -76.64 -38.09 55.22 Favored 'General case' 0 C--N 1.346 0.445 0 O-C-N 120.568 -1.332 . . . . 0.0 108.396 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 17.5 mt -118.44 76.03 12.61 Favored Pre-proline 0 N--CA 1.467 0.411 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -70.78 0.92 5.67 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.57 2.846 . . . . 0.0 114.91 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -105.32 -58.34 1.91 Allowed 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 119.777 1.171 . . . . 0.0 109.962 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -47.38 -47.92 26.05 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 -177.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.92 71.91 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 120.148 1.34 . . . . 0.0 111.281 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.34 -36.95 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.687 1.195 . . . . 0.0 110.45 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.5 -52.46 61.16 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.131 1.772 . . . . 0.0 108.762 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.8 m -64.11 -40.81 97.0 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 12.8 t80 -56.59 -53.65 55.18 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.409 1.084 . . . . 0.0 109.614 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 14.0 mtp180 -63.09 -40.09 96.61 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.444 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.75 -48.83 80.05 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.879 0.763 . . . . 0.0 109.031 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -62.09 -50.77 70.6 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.276 1.43 . . . . 0.0 111.283 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -57.02 -43.79 82.21 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.386 1.074 . . . . 0.0 108.978 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -64.66 -54.32 33.63 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.791 0.837 . . . . 0.0 109.3 178.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -53.87 -31.47 49.82 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.727 1.211 . . . . 0.0 112.675 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -55.88 -48.35 75.75 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.557 1.071 . . . . 0.0 108.976 178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -74.27 -35.03 63.74 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.472 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -58.68 -38.42 78.19 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.117 0.872 . . . . 0.0 108.733 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -47.99 83.77 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.853 0.861 . . . . 0.0 110.366 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 50.1 tp -59.46 -22.61 61.78 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.361 0.664 . . . . 0.0 112.219 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.29 -14.0 59.61 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.184 1.394 . . . . 0.0 111.8 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 14.0 mm100 38.57 55.31 1.89 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.57 2.348 . . . . 0.0 112.335 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -132.76 2.13 3.7 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -139.84 153.48 47.06 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 121.551 1.978 . . . . 0.0 108.95 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 3.3 p -80.24 -44.45 19.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.045 0.938 . . . . 0.0 111.233 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 15.8 t -160.02 -165.7 1.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.214 1.006 . . . . 0.0 108.385 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 19.7 tt -63.66 -19.87 25.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.752 2.021 . . . . 0.0 110.994 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -125.4 156.42 38.83 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 127.367 2.267 . . . . 0.0 105.709 178.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 62.6 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 128.101 2.56 . . . . 0.0 105.841 179.55 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 60.3 m -112.54 143.22 44.08 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.048 1.339 . . . . 0.0 108.414 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 28.1 p-10 -164.69 63.65 0.13 Allowed 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.364 1.466 . . . . 0.0 109.369 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -92.16 -23.59 19.35 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.957 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -67.14 100.92 0.82 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.14 147.74 18.13 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -178.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -102.22 128.91 48.54 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.63 160.87 13.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.165 1.386 . . . . 0.0 109.453 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . 0.496 HD23 ' H ' ' D' 1102 ' ' GLN . 0.5 OUTLIER -152.8 152.67 31.87 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.409 -1.432 . . . . 0.0 107.893 176.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . 0.496 ' H ' HD23 ' D' 1101 ' ' LEU . 1.1 tm0? -151.39 98.0 2.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.779 1.232 . . . . 0.0 109.032 -177.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 55.2 t -148.73 149.65 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.983 1.713 . . . . 0.0 108.35 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -118.94 102.06 8.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.403 1.456 . . . . 0.0 112.606 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.37 124.93 2.42 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 107.164 -2.374 . . . . 0.0 107.164 176.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -67.3 -57.15 7.18 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 120.641 2.22 . . . . 0.0 110.979 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.58 -47.98 83.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.84 -50.52 63.57 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.482 1.513 . . . . 0.0 112.402 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 66.7 t80 -64.31 -48.01 77.24 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.17 -178.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.84 -53.03 54.61 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.836 0.827 . . . . 0.0 110.022 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.98 -57.95 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 125.474 1.51 . . . . 0.0 110.597 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.24 -40.05 88.89 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.9 -1.048 . . . . 0.0 111.551 -178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.5 tmt? -64.1 -48.9 74.33 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 120.418 1.463 . . . . 0.0 109.726 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 14.3 ttmm -53.47 -51.89 61.28 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.492 0.717 . . . . 0.0 109.205 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 40.0 mt -62.7 -42.06 99.44 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 124.407 1.083 . . . . 0.0 111.57 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . 0.576 ' HE3' HG11 ' B' ' 103' ' ' VAL . 39.0 tptt -59.77 -53.3 59.55 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.748 1.219 . . . . 0.0 110.798 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -59.54 -51.38 70.07 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.385 1.474 . . . . 0.0 109.491 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.5 m -54.76 -44.61 73.78 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.09 0.956 . . . . 0.0 112.179 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -36.74 77.94 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.265 0.484 . . . . 0.0 110.988 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.65 -41.29 92.75 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.399 1.0 . . . . 0.0 109.127 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.72 -52.25 58.07 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.805 1.242 . . . . 0.0 110.376 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.5 -19.87 65.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.235 0.471 . . . . 0.0 111.75 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -79.64 -39.16 32.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.857 1.208 . . . . 0.0 109.065 178.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -75.62 -28.9 59.01 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 118.245 -0.883 . . . . 0.0 112.61 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.91 147.39 33.87 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.781 0.832 . . . . 0.0 110.057 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.45 -176.53 2.54 Favored 'Trans proline' 0 CA--C 1.547 1.14 0 C-N-CA 123.314 2.676 . . . . 0.0 110.496 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -104.22 40.94 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.256 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.84 -56.76 0.23 Allowed 'Trans proline' 0 C--N 1.355 0.875 0 CA-C-N 124.34 2.586 . . . . 0.0 113.096 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.57 -44.63 90.09 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.193 0.906 . . . . 0.0 108.824 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 t -53.07 -53.46 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 125.544 1.538 . . . . 0.0 110.504 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 7.4 t70 -63.53 -38.51 91.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.154 0.888 . . . . 0.0 111.44 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 21.5 t -62.89 -50.09 72.25 Favored 'General case' 0 N--CA 1.457 -0.119 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.4 t80 -62.14 -42.57 99.37 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -48.02 73.66 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.62 0.768 . . . . 0.0 110.011 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -69.66 -47.79 62.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.175 0.898 . . . . 0.0 110.672 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -55.7 -40.44 72.4 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.814 1.246 . . . . 0.0 111.231 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -80.64 -33.77 35.47 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 126.058 1.743 . . . . 0.0 110.611 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -60.5 -30.89 70.0 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.483 1.038 . . . . 0.0 108.671 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.3 -20.48 59.34 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.441 0.564 . . . . 0.0 111.956 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.01 -0.41 54.32 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.956 1.302 . . . . 0.0 112.014 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -135.38 178.75 6.79 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.264 1.826 . . . . 0.0 111.465 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.035 0 C-N-CA 125.946 1.698 . . . . 0.0 107.453 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 73.6 m . . . . . 0 CA--C 1.514 -0.405 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -95.73 -32.13 12.88 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -93.42 -50.66 5.34 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 62.8 160.92 0.09 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 127.162 2.185 . . . . 0.0 110.322 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -81.53 101.54 10.01 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.18 -1.575 . . . . 0.0 107.002 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.64 168.79 11.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.711 1.205 . . . . 0.0 108.602 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -133.26 138.28 46.39 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.919 1.288 . . . . 0.0 108.653 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.8 90.43 48.37 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 124.823 1.249 . . . . 0.0 111.966 -178.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.74 112.39 2.66 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 124.5 3.467 . . . . 0.0 111.806 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.7 t -144.71 152.96 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.554 1.141 . . . . 0.0 108.501 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -135.18 100.88 4.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.67 1.123 . . . . 0.0 108.858 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.99 124.21 1.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-O 116.343 -2.365 . . . . 0.0 107.356 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -66.16 -51.09 61.11 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 121.399 2.6 . . . . 0.0 110.055 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.02 -41.65 92.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.202 1.001 . . . . 0.0 111.035 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -64.81 -50.0 68.47 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.125 1.37 . . . . 0.0 108.692 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -56.92 -51.82 67.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.643 -0.694 . . . . 0.0 111.028 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -55.3 -54.87 38.05 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 124.159 0.912 . . . . 0.0 111.942 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.434 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 37.6 ttm -59.55 -50.45 73.85 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.488 0.315 . . . . 0.0 111.391 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.82 -41.69 91.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.854 0.862 . . . . 0.0 110.813 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.6 tt -68.05 -45.72 73.1 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.46 -40.16 81.91 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.949 0.795 . . . . 0.0 111.512 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mt -72.77 -43.64 60.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -59.26 -46.23 89.06 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.545 -0.722 . . . . 0.0 109.316 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -56.03 -55.21 35.57 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.935 1.694 . . . . 0.0 109.65 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 p -64.18 -44.32 92.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.04 -47.88 84.34 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 118.669 0.668 . . . . 0.0 109.88 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -62.13 -43.57 98.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.502 HD21 HG22 ' B' ' 130' ' ' VAL . 0.6 OUTLIER -55.02 -49.92 70.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 118.733 0.697 . . . . 0.0 111.324 -179.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.0 ttm -57.4 -37.17 72.29 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.72 -34.55 64.85 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.022 -1.049 . . . . 0.0 111.628 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.43 ' C ' HD22 ' A' ' 32' ' ' LEU . 32.0 m-85 -77.07 -30.85 55.71 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.606 1.094 . . . . 0.0 110.894 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.43 HD22 ' C ' ' A' ' 31' ' ' TYR . 2.6 mm? -123.96 69.12 46.94 Favored Pre-proline 0 CA--C 1.539 0.532 0 C-N-CA 126.68 1.992 . . . . 0.0 107.896 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -72.58 -6.26 18.72 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.331 2.021 . . . . 0.0 113.982 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -129.93 -47.38 1.13 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.982 -178.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -51.81 -51.9 53.05 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.447 1.099 . . . . 0.0 112.786 -178.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 m -61.73 -45.54 93.5 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.086 -1.008 . . . . 0.0 109.359 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 9.1 mm -63.47 -41.07 91.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 123.837 0.855 . . . . 0.0 110.578 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.9 -36.92 78.01 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.609 1.564 . . . . 0.0 109.726 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.5 m -68.52 -52.39 32.66 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -60.36 -36.07 77.16 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.309 1.044 . . . . 0.0 111.55 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -48.96 76.03 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.684 1.194 . . . . 0.0 108.712 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -67.22 -55.88 12.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 118.499 -0.762 . . . . 0.0 111.205 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -53.92 -54.76 34.28 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.425 1.09 . . . . 0.0 111.576 -178.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.421 HE22 ' NE2' ' A' ' 47' ' ' GLN . 22.2 tp60 -62.39 -39.55 93.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.516 -0.754 . . . . 0.0 111.373 -178.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -64.02 -49.81 70.94 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.833 0.742 . . . . 0.0 109.347 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -60.09 -44.89 94.48 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.798 0.726 . . . . 0.0 110.03 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.421 ' NE2' HE22 ' A' ' 44' ' ' GLN . 30.0 tt0 -58.7 -50.91 72.14 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.245 1.018 . . . . 0.0 109.47 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -63.76 -43.56 96.06 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.291 0.636 . . . . 0.0 110.963 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.59 -43.27 99.22 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.725 1.21 . . . . 0.0 110.729 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -65.02 -21.12 66.79 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.968 0.804 . . . . 0.0 112.503 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 37.8 tp -93.2 -46.5 7.38 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.755 1.222 . . . . 0.0 109.921 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.85 -55.73 15.55 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 124.63 1.172 . . . . 0.0 110.126 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 52.04 4.68 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 130.589 3.556 . . . . 0.0 115.599 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -112.3 154.14 26.12 Favored 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 127.118 2.167 . . . . 0.0 107.108 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -74.12 -52.19 13.31 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.8 m 56.94 78.56 0.22 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.272 1.429 . . . . 0.0 109.752 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.8 m -152.71 174.98 13.33 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.221 1.408 . . . . 0.0 108.078 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.4 mm -71.39 -18.05 20.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 124.134 0.974 . . . . 0.0 111.71 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -133.22 151.48 51.93 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 119.191 0.905 . . . . 0.0 109.403 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.9 m . . . . . 0 C--O 1.251 1.141 0 C-N-CA 124.83 1.252 . . . . 0.0 109.514 178.439 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.683 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 3.0 p -138.56 160.42 39.63 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -133.52 -46.25 0.82 Allowed 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 118.651 0.66 . . . . 0.0 109.673 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -73.08 -36.95 66.92 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 177.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 38.2 t0 65.74 -63.74 0.21 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 130.131 3.372 . . . . 0.0 108.476 -178.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 96.8 m -71.38 125.24 26.48 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 177.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -102.1 150.93 22.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -123.56 137.14 54.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.52 1.128 . . . . 0.0 109.777 -177.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 19.7 tp -139.68 149.83 44.16 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 123.387 0.675 . . . . 0.0 110.805 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -145.68 108.29 4.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.367 -2.457 . . . . 0.0 104.367 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 m -149.66 150.67 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 119.804 1.184 . . . . 0.0 112.153 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.42 102.14 10.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.67 114.42 0.82 Allowed Glycine 0 C--O 1.227 -0.316 0 CA-C-O 116.006 -2.552 . . . . 0.0 109.873 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -68.05 -57.44 6.12 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 122.489 3.144 . . . . 0.0 108.404 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -70.3 -49.88 45.06 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.14 -51.32 58.65 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.059 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -67.12 -36.52 82.08 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.958 1.254 . . . . 0.0 111.682 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -60.71 -54.14 48.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 120.003 1.274 . . . . 0.0 110.768 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.77 -51.08 71.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 125.745 1.618 . . . . 0.0 110.611 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.3 mt -60.41 -33.88 73.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.718 -179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -45.92 70.21 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.771 1.623 . . . . 0.0 108.212 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.45 ' HE3' ' HE2' ' C' 1018 ' ' MET . 29.1 ttpt -55.83 -49.49 73.13 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 30.7 mt -60.43 -36.34 77.96 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-O 119.009 -0.52 . . . . 0.0 110.97 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -59.99 4.46 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 119.477 1.035 . . . . 0.0 109.149 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -62.05 -43.81 98.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.619 -0.705 . . . . 0.0 111.423 -178.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 4.1 t -58.05 -45.29 87.27 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.405 1.002 . . . . 0.0 111.501 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -69.56 -46.34 66.63 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 117.846 -1.073 . . . . 0.0 109.679 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -57.01 -49.34 76.09 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.051 0.841 . . . . 0.0 109.939 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.51 -50.72 72.75 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 123.808 0.843 . . . . 0.0 110.726 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -69.6 -18.87 63.65 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -83.57 -47.38 11.36 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.034 1.334 . . . . 0.0 108.976 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.79 -32.67 72.56 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.699 -179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 77.6 t -92.76 144.51 28.71 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -67.61 -176.76 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.08 2.52 . . . . 0.0 111.274 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -111.5 48.37 0.29 Allowed Pre-proline 0 CA--C 1.551 1.0 0 N-CA-C 117.666 2.469 . . . . 0.0 117.666 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.93 -57.46 0.13 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.251 1.967 . . . . 0.0 113.782 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.7 tt -63.38 -31.96 73.26 Favored 'General case' 0 C--N 1.349 0.546 0 O-C-N 120.627 -1.296 . . . . 0.0 110.952 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.502 HG22 HD21 ' A' ' 28' ' ' LEU . 3.0 t -51.8 -56.78 4.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 C-N-CA 124.226 1.01 . . . . 0.0 111.943 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -73.9 -31.49 63.12 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.406 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.2 m -61.06 -47.88 84.32 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 122.398 1.094 . . . . 0.0 108.088 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -66.98 -38.36 85.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.466 1.506 . . . . 0.0 108.409 178.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -46.99 84.37 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.96 0.904 . . . . 0.0 109.188 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -59.03 -46.41 88.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -44.66 89.04 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.41 0.684 . . . . 0.0 110.906 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -35.36 73.71 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.169 0.987 . . . . 0.0 110.076 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -56.21 -40.31 73.85 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.2 -18.29 63.34 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.562 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp -72.58 -49.68 30.66 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.904 1.229 . . . . 0.0 110.154 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -140.91 105.97 4.98 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 126.207 1.803 . . . . 0.0 109.493 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ttt85 . . . . . 0 C--O 1.256 1.414 0 C-N-CA 124.045 0.938 . . . . 0.0 108.68 178.75 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -103.43 -7.67 20.77 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.342 1.057 . . . . 0.0 112.451 -177.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -108.71 -50.12 3.06 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.8 tp10 78.19 158.82 0.19 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 129.853 3.261 . . . . 0.0 110.727 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 33.7 tp -76.54 95.49 3.91 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 103.968 -2.605 . . . . 0.0 103.968 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 58.4 mt -89.54 124.64 34.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 124.35 1.06 . . . . 0.0 108.222 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -104.57 125.93 51.18 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 128.917 2.887 . . . . 0.0 108.1 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.95 92.01 19.75 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.244 1.417 . . . . 0.0 109.641 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.24 118.17 4.86 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.648 2.232 . . . . 0.0 107.501 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 22.0 t -145.15 155.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 119.706 1.139 . . . . 0.0 109.978 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -134.98 102.58 5.27 Favored 'General case' 0 C--N 1.343 0.312 0 O-C-N 121.214 -0.929 . . . . 0.0 109.134 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.37 116.83 0.7 Allowed Glycine 0 CA--C 1.519 0.31 0 CA-C-O 115.496 -2.836 . . . . 0.0 107.001 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.4 tpp85 -61.98 -51.82 66.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 121.697 2.749 . . . . 0.0 111.976 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -69.2 -41.07 77.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.868 0.758 . . . . 0.0 109.502 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -55.47 -46.49 76.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.3 t80 -65.57 -47.93 74.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.54 0.736 . . . . 0.0 109.998 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -53.18 -50.71 64.07 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.774 1.23 . . . . 0.0 110.69 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . 0.45 ' HE2' ' HE3' ' B' ' 114' ' ' LYS . 3.1 tmm? -69.33 -43.16 74.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.314 0.646 . . . . 0.0 111.41 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.12 -46.55 89.26 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.735 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.25 -46.33 81.01 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 119.268 0.94 . . . . 0.0 111.612 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -54.98 -44.46 74.47 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.111 0.868 . . . . 0.0 110.335 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.5 mt -72.63 -44.11 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.839 1.256 . . . . 0.0 111.166 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -57.77 -49.08 77.78 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.847 0.859 . . . . 0.0 109.34 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.25 -45.45 80.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 117.968 -1.015 . . . . 0.0 111.305 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 2.7 p -61.08 -40.6 94.3 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 120.328 1.422 . . . . 0.0 111.536 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 64.4 mt -67.87 -46.32 72.02 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.124 0.97 . . . . 0.0 109.471 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -62.18 -44.18 97.18 Favored 'General case' 0 C--O 1.224 -0.264 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . 0.525 HD13 HD23 ' C' 1032 ' ' LEU . 1.4 mm? -57.95 -44.3 86.88 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 119.12 0.873 . . . . 0.0 110.515 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 4.6 ttm -57.19 -36.07 70.37 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -76.96 -37.17 55.75 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.365 -1.302 . . . . 0.0 111.669 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . 0.468 ' C ' HD22 ' C' 1032 ' ' LEU . 52.5 m-85 -83.1 -19.59 36.47 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 120.942 1.701 . . . . 0.0 113.667 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . 0.525 HD23 HD13 ' C' 1028 ' ' LEU . 1.9 mm? -124.55 65.2 42.15 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 105.182 -2.155 . . . . 0.0 105.182 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -68.08 -20.15 44.45 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.838 2.359 . . . . 0.0 115.282 -178.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -121.78 -41.0 2.49 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 119.7 1.136 . . . . 0.0 111.56 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -52.26 -52.64 51.51 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.218 0.917 . . . . 0.0 113.371 -178.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.18 -43.18 96.08 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.126 -0.984 . . . . 0.0 110.373 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 13.0 mm -63.93 -34.33 67.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 124.369 1.068 . . . . 0.0 109.808 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -69.56 -44.34 71.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.246 1.018 . . . . 0.0 108.892 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.3 m -62.94 -46.74 86.32 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.1 t80 -59.24 -50.36 74.29 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.247 1.419 . . . . 0.0 111.226 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 tpp85 -56.43 -48.48 76.91 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.923 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -57.26 -55.73 31.03 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 119.313 0.96 . . . . 0.0 109.585 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.96 -54.36 39.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.846 1.259 . . . . 0.0 112.968 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -65.23 -47.01 78.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.118 1.367 . . . . 0.0 111.592 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -56.62 -47.17 80.26 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.589 1.156 . . . . 0.0 108.231 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -61.64 -54.34 44.15 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.576 1.15 . . . . 0.0 110.471 178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -53.72 -53.43 52.19 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 125.086 1.354 . . . . 0.0 112.003 -178.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 8.6 t60 -68.61 -43.85 75.53 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.654 -0.688 . . . . 0.0 111.605 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -61.15 -38.95 88.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 119.885 1.221 . . . . 0.0 110.806 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -70.45 -20.17 62.91 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.831 0.452 . . . . 0.0 112.007 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 41.5 tp -85.04 -44.79 12.73 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.366 1.066 . . . . 0.0 109.939 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 57.2 tp -76.55 -51.28 11.98 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 123.559 0.744 . . . . 0.0 110.326 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 34.2 tt0 52.05 15.7 0.45 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.835 2.454 . . . . 0.0 114.234 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 31.0 mttp -131.95 121.43 23.95 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 125.506 1.523 . . . . 0.0 107.421 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -45.43 -42.91 10.88 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.691 1.196 . . . . 0.0 112.975 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 3.8 m 46.38 78.64 0.07 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.774 2.03 . . . . 0.0 111.822 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 68.6 m -150.86 172.48 15.57 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.915 1.286 . . . . 0.0 107.699 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 33.8 mm -69.41 -11.58 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 C-N-CA 124.081 0.952 . . . . 0.0 111.306 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -139.55 158.41 44.18 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.201 1.401 . . . . 0.0 108.828 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.407 1.483 . . . . 0.0 108.309 178.13 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.525 0 N-CA-C 108.554 -1.818 . . . . 0.0 108.554 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 14.4 p -68.68 141.78 55.23 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -88.39 -59.34 2.26 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -87.9 -27.43 22.18 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . 0.283 12.5 t70 68.67 -56.35 0.52 Allowed 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 129.39 3.076 . . . . 0.0 110.139 -177.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.17 140.67 32.44 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 126.347 1.859 . . . . 0.0 107.581 177.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -131.4 158.33 41.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.846 1.258 . . . . 0.0 109.069 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -124.44 160.58 27.9 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.152 1.381 . . . . 0.0 110.352 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 13.4 tp -159.88 139.01 10.93 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.585 1.154 . . . . 0.0 108.496 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -138.97 98.07 3.45 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 30.4 m -145.45 151.72 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 O-C-N 120.683 -1.26 . . . . 0.0 114.254 -176.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.14 103.48 12.69 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.45 100.56 0.24 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 103.661 -3.776 . . . . 0.0 103.661 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -61.82 -57.49 11.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 122.474 3.137 . . . . 0.0 112.803 -178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 6.5 mttp -66.34 -38.73 88.33 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.376 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.5 m120 -59.39 -51.76 68.51 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 117.67 -1.157 . . . . 0.0 111.36 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . 0.413 ' CZ ' ' HG3' ' D' 1113 ' ' MET . 84.2 t80 -60.84 -42.1 97.13 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 120.247 1.385 . . . . 0.0 110.333 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.45 -53.71 52.9 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.469 0.652 . . . . 0.0 110.068 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.96 -54.04 39.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 125.562 1.545 . . . . 0.0 110.607 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.11 -38.86 74.02 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.488 1.515 . . . . 0.0 111.186 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . 0.413 ' HG3' ' CZ ' ' D' 1109 ' ' PHE . 0.0 OUTLIER -71.74 -43.99 64.86 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.213 1.369 . . . . 0.0 109.577 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . 0.434 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 8.8 ttpt -56.9 -44.74 82.66 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 68.9 mt -63.46 -36.09 82.6 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.869 0.868 . . . . 0.0 111.248 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -60.03 4.47 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.215 -0.928 . . . . 0.0 108.68 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -64.4 -29.37 70.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.368 0.267 . . . . 0.0 111.081 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 17.8 t -64.45 -47.68 78.17 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.842 0.747 . . . . 0.0 110.088 178.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.51 -44.3 58.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 116.959 -1.496 . . . . 0.0 111.979 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -59.28 -41.24 88.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.952 1.705 . . . . 0.0 110.827 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.1 mm? -66.33 -50.6 63.04 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 3.5 ttt -61.76 -27.4 68.7 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 119.065 -0.493 . . . . 0.0 111.31 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -78.6 -37.07 43.33 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.345 1.458 . . . . 0.0 111.773 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -79.43 -27.9 41.71 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 118.362 -0.828 . . . . 0.0 112.257 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.25 147.14 33.98 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-N 118.735 0.698 . . . . 0.0 109.988 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.92 -175.16 0.55 Allowed 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.243 2.629 . . . . 0.0 109.378 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.272 7.2 pt20 -111.63 51.18 0.34 Allowed Pre-proline 0 CA--C 1.557 1.232 0 O-C-N 120.039 -1.663 . . . . 0.0 114.425 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.42 -65.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.462 2.775 . . . . 0.0 113.127 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.4 tt -64.15 -30.43 71.49 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.708 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -58.92 -55.79 21.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.814 1.246 . . . . 0.0 110.367 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 45.2 t0 -63.63 -40.71 97.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.649 0.659 . . . . 0.0 110.483 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 19.9 m -60.13 -50.4 73.84 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.327 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.7 t80 -62.96 -42.92 99.97 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.89 1.276 . . . . 0.0 110.39 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -45.61 70.44 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -69.03 -52.88 24.02 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.577 0.751 . . . . 0.0 110.512 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -50.47 -47.51 57.04 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.027 1.731 . . . . 0.0 111.183 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.72 -38.99 62.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.547 1.139 . . . . 0.0 109.281 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.5 -32.39 39.92 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.495 1.043 . . . . 0.0 110.882 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -56.98 -23.55 46.72 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 118.684 0.675 . . . . 0.0 112.171 177.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 32.2 tp -77.38 -40.95 41.96 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.485 1.493 . . . . 0.0 112.898 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -137.65 107.3 6.21 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 125.477 1.511 . . . . 0.0 107.598 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 . . . . . 0 C--O 1.252 1.219 0 C-N-CA 123.672 0.789 . . . . 0.0 110.464 -179.675 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.2 m . . . . . 0 N--CA 1.463 0.202 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -102.87 -83.77 0.47 Allowed 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.64 -35.5 11.58 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.447 0.699 . . . . 0.0 111.785 -179.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 76.01 167.93 0.27 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 127.239 2.215 . . . . 0.0 110.582 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.3 tp -79.38 95.24 5.69 Favored 'General case' 0 C--N 1.339 0.143 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.1 mt -95.52 140.73 29.94 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -112.21 144.11 42.15 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.774 1.63 . . . . 0.0 107.902 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.4 tp -130.39 94.04 30.99 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 124.596 1.158 . . . . 0.0 109.546 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -78.58 121.26 5.07 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 109.356 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.4 t -144.78 156.08 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 120.03 1.286 . . . . 0.0 108.719 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -133.03 102.17 5.5 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.99 110.58 0.41 Allowed Glycine 0 C--O 1.219 -0.84 0 CA-C-O 115.839 -2.645 . . . . 0.0 107.526 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -51.32 65.29 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 122.94 3.37 . . . . 0.0 109.1 178.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -67.05 -46.84 73.14 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -36.85 84.8 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.925 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -71.11 -43.9 66.73 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 120.189 1.359 . . . . 0.0 108.672 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.14 -49.8 76.21 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.511 1.051 . . . . 0.0 109.308 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 11.4 ttp -57.22 -46.77 82.62 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.882 0.473 . . . . 0.0 109.82 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.54 -38.97 93.17 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 123.921 0.888 . . . . 0.0 110.027 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.37 -47.13 71.29 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 119.297 0.953 . . . . 0.0 109.718 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -48.95 74.01 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.582 0.753 . . . . 0.0 110.501 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 67.3 mt -73.01 -33.45 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.185 0.994 . . . . 0.0 110.957 -178.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -67.58 -56.9 7.62 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.57 -38.94 72.64 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.058 2.143 . . . . 0.0 110.426 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 t -61.19 -52.52 64.48 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 118.405 -0.807 . . . . 0.0 110.838 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -39.27 61.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.012 0.824 . . . . 0.0 111.851 -178.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.79 -54.47 46.72 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.08 0.952 . . . . 0.0 110.827 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -69.21 -41.45 77.05 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 117.97 -1.015 . . . . 0.0 110.264 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -57.86 -38.99 76.68 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.247 0.931 . . . . 0.0 110.668 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -79.53 -20.63 46.66 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 118.328 0.513 . . . . 0.0 110.119 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -82.59 -39.56 22.06 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.984 -1.072 . . . . 0.0 112.103 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.3 tp -122.38 76.06 43.66 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.876 1.67 . . . . 0.0 109.933 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -78.13 73.92 5.55 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 123.516 2.811 . . . . 0.0 111.914 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.86 170.49 2.05 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 121.177 -0.952 . . . . 0.0 109.273 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -60.6 -24.61 65.62 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.5 m -54.8 -51.16 66.65 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.165 2.186 . . . . 0.0 109.031 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.48 -45.87 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 125.607 1.563 . . . . 0.0 109.733 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.97 -55.6 32.06 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.817 0.447 . . . . 0.0 111.845 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -62.0 -43.01 99.74 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.42 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -58.02 -49.55 76.48 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 119.494 1.043 . . . . 0.0 108.9 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.97 -48.2 82.69 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.193 1.397 . . . . 0.0 111.725 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -59.85 -56.55 20.36 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.477 1.111 . . . . 0.0 110.091 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -58.48 -43.95 89.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.155 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -52.86 -46.75 68.01 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.163 0.985 . . . . 0.0 111.95 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.12 -53.9 38.11 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.009 0.524 . . . . 0.0 111.016 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -62.1 -32.66 73.24 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.011 0.434 . . . . 0.0 110.84 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -66.78 -45.58 78.02 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.648 1.579 . . . . 0.0 109.951 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -53.93 -50.52 66.25 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.163 0.892 . . . . 0.0 111.083 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -58.16 -29.85 65.9 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -83.74 -46.4 12.29 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.15 0.98 . . . . 0.0 111.044 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 6.0 mp -58.23 -55.46 34.67 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 124.568 1.147 . . . . 0.0 111.082 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 52.4 tp -53.8 -75.59 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.305 1.442 . . . . 0.0 113.606 -178.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -158.13 151.46 23.2 Favored 'General case' 0 C--N 1.339 0.134 0 O-C-N 121.347 -0.846 . . . . 0.0 112.028 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -77.49 -25.53 50.49 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.963 0.905 . . . . 0.0 110.203 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -169.27 -65.99 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 129.336 3.055 . . . . 0.0 104.503 178.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 14.4 t -164.52 165.86 20.9 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.008 2.123 . . . . 0.0 106.314 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.9 m 33.49 -152.96 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 129.196 2.998 . . . . 0.0 116.146 178.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.7 pt -78.34 -30.26 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 124.826 1.25 . . . . 0.0 109.888 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -146.36 159.28 43.57 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 129.146 2.978 . . . . 0.0 105.685 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 54.7 p . . . . . 0 C--O 1.255 1.348 0 CA-C-O 113.64 -3.076 . . . . 0.0 104.289 179.403 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.542 0 N-CA-C 111.399 -0.681 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 2.0 t -174.61 -176.33 1.04 Allowed 'General case' 0 C--O 1.236 0.352 0 C-N-CA 126.998 2.119 . . . . 0.0 107.162 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.52 159.99 29.87 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 104.438 -2.43 . . . . 0.0 104.438 176.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -131.4 18.98 4.81 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 124.5 1.12 . . . . 0.0 110.152 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -132.33 153.07 51.1 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.799 0.839 . . . . 0.0 109.78 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.7 m -79.2 158.05 27.72 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -106.03 150.68 25.51 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -128.58 140.15 51.93 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.511 1.125 . . . . 0.0 110.718 -178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.5 mt -133.21 110.12 9.9 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -110.29 98.59 7.8 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 128.503 2.721 . . . . 0.0 105.808 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -154.41 151.17 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.226 1.41 . . . . 0.0 109.012 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.33 101.27 7.27 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.685 0.675 . . . . 0.0 110.813 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.19 105.42 0.39 Allowed Glycine 0 C--O 1.228 -0.28 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -53.79 -54.15 42.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 121.586 2.693 . . . . 0.0 112.918 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -59.89 -40.65 89.45 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.868 0.758 . . . . 0.0 109.854 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -60.18 -50.58 73.13 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.154 -0.926 . . . . 0.0 110.539 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . 0.415 ' CD2' ' HB3' ' D' 1099 ' ' TYR . 31.8 t80 -54.33 -46.04 72.8 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 119.256 0.935 . . . . 0.0 111.194 -178.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -61.74 -53.74 51.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.34 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 45.2 mt -58.05 -52.54 57.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.985 1.714 . . . . 0.0 110.543 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 73.6 mt -65.76 -32.28 73.73 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.154 1.381 . . . . 0.0 111.885 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 24.3 mtp -68.24 -54.56 16.85 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.85 1.205 . . . . 0.0 109.433 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -60.71 -35.95 77.62 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.674 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.95 -54.77 11.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 117.836 -1.078 . . . . 0.0 110.697 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 5.3 tptp -58.16 -40.83 82.42 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 121.059 1.754 . . . . 0.0 110.018 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.5 -58.53 7.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 126.322 1.849 . . . . 0.0 106.39 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 90.2 p -57.68 -36.16 71.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.3 -42.77 65.11 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.17 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -64.84 -40.03 94.52 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.012 1.278 . . . . 0.0 107.583 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 44.6 mt -64.24 -46.16 85.0 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.026 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -71.2 -19.08 62.43 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.312 0.96 . . . . 0.0 110.7 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -89.08 -42.79 11.51 Favored 'General case' 0 C--N 1.343 0.323 0 O-C-N 121.01 -1.056 . . . . 0.0 113.225 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -76.3 -33.01 59.07 Favored 'General case' 0 N--CA 1.457 -0.086 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.0 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -95.5 147.56 33.2 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 178.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -71.68 177.89 6.36 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.508 1.472 . . . . 0.0 110.382 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -112.17 50.85 0.37 Allowed Pre-proline 0 CA--C 1.554 1.099 0 O-C-N 121.08 -1.013 . . . . 0.0 112.389 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.37 -57.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.732 2.288 . . . . 0.0 113.292 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.2 tt -65.33 -33.52 76.16 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 119.992 1.269 . . . . 0.0 109.206 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 40.2 t -54.36 -56.33 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.851 1.661 . . . . 0.0 109.228 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.59 -47.35 85.88 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.81 0.844 . . . . 0.0 111.233 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 30.1 t -54.75 -50.78 67.58 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 0.0 110.442 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -68.55 -44.08 75.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.87 1.268 . . . . 0.0 111.019 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -54.96 -46.0 74.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 118.822 0.737 . . . . 0.0 109.729 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -65.81 -49.63 67.54 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.448 0.567 . . . . 0.0 110.917 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -57.28 -44.77 84.29 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.229 0.612 . . . . 0.0 111.673 -179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.69 -29.82 61.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.882 0.873 . . . . 0.0 109.547 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -61.75 -32.83 73.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.07 -6.0 3.62 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.07 1.348 . . . . 0.0 113.021 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 4.7 tt -76.5 -49.34 16.75 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -90.93 178.2 6.09 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.923 2.089 . . . . 0.0 111.328 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 117.644 -1.17 . . . . 0.0 108.815 -179.65 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.468 0.448 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.87 -74.12 0.41 Allowed 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -100.88 -50.48 3.82 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.867 0.758 . . . . 0.0 109.976 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.5 tp10 75.24 163.84 0.26 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 127.503 2.321 . . . . 0.0 110.894 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 67.2 tp -78.47 95.21 5.08 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 42.8 mt -90.52 153.75 20.13 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -123.29 142.31 51.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.584 1.154 . . . . 0.0 108.921 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 41.7 tp -134.11 94.89 17.43 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 124.11 0.964 . . . . 0.0 111.182 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.18 130.03 9.05 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.432 2.755 . . . . 0.0 109.964 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 2.4 t -145.78 152.04 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.602 1.161 . . . . 0.0 108.478 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -134.91 101.83 5.03 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 177.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.57 117.01 0.7 Allowed Glycine 0 CA--C 1.519 0.328 0 N-CA-C 105.402 -3.079 . . . . 0.0 105.402 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -52.41 58.85 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 122.067 2.934 . . . . 0.0 110.968 -179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -68.95 -41.14 78.43 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 54.0 m -58.27 -48.03 81.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 118.316 -0.849 . . . . 0.0 109.964 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.4 t80 -58.54 -50.59 73.21 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 119.147 0.885 . . . . 0.0 110.145 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.0 -48.8 78.72 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 16.3 ttt -58.69 -49.34 77.93 Favored 'General case' 0 N--CA 1.46 0.066 0 C-N-CA 124.754 1.222 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.86 -50.28 73.85 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.385 1.074 . . . . 0.0 109.132 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -55.86 28.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.011 0.924 . . . . 0.0 111.15 -179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -55.6 -48.52 74.75 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.676 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 76.7 mt -67.0 -43.93 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.669 -0.644 . . . . 0.0 111.176 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -64.16 -52.28 59.77 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 123.786 0.835 . . . . 0.0 111.539 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -66.92 -35.11 79.25 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.258 1.023 . . . . 0.0 110.044 -179.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 4.8 t -56.05 -51.77 66.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -48.27 80.17 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 123.193 0.308 . . . . 0.0 110.663 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -57.06 -54.62 44.68 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.51 0.724 . . . . 0.0 111.989 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.43 -41.4 84.87 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 119.342 0.974 . . . . 0.0 112.344 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.4 -44.6 92.8 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 -22.99 46.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.733 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 t80 -79.14 -33.45 44.16 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.117 1.326 . . . . 0.0 111.311 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 49.8 tp -129.1 74.22 81.26 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -77.55 77.83 3.73 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.166 2.577 . . . . 0.0 110.57 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . 0.495 ' N ' HD13 ' C' 1037 ' ' ILE . 53.8 mt-30 -63.51 174.55 1.27 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.349 1.46 . . . . 0.0 109.875 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 38.3 m80 -54.99 -32.83 62.02 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.245 -0.91 . . . . 0.0 112.934 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.6 m -61.27 -49.39 77.27 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 120.117 1.326 . . . . 0.0 109.451 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . 0.608 ' H ' HD12 ' C' 1037 ' ' ILE . 2.2 mp -59.21 -42.95 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 126.342 1.857 . . . . 0.0 109.526 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.73 -59.41 4.93 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.676 1.19 . . . . 0.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.3 m -60.1 -52.74 64.05 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.153 1.381 . . . . 0.0 111.897 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.27 -50.33 69.8 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.466 0.706 . . . . 0.0 112.37 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -61.13 -44.7 96.94 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 118.887 0.767 . . . . 0.0 111.641 -179.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -61.93 -48.91 78.32 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -64.55 -36.24 83.56 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-O 116.984 -1.484 . . . . 0.0 111.127 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 11.5 tp60 -60.46 -42.33 95.95 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 120.92 1.691 . . . . 0.0 108.239 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -47.6 84.89 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 118.997 0.817 . . . . 0.0 110.598 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -68.94 -54.11 17.2 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 123.41 0.444 . . . . 0.0 110.647 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -55.75 -42.59 75.62 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 126.23 1.812 . . . . 0.0 111.294 -179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -52.87 -49.77 65.16 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.115 1.325 . . . . 0.0 109.112 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -57.06 -43.46 82.05 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.14 0.976 . . . . 0.0 110.864 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -72.21 -43.63 64.19 Favored 'General case' 0 C--O 1.234 0.268 0 O-C-N 121.787 -0.57 . . . . 0.0 112.523 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.93 -23.07 66.12 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.091 1.356 . . . . 0.0 111.873 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 11.2 tp -74.18 -79.03 0.09 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -167.88 179.69 4.6 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.236 1.414 . . . . 0.0 109.424 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.43 -48.75 5.45 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -138.51 -78.57 0.35 Allowed 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 103.604 -2.739 . . . . 0.0 103.604 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 12.5 t -157.51 172.46 18.52 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.348 1.059 . . . . 0.0 108.287 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 6.4 m 25.33 -107.82 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 131.546 3.938 . . . . 0.0 112.904 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 42.4 pt -122.61 -24.09 2.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.143 1.377 . . . . 0.0 111.202 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -146.15 159.18 43.66 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 128.528 2.731 . . . . 0.0 105.527 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 46.5 p . . . . . 0 C--O 1.255 1.393 0 CA-C-O 113.921 -2.942 . . . . 0.0 105.6 179.819 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.85 0 N-CA-C 108.983 -1.647 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 2.1 t -149.89 169.87 20.13 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 105.204 -2.147 . . . . 0.0 105.204 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.91 147.42 50.36 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -108.33 21.63 17.05 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 126.029 1.732 . . . . 0.0 111.842 -178.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 1.4 t0 -138.02 164.87 27.98 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 113.442 0.905 . . . . 0.0 113.442 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 80.6 m -86.86 167.24 14.52 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.009 1.723 . . . . 0.0 111.12 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . 0.415 ' HB3' ' CD2' ' B' ' 109' ' ' PHE . 67.8 m-85 -120.38 143.12 48.59 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -126.83 142.94 51.41 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.777 1.231 . . . . 0.0 110.677 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 90.4 mt -129.86 140.97 50.89 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -136.87 98.44 3.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.423 1.077 . . . . 0.0 108.117 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.6 m -153.19 151.51 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.944 1.298 . . . . 0.0 111.671 -177.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.33 102.79 10.18 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.374 0.988 . . . . 0.0 111.604 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.25 116.81 0.99 Allowed Glycine 0 C--O 1.229 -0.168 0 CA-C-O 115.636 -2.758 . . . . 0.0 107.886 177.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.78 -56.93 11.81 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 122.521 3.16 . . . . 0.0 111.592 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.84 -43.8 97.83 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 14.7 m120 -54.13 -47.88 71.39 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 117.671 -1.156 . . . . 0.0 112.038 -178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 9.1 t80 -64.5 -46.25 83.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.524 1.056 . . . . 0.0 109.856 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -57.98 -52.39 65.7 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.537 1.062 . . . . 0.0 111.408 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.16 -48.61 84.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 126.971 2.108 . . . . 0.0 111.825 -178.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 53.8 mt -67.72 -36.14 80.06 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.901 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 68.8 mtp -65.45 -53.2 46.32 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 119.999 1.272 . . . . 0.0 109.729 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -56.37 -40.72 75.01 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.359 0.981 . . . . 0.0 111.276 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 38.6 mt -74.24 -41.0 62.03 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . 0.568 ' HZ1' ' HG2' ' D' 1120 ' ' GLU . 3.1 tptp -65.7 -43.44 89.17 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.476 -1.39 . . . . 0.0 107.941 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -59.47 -52.86 63.76 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.482 1.513 . . . . 0.0 108.021 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 84.2 p -60.6 -34.64 74.53 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.008 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . 0.42 HD13 ' HA ' ' D' 1119 ' ' LEU . 0.8 OUTLIER -69.07 -36.98 78.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.233 0.924 . . . . 0.0 109.489 179.035 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . 0.568 ' HG2' ' HZ1' ' D' 1116 ' ' LYS . 0.6 OUTLIER -64.71 -52.48 56.9 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.238 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 43.3 mt -57.8 -47.12 83.49 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.135 1.774 . . . . 0.0 112.122 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.0 ppp? -76.49 -24.61 53.78 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 120.074 1.306 . . . . 0.0 112.749 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -80.44 -42.9 21.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.115 0.87 . . . . 0.0 110.049 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.3 -32.24 38.07 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 -178.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.77 149.07 35.86 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.766 1.226 . . . . 0.0 107.916 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -65.36 167.95 15.52 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 121.339 1.359 . . . . 0.0 110.954 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -118.79 57.05 3.1 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 124.507 1.123 . . . . 0.0 113.113 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -70.51 -64.06 0.04 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.25 2.633 . . . . 0.0 112.826 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 6.7 tt -58.81 -33.78 70.76 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.868 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.8 t -52.2 -53.52 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 C-N-CA 124.154 0.982 . . . . 0.0 110.054 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 35.5 t0 -70.52 -41.17 72.91 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.202 0.91 . . . . 0.0 111.47 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 14.5 t -54.82 -49.82 70.07 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.16 -49.72 63.73 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.423 1.489 . . . . 0.0 109.8 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 3.9 tmm_? -53.53 -45.91 69.96 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.216 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.67 -49.18 69.55 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 120.525 1.511 . . . . 0.0 110.236 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -52.03 -49.26 63.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.125 1.37 . . . . 0.0 109.242 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -39.68 75.24 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 127.138 2.175 . . . . 0.0 111.173 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -59.94 -28.09 67.33 Favored 'General case' 0 N--CA 1.462 0.156 0 O-C-N 120.988 -1.07 . . . . 0.0 109.651 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.16 -19.71 47.42 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.506 0.722 . . . . 0.0 111.076 177.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.44 -54.44 20.31 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.17 1.388 . . . . 0.0 110.332 179.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -92.34 155.05 18.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.635 0.652 . . . . 0.0 112.307 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 33.1 mtp85 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 116.625 -1.655 . . . . 0.0 107.343 178.688 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 120.394 0.14 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -60.39 -9.38 3.51 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 126.458 1.903 . . . . 0.0 114.655 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -80.24 31.6 0.28 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.11 1.364 . . . . 0.0 109.776 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -74.51 104.0 5.05 Favored 'General case' 0 CA--C 1.521 -0.149 0 O-C-N 119.508 -1.995 . . . . 0.0 109.618 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -66.19 96.43 0.34 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 125.785 1.634 . . . . 0.0 109.121 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.2 mt -88.88 143.73 26.69 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -103.79 100.69 10.5 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 30.7 tp -92.11 107.36 22.48 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 128.468 2.707 . . . . 0.0 108.217 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -85.16 129.68 3.88 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.218 2.612 . . . . 0.0 110.767 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 t -145.43 150.62 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.92 1.236 . . . . 0.0 110.867 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -136.43 102.24 4.9 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.95 128.1 1.63 Allowed Glycine 0 N--CA 1.459 0.208 0 CA-C-O 114.845 -3.197 . . . . 0.0 107.765 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -52.97 17.64 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 122.791 3.295 . . . . 0.0 109.898 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.35 -33.79 76.51 Favored 'General case' 0 C--N 1.343 0.29 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.6 m -60.48 -50.26 74.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.287 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.95 -46.42 87.81 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.217 -178.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -59.24 -52.37 65.95 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.413 0.551 . . . . 0.0 111.067 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 34.6 ttm -59.12 -52.0 67.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.245 1.018 . . . . 0.0 109.215 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.7 mp -60.8 -30.72 70.23 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.78 0.718 . . . . 0.0 111.015 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -55.77 7.74 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 119.197 0.908 . . . . 0.0 108.849 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.14 -39.04 92.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 114.141 1.163 . . . . 0.0 114.141 -178.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.478 HG23 HD22 ' B' ' 115' ' ' LEU . 29.4 mt -62.13 -47.6 92.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 178.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.41 -58.04 9.82 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -51.97 -39.29 59.1 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 126.358 1.863 . . . . 0.0 113.386 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 p -69.02 -51.16 42.12 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.675 0.671 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 tt -62.83 -50.65 70.14 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 124.614 1.166 . . . . 0.0 111.553 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.91 -53.99 48.34 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.33 1.052 . . . . 0.0 110.79 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.34 -35.81 76.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.562 0.619 . . . . 0.0 111.365 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.96 -27.03 68.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.509 1.05 . . . . 0.0 110.529 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -92.77 -28.26 16.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.791 -0.568 . . . . 0.0 109.848 178.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -75.46 -29.92 59.78 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.145 0.884 . . . . 0.0 110.65 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -114.78 75.86 3.93 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.677 1.591 . . . . 0.0 107.771 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -76.09 73.69 4.83 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.966 3.111 . . . . 0.0 110.424 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.98 159.92 27.44 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.968 -1.083 . . . . 0.0 109.471 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -54.4 -34.51 61.43 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.56 -0.733 . . . . 0.0 111.104 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.0 m -59.3 -45.15 92.09 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.614 1.097 . . . . 0.0 110.106 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.47 -49.66 82.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 C-N-CA 125.384 1.474 . . . . 0.0 108.148 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.34 -41.57 96.71 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.2 m -60.88 -50.22 74.29 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.11 -43.16 77.87 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.627 0.771 . . . . 0.0 110.287 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -49.38 78.01 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.86 -0.525 . . . . 0.0 110.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -65.52 -50.39 65.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.948 0.899 . . . . 0.0 110.899 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -54.93 36.82 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.543 1.137 . . . . 0.0 110.596 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? -64.91 -32.9 74.84 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.886 1.221 . . . . 0.0 112.734 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.47 -47.77 74.93 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 118.762 0.71 . . . . 0.0 109.159 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -66.27 -48.12 71.47 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.434 1.094 . . . . 0.0 109.502 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -52.67 -33.85 49.07 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 126.027 1.731 . . . . 0.0 112.342 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -57.69 -23.99 54.48 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.979 -0.451 . . . . 0.0 111.066 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -70.81 -38.98 73.35 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 125.971 1.709 . . . . 0.0 111.306 178.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -92.69 -3.88 54.14 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.185 0.994 . . . . 0.0 113.294 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.7 tt -43.03 -35.43 1.26 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 128.472 2.709 . . . . 0.0 114.4 -177.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 52.6 tp -47.4 -32.14 4.71 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.229 1.812 . . . . 0.0 112.758 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 17.38 102.33 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 130.243 3.417 . . . . 0.0 113.97 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -57.46 164.08 2.08 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.746 0.818 . . . . 0.0 110.863 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -66.08 69.59 0.06 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 127.428 2.291 . . . . 0.0 110.582 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -148.46 90.47 1.8 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.835 2.854 . . . . 0.0 104.459 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -63.52 112.61 2.86 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.61 1.564 . . . . 0.0 111.337 -179.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 8.9 tp -152.91 -10.88 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.468 0.707 . . . . 0.0 112.505 179.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -60.72 108.39 0.84 Allowed 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.093 0.861 . . . . 0.0 110.772 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 C--O 1.25 1.089 0 C-N-CA 128.627 2.771 . . . . 0.0 103.822 179.6 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.622 0 CA-C-O 121.383 0.435 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 9.1 p -135.95 -55.81 0.77 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.065 1.346 . . . . 0.0 109.844 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 49.74 67.6 0.87 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.8 2.04 . . . . 0.0 108.314 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -106.22 -4.32 20.33 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.756 2.022 . . . . 0.0 114.17 -178.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -80.64 35.86 0.37 Allowed 'General case' 0 CA--C 1.545 0.769 0 O-C-N 120.707 -1.246 . . . . 0.0 110.68 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 9.1 m -52.77 143.73 15.86 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.606 2.362 . . . . 0.0 114.443 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -109.8 140.03 44.18 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.42 145.94 49.84 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 127.466 2.306 . . . . 0.0 107.867 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.633 HD22 ' HE2' ' D' 1116 ' ' LYS . 50.0 mt -147.94 150.16 33.54 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.772 0.829 . . . . 0.0 109.052 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.02 107.63 4.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.524 -1.227 . . . . 0.0 110.43 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.9 t -155.13 144.82 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 119.879 1.218 . . . . 0.0 109.374 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.06 103.85 15.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -141.38 112.75 0.79 Allowed Glycine 0 C--O 1.227 -0.307 0 N-CA-C 106.985 -2.446 . . . . 0.0 106.985 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 46.3 tpt85 -65.22 -59.21 4.32 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 120.991 2.396 . . . . 0.0 112.068 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -71.67 -42.02 68.0 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.16 -50.81 61.07 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 125.639 1.576 . . . . 0.0 110.468 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.31 -41.04 85.99 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.822 1.192 . . . . 0.0 110.322 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.85 -52.44 62.78 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.491 1.042 . . . . 0.0 109.134 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 56.2 mt -57.08 -57.88 8.14 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 C-N-CA 127.205 2.202 . . . . 0.0 110.118 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 mp -55.26 -54.01 48.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.571 1.148 . . . . 0.0 110.869 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 7.3 ttp -59.84 -45.12 93.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.356 0.98 . . . . 0.0 111.417 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -56.31 -52.43 64.55 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.897 0.879 . . . . 0.0 109.934 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.478 HD22 HG23 ' A' ' 22' ' ' ILE . 78.4 mt -70.49 -30.0 66.68 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . 0.463 ' HD2' HG21 ' D' 1103 ' ' VAL . 29.3 ttpp -58.81 -60.04 4.48 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.43 -45.27 80.84 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 124.201 0.938 . . . . 0.0 110.688 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 66.7 m -60.48 -44.06 96.32 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 118.034 -0.984 . . . . 0.0 113.389 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -38.21 63.01 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.894 1.224 . . . . 0.0 109.458 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -55.35 -52.81 62.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.798 0.808 . . . . 0.0 109.396 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.08 -42.41 94.13 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.452 -1.261 . . . . 0.0 109.288 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.52 -31.08 70.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.338 0.972 . . . . 0.0 111.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -77.09 -40.02 47.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.828 0.74 . . . . 0.0 110.013 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 26.7 tp -76.61 -22.46 54.15 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 33.3 m -94.5 147.61 33.54 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 119.848 1.203 . . . . 0.0 109.334 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.54 177.4 7.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 121.883 1.722 . . . . 0.0 108.639 178.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -112.09 56.58 0.47 Allowed Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 121.056 -1.028 . . . . 0.0 113.013 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.5 -72.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.584 2.19 . . . . 0.0 110.544 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.17 -36.91 85.18 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.8 t -54.29 -56.16 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 125.029 1.331 . . . . 0.0 111.597 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.18 -44.94 90.46 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.161 1.346 . . . . 0.0 111.497 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 17.4 t -57.83 -47.0 83.89 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -68.25 -35.63 78.21 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.235 1.414 . . . . 0.0 109.684 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 23.0 ttm-85 -55.46 -48.95 73.71 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.229 1.377 . . . . 0.0 108.834 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -69.72 -51.64 32.51 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.905 0.882 . . . . 0.0 111.631 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -51.11 -49.07 61.45 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.861 0.864 . . . . 0.0 110.068 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.26 -37.54 71.94 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.527 1.131 . . . . 0.0 110.579 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -57.13 -27.62 61.99 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.172 0.989 . . . . 0.0 110.6 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.25 -12.97 57.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.778 0.717 . . . . 0.0 112.186 177.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.66 2.8 35.82 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.943 -1.098 . . . . 0.0 111.045 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -133.1 177.45 7.65 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 126.009 1.724 . . . . 0.0 108.232 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 . . . . . 0 C--O 1.249 1.058 0 C-N-CA 125.12 1.368 . . . . 0.0 108.929 -179.711 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.474 0.74 0 CA-C-O 121.126 0.488 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -103.87 33.71 3.31 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 130.057 3.343 . . . . 0.0 109.26 -178.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -118.13 39.28 3.44 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.755 1.222 . . . . 0.0 109.206 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -67.15 113.88 5.45 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 178.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 7.6 tt -79.37 98.88 6.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.147 1.379 . . . . 0.0 108.528 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.2 mt -87.64 152.74 21.93 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 126.125 1.77 . . . . 0.0 107.138 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -115.15 100.07 7.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 23.6 tp -82.04 108.57 11.84 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.455 1.502 . . . . 0.0 108.932 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -93.74 103.43 0.14 Allowed 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 124.772 3.648 . . . . 0.0 110.923 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 68.0 t -136.39 159.18 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 120.759 -1.213 . . . . 0.0 110.641 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -135.52 102.2 5.05 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.51 130.97 2.22 Favored Glycine 0 CA--C 1.517 0.176 0 CA-C-O 115.538 -2.812 . . . . 0.0 109.23 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -70.12 -52.68 21.77 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 121.351 2.576 . . . . 0.0 108.636 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.33 -34.93 78.37 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.199 0.599 . . . . 0.0 109.825 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.7 m -65.95 -47.98 72.85 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 89.9 t80 -64.33 -49.48 71.54 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 118.594 -0.717 . . . . 0.0 109.843 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -55.46 -53.23 58.94 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.527 1.131 . . . . 0.0 110.506 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 10.4 ttm -58.17 -53.59 56.6 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 123.285 0.634 . . . . 0.0 110.25 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.1 mp -62.75 -28.62 70.09 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.725 -1.131 . . . . 0.0 111.489 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.8 tt -70.81 -56.6 5.96 Favored 'General case' 0 CA--C 1.522 -0.102 0 CA-C-N 120.696 1.589 . . . . 0.0 108.259 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -61.11 -46.9 88.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.479 0.712 . . . . 0.0 112.785 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 48.0 mt -67.9 -44.12 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.604 0.638 . . . . 0.0 110.632 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 1.2 tmpt? -66.73 -44.22 82.14 Favored 'General case' 0 CA--C 1.517 -0.294 0 O-C-N 120.974 -1.079 . . . . 0.0 110.01 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -62.93 -50.85 69.21 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.582 0.753 . . . . 0.0 110.518 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 19.0 p -56.14 -46.41 79.25 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.184 0.902 . . . . 0.0 111.475 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 4.2 tt -62.94 -49.1 76.07 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.927 1.291 . . . . 0.0 110.056 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -60.27 -54.91 40.13 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.788 0.835 . . . . 0.0 110.856 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.76 -40.93 94.31 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 124.416 1.086 . . . . 0.0 112.132 -178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmm? -63.27 -44.29 95.55 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -65.0 -37.11 86.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -33.54 76.15 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.801 1.24 . . . . 0.0 112.714 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -112.16 82.58 4.46 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 119.28 0.946 . . . . 0.0 109.713 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -73.83 62.0 4.72 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 125.095 3.863 . . . . 0.0 113.339 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.35 158.39 26.63 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.383 1.073 . . . . 0.0 109.224 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 26.5 m80 -61.46 -32.23 72.22 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.107 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 60.8 m -57.95 -47.67 82.24 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.473 1.033 . . . . 0.0 108.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 4.0 mp -59.29 -42.09 86.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.915 0.886 . . . . 0.0 109.062 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.06 -57.73 10.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.652 0.381 . . . . 0.0 111.213 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 91.2 m -57.82 -43.46 85.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.3 1.04 . . . . 0.0 109.745 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -58.43 -46.54 86.29 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.539 1.063 . . . . 0.0 110.302 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -49.16 76.54 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 118.863 -0.589 . . . . 0.0 110.69 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -68.32 -47.74 66.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 118.802 -0.618 . . . . 0.0 110.99 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -48.28 -51.19 26.88 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.081 1.353 . . . . 0.0 110.102 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . 0.296 3.7 pp0? -72.98 -31.72 64.71 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.74 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -66.25 -40.25 90.07 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.184 1.356 . . . . 0.0 108.456 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -70.31 -41.77 72.86 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -58.34 -36.88 74.09 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.481 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 1.9 t60 -54.98 -27.81 46.88 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.461 1.028 . . . . 0.0 112.363 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -70.51 -45.84 64.81 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.002 -1.061 . . . . 0.0 109.658 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -78.09 -9.35 59.11 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 128.405 2.682 . . . . 0.0 114.955 -178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 9.9 tt -44.78 -30.73 1.01 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 128.619 2.767 . . . . 0.0 114.376 -178.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 64.9 tp -51.09 -32.07 21.15 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 117.527 -1.225 . . . . 0.0 112.721 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 18.16 96.38 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 129.648 3.179 . . . . 0.0 115.989 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 30.8 tttt -52.81 139.79 25.91 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 125.6 1.56 . . . . 0.0 110.046 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.95 81.76 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.87 2.868 . . . . 0.0 111.939 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.91 103.08 0.78 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.207 -1.775 . . . . 0.0 106.207 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 5.8 m -57.44 138.28 55.2 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 124.549 1.14 . . . . 0.0 110.019 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 6.9 tp -160.41 -37.01 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 124.53 1.132 . . . . 0.0 110.267 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -60.79 148.96 37.33 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.884 0.874 . . . . 0.0 111.46 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 30.8 t . . . . . 0 C--O 1.252 1.206 0 N-CA-C 100.289 -3.967 . . . . 0.0 100.289 178.873 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.316 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 9.7 p -174.84 -53.37 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 125.612 1.565 . . . . 0.0 108.703 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 1.2 m-20 59.25 67.9 0.86 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 127.386 2.274 . . . . 0.0 109.458 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -117.29 -4.64 11.35 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.244 2.217 . . . . 0.0 114.02 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -82.96 29.67 0.46 Allowed 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.391 -1.443 . . . . 0.0 111.656 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 5.0 m -53.78 139.09 34.01 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 126.167 1.787 . . . . 0.0 110.687 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -106.99 145.4 32.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -130.03 143.29 50.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 125.571 1.548 . . . . 0.0 107.306 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 59.7 mt -144.42 154.81 43.35 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.095 0.558 . . . . 0.0 110.446 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -145.02 107.42 4.38 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.453 1.901 . . . . 0.0 108.116 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . 0.463 HG21 ' HD2' ' B' ' 116' ' ' LYS . 99.6 t -155.55 152.32 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 128.547 2.739 . . . . 0.0 106.497 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 103.49 7.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 121.128 1.785 . . . . 0.0 112.854 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.39 120.33 1.75 Allowed Glycine 0 C--O 1.228 -0.279 0 N-CA-C 105.957 -2.857 . . . . 0.0 105.957 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 9.3 tpt85 -57.85 -56.61 19.69 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.439 1.62 . . . . 0.0 111.688 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 58.7 mttp -67.51 -48.91 65.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -51.7 -52.03 51.47 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.051 0.94 . . . . 0.0 110.51 -177.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 93.1 t80 -61.06 -51.03 70.91 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 117.89 -1.052 . . . . 0.0 111.816 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -57.63 -47.56 81.88 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.875 1.216 . . . . 0.0 111.415 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 87.7 mt -61.21 -58.2 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.832 1.253 . . . . 0.0 108.896 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 4.6 mp -55.2 -47.47 75.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 123.264 0.626 . . . . 0.0 109.802 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -44.38 87.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.695 1.198 . . . . 0.0 110.279 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -62.72 -53.03 60.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.751 1.16 . . . . 0.0 108.558 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 59.4 mt -59.2 -30.06 67.94 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.084 0.553 . . . . 0.0 112.475 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . 0.633 ' HE2' HD22 ' B' ' 101' ' ' LEU . 28.5 ttpp -64.34 -60.52 3.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.703 1.201 . . . . 0.0 108.522 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.23 -41.21 99.07 Favored 'General case' 0 C--O 1.225 -0.207 0 O-C-N 123.704 0.628 . . . . 0.0 110.722 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 58.6 m -58.91 -48.18 82.36 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.35 0.977 . . . . 0.0 112.019 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -41.63 70.21 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -57.27 -46.55 82.97 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.645 1.111 . . . . 0.0 110.341 179.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.52 -39.67 88.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 117.804 -1.093 . . . . 0.0 108.783 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -66.97 -30.75 70.95 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.151 0.98 . . . . 0.0 110.605 178.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -75.7 -28.74 58.75 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.935 1.694 . . . . 0.0 109.661 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 40.9 tp -85.48 -33.1 21.92 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.597 1.159 . . . . 0.0 112.476 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 21.2 m -93.46 148.0 34.72 Favored Pre-proline 0 C--N 1.332 -0.181 0 O-C-N 120.934 -1.104 . . . . 0.0 110.233 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -70.82 -179.9 3.75 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 N-CA-C 108.105 -1.536 . . . . 0.0 108.105 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -112.0 61.52 0.57 Allowed Pre-proline 0 CA--C 1.544 0.718 0 O-C-N 120.814 -1.179 . . . . 0.0 111.936 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.96 -75.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 123.598 2.865 . . . . 0.0 109.974 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.4 tt -65.05 -30.35 71.31 Favored 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.9 t -55.9 -52.41 49.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 118.148 -0.929 . . . . 0.0 110.328 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.15 -45.96 75.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.182 1.355 . . . . 0.0 110.693 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -50.25 67.53 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.643 0.777 . . . . 0.0 109.839 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 24.8 t80 -67.02 -42.46 84.9 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 125.335 1.454 . . . . 0.0 110.064 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -57.06 -47.8 80.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.954 1.252 . . . . 0.0 110.866 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -67.45 -37.77 83.48 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.898 0.772 . . . . 0.0 110.453 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -64.67 -34.0 77.26 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.767 1.627 . . . . 0.0 111.238 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.97 -43.69 19.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.53 1.532 . . . . 0.0 108.501 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -57.76 -31.53 66.59 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.018 0.927 . . . . 0.0 110.498 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 19.3 mt -58.6 -21.35 53.16 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.708 0.803 . . . . 0.0 111.429 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.44 -5.49 54.83 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.368 0.667 . . . . 0.0 111.884 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -120.97 161.1 22.17 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.968 1.307 . . . . 0.0 110.29 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 . . . . . 0 C--O 1.254 1.314 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.881 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -102.79 21.28 15.79 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.268 1.427 . . . . 0.0 109.261 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -128.98 26.39 5.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 128.425 2.69 . . . . 0.0 107.895 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.32 142.63 56.75 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.0 tp -89.8 121.75 32.24 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -106.57 163.75 12.63 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.597 1.159 . . . . 0.0 108.011 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -132.44 145.17 51.0 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.588 HD21 ' HE2' ' C' 1023 ' ' LYS . 3.1 tt -132.99 96.91 17.26 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-O 118.272 -0.871 . . . . 0.0 109.255 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.05 126.4 8.62 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.582 2.855 . . . . 0.0 112.737 -179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 t -145.77 148.63 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 119.655 1.116 . . . . 0.0 109.917 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -136.28 100.94 4.53 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.55 117.45 0.74 Allowed Glycine 0 CA--C 1.523 0.556 0 N-CA-C 105.389 -3.084 . . . . 0.0 105.389 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -65.09 -50.94 64.18 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 122.174 2.987 . . . . 0.0 111.592 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -62.01 -36.61 82.04 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.267 0.939 . . . . 0.0 110.228 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.2 m -63.84 -49.57 72.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -59.0 -34.88 72.36 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.932 1.242 . . . . 0.0 112.123 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -59.05 -57.38 13.34 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.422 ' CE ' ' HE3' ' D' 1114 ' ' LYS . 1.2 ptp -63.82 -37.8 88.74 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 119.74 -0.784 . . . . 0.0 112.336 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.55 -53.62 48.88 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 117.896 -1.05 . . . . 0.0 111.817 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.01 -52.6 64.3 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 119.661 1.119 . . . . 0.0 110.439 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -56.29 -47.57 78.39 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.67 -47.62 69.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 118.709 0.686 . . . . 0.0 109.979 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.49 -53.78 41.17 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.937 0.895 . . . . 0.0 109.817 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -61.52 -34.39 75.43 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.978 0.911 . . . . 0.0 112.69 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 p -67.77 -43.74 79.09 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 118.489 0.586 . . . . 0.0 110.291 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.07 -42.45 89.38 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.399 1.079 . . . . 0.0 109.333 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -54.74 -53.87 49.4 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 56.5 tp -60.07 -56.28 23.57 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.402 1.081 . . . . 0.0 112.765 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.497 ' HE1' HH21 ' A' ' 41' ' ' ARG . 0.2 OUTLIER -54.36 -32.35 56.68 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.347 1.459 . . . . 0.0 112.467 -178.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -89.92 -41.64 11.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.633 0.651 . . . . 0.0 111.129 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -70.58 -21.71 62.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 112.912 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.4 tp -132.29 75.74 73.86 Favored Pre-proline 0 C--O 1.236 0.364 0 C-N-CA 123.992 0.917 . . . . 0.0 110.652 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -70.03 81.84 0.85 Allowed 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.357 2.705 . . . . 0.0 111.252 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -72.17 153.6 41.54 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -61.6 -21.85 64.7 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.33 -0.856 . . . . 0.0 110.854 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 m -62.14 -51.25 68.64 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 177.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.5 mp -57.21 -48.1 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 124.531 1.132 . . . . 0.0 108.682 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -60.57 -58.68 7.45 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.8 p -59.93 -50.02 75.39 Favored 'General case' 0 C--N 1.334 -0.076 0 C-N-CA 123.726 0.81 . . . . 0.0 111.9 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.84 -35.25 76.08 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 118.043 0.383 . . . . 0.0 111.069 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.497 HH21 ' HE1' ' A' ' 29' ' ' MET . 37.9 ttm180 -67.24 -48.57 67.4 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 178.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -58.61 -45.62 88.78 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.657 0.383 . . . . 0.0 110.672 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -63.59 -49.66 72.49 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.422 -0.799 . . . . 0.0 110.337 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -58.01 -40.14 80.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.142 0.883 . . . . 0.0 110.239 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -67.19 -49.79 63.34 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -61.62 -38.01 86.06 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.599 -0.688 . . . . 0.0 110.42 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -59.17 -38.97 81.05 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.421 1.089 . . . . 0.0 108.535 178.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -61.9 -25.21 67.43 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.415 0.552 . . . . 0.0 110.987 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -69.68 -44.06 71.23 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 20.7 m-70 -82.37 4.39 24.14 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.643 1.577 . . . . 0.0 112.999 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -28.01 64.21 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 120.085 1.312 . . . . 0.0 112.121 -179.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.21 -9.45 53.05 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.925 0.89 . . . . 0.0 111.437 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -96.73 -175.63 3.35 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 120.189 1.359 . . . . 0.0 111.351 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -61.52 141.79 57.49 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -155.5 93.51 1.5 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.433 0.693 . . . . 0.0 111.419 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 72.2 p -139.06 140.63 38.12 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.014 -1.053 . . . . 0.0 110.073 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.8 m -72.47 105.4 4.14 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 125.463 1.505 . . . . 0.0 110.815 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.6 tt -143.16 165.36 15.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.0 151.85 37.64 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.578 1.551 . . . . 0.0 106.952 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 C--O 1.255 1.365 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 179.145 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.599 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 15.6 m -114.71 -23.53 9.17 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.417 0.687 . . . . 0.0 111.175 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.5 t0 59.08 28.13 17.31 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 123.17 1.462 . . . . 0.0 111.727 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -138.8 18.62 2.67 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 129.092 2.957 . . . . 0.0 108.98 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -50.15 -74.91 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.334 1.854 . . . . 0.0 109.447 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 98.3 m -159.71 147.61 17.12 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.637 3.175 . . . . 0.0 105.722 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -119.69 130.11 54.87 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 104.15 -2.537 . . . . 0.0 104.15 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -108.33 151.03 26.54 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.507 1.523 . . . . 0.0 110.43 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 45.1 mt -148.67 150.73 33.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.698 0.799 . . . . 0.0 109.362 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.26 106.02 4.13 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.327 1.451 . . . . 0.0 109.867 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 57.5 t -154.68 151.48 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.968 1.307 . . . . 0.0 109.156 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -113.08 102.33 10.29 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.51 1.504 . . . . 0.0 111.603 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.15 111.32 0.64 Allowed Glycine 0 CA--C 1.52 0.366 0 CA-C-O 116.046 -2.53 . . . . 0.0 108.08 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 11.2 tpt180 -60.32 -58.02 10.3 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.954 2.877 . . . . 0.0 112.566 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -67.28 -41.83 84.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 118.544 0.611 . . . . 0.0 110.613 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -58.78 -48.05 82.6 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.54 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -63.7 -44.13 94.56 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 119.007 0.821 . . . . 0.0 110.438 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -57.66 -53.92 52.71 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.737 0.699 . . . . 0.0 111.277 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.8 mt -59.7 -54.17 38.26 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 124.31 1.044 . . . . 0.0 109.757 -178.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 58.1 mt -58.63 -51.32 70.42 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 117.259 -1.353 . . . . 0.0 112.247 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 26.2 ttt -64.16 -44.59 91.63 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.96 1.255 . . . . 0.0 111.133 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.1 ttpt -54.05 -52.37 61.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 119.028 0.831 . . . . 0.0 109.115 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 81.6 mt -72.57 -23.88 61.03 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.384 0.674 . . . . 0.0 112.187 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . 0.472 ' HD3' HD11 ' D' 1112 ' ' LEU . 25.2 tptt -63.26 -60.11 3.83 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 120.196 1.362 . . . . 0.0 107.978 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -39.13 77.3 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.434 1.709 . . . . 0.0 108.649 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 7.0 t -57.03 -45.31 83.21 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 123.43 0.692 . . . . 0.0 111.322 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.27 -42.77 71.67 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.382 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.91 -37.03 85.9 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 120.728 1.604 . . . . 0.0 110.248 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 mt -66.57 -48.28 70.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -61.61 -31.9 72.0 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 123.935 0.894 . . . . 0.0 111.113 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -73.9 -33.35 63.97 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.178 0.899 . . . . 0.0 109.671 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 52.7 tp -83.54 -33.69 25.41 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.5 m -94.16 148.6 35.42 Favored Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -71.42 172.26 14.54 Favored 'Trans proline' 0 N--CA 1.45 -1.082 0 CA-C-N 119.904 1.002 . . . . 0.0 110.5 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -112.84 41.6 0.23 Allowed Pre-proline 0 CA--C 1.556 1.18 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.51 -48.81 2.88 Favored 'Trans proline' 0 C--N 1.354 0.836 0 CA-C-N 122.417 1.899 . . . . 0.0 111.502 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.2 -36.13 80.98 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.016 0.826 . . . . 0.0 109.567 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.25 -46.65 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.068 0 C-N-CA 123.809 0.844 . . . . 0.0 110.23 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 100.0 m-20 -62.12 -50.07 73.36 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.015 0.526 . . . . 0.0 110.31 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.3 t -62.37 -46.38 88.89 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.008 0.523 . . . . 0.0 111.176 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -61.32 -49.61 76.29 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.535 1.134 . . . . 0.0 109.006 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -56.55 -47.72 78.83 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 118.503 -0.76 . . . . 0.0 108.968 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -58.7 -54.48 46.6 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.039 0.836 . . . . 0.0 111.207 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -34.4 75.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.7 0.682 . . . . 0.0 112.4 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -74.56 -33.9 62.8 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.148 0.579 . . . . 0.0 110.069 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -61.76 -38.62 88.66 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.151 -1.593 . . . . 0.0 107.55 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.16 -13.4 60.15 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.112 0.565 . . . . 0.0 112.059 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -69.52 -41.47 75.98 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -68.15 174.95 3.48 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.361 1.464 . . . . 0.0 111.508 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 . . . . . 0 C--O 1.242 0.71 0 C-N-CA 126.979 2.112 . . . . 0.0 107.101 179.433 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -104.27 -27.17 12.17 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.539 -0.726 . . . . 0.0 112.425 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 38.9 t70 -82.67 39.36 0.61 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.495 1.518 . . . . 0.0 109.779 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.64 139.86 58.45 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 120.576 -1.328 . . . . 0.0 107.758 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 68.8 tp -86.57 124.23 32.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.87 169.1 10.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 177.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -137.97 152.24 48.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -119.43 99.84 49.91 Favored Pre-proline 0 C--O 1.235 0.311 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -80.04 108.15 2.17 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.821 3.014 . . . . 0.0 109.582 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.3 t -142.17 147.42 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 O-C-N 121.027 -1.046 . . . . 0.0 110.365 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -126.25 101.97 6.98 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.56 120.82 0.91 Allowed Glycine 0 N--CA 1.459 0.218 0 CA-C-O 116.035 -2.536 . . . . 0.0 108.578 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -66.73 -51.77 52.07 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 122.411 3.106 . . . . 0.0 110.395 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -67.9 -38.12 82.59 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.31 99.11 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.274 0.63 . . . . 0.0 110.691 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 20.9 t80 -68.9 -38.93 79.93 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 119.742 1.155 . . . . 0.0 108.921 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -60.51 -54.4 45.9 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.353 -0.832 . . . . 0.0 111.497 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 3.8 ptp -61.59 -33.04 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.619 0.645 . . . . 0.0 111.132 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -69.21 -46.83 66.47 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -43.2 98.31 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 119.467 1.03 . . . . 0.0 109.741 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.74 -48.88 74.47 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.194 0.998 . . . . 0.0 110.624 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 8.6 mt -79.76 -31.53 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.508 0.723 . . . . 0.0 111.837 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . 0.588 ' HE2' HD21 ' A' ' 8' ' ' LEU . 1.4 tmmt? -65.86 -56.69 10.55 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.14 -49.27 76.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.896 1.678 . . . . 0.0 113.055 -178.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 13.7 p -61.88 -50.19 73.22 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.688 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.7 tm? -65.77 -40.33 91.9 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.035 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.02 -54.53 41.88 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -47.56 78.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 117.916 0.326 . . . . 0.0 111.21 -179.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -54.76 -33.35 61.15 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.705 1.202 . . . . 0.0 111.297 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.25 -22.92 18.72 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.073 1.349 . . . . 0.0 111.354 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -81.48 -34.63 31.24 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.339 1.427 . . . . 0.0 109.752 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 22.6 tp -129.29 78.65 75.56 Favored Pre-proline 0 C--O 1.237 0.423 0 C-N-CA 126.433 1.893 . . . . 0.0 107.592 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.5 66.05 6.46 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.191 3.261 . . . . 0.0 109.443 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -56.14 152.16 11.15 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.549 1.54 . . . . 0.0 110.858 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 84.2 m-70 -51.28 -32.68 25.64 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.386 1.475 . . . . 0.0 112.464 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 7.3 m -61.75 -51.55 67.88 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.976 0.91 . . . . 0.0 109.002 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.98 -40.45 85.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 125.787 1.635 . . . . 0.0 109.116 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -65.21 -58.04 7.0 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.434 1.494 . . . . 0.0 112.625 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 26.3 p -59.2 -43.55 92.23 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.73 0.812 . . . . 0.0 110.744 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 6.5 t80 -59.72 -39.62 85.28 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.934 0.494 . . . . 0.0 109.789 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -62.86 -48.81 77.43 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 118.99 0.814 . . . . 0.0 109.653 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -57.83 -56.37 22.86 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.268 0.627 . . . . 0.0 111.009 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -60.47 -45.1 94.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.895 -1.05 . . . . 0.0 111.428 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.89 -33.77 76.44 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.258 0.935 . . . . 0.0 113.297 -178.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -69.33 -50.36 47.26 Favored 'General case' 0 N--CA 1.461 0.084 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -58.83 -35.1 72.35 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.054 0.942 . . . . 0.0 110.752 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 25.1 tt0 -57.45 -29.6 64.33 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.875 1.27 . . . . 0.0 110.381 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -64.22 -30.05 71.13 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.506 0.594 . . . . 0.0 111.09 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -66.64 -42.41 86.74 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 120.803 -1.185 . . . . 0.0 109.886 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 13.2 m170 -77.75 -3.46 41.39 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.795 0.838 . . . . 0.0 111.674 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.17 -20.21 64.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.399 1.079 . . . . 0.0 110.885 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 6.3 mp -66.18 -24.9 66.72 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.974 -1.079 . . . . 0.0 109.232 178.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -91.58 172.21 8.65 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.084 1.353 . . . . 0.0 110.794 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -51.9 142.24 15.89 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.054 1.342 . . . . 0.0 111.046 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -140.35 103.5 4.58 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.72 114.84 7.88 Favored 'General case' 0 C--O 1.241 0.652 0 O-C-N 121.718 -0.614 . . . . 0.0 109.552 -178.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 15.7 m -67.92 106.12 2.21 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.276 1.03 . . . . 0.0 109.472 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 20.1 tt -163.05 140.11 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 104.613 -2.366 . . . . 0.0 104.613 178.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -145.94 158.4 43.87 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.058 1.343 . . . . 0.0 108.586 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.255 1.381 0 C-N-CA 124.268 1.027 . . . . 0.0 109.053 179.425 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.601 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 2.0 m -131.98 -81.92 0.5 Allowed 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.595 -1.631 . . . . 0.0 106.595 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 31.1 t0 -169.48 39.27 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.968 2.107 . . . . 0.0 107.245 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -126.49 26.14 6.39 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.932 1.293 . . . . 0.0 109.456 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.86 -80.89 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 125.393 1.477 . . . . 0.0 111.572 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 84.2 m -160.69 139.14 10.02 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 128.007 2.523 . . . . 0.0 106.385 177.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -113.24 130.16 56.31 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -105.69 140.03 39.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.942 2.897 . . . . 0.0 110.141 -177.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 77.5 mt -137.66 144.93 42.09 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.326 -0.859 . . . . 0.0 111.006 -178.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.84 101.39 3.94 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.03 1.732 . . . . 0.0 110.377 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . 0.452 HG11 ' HE3' ' B' ' 116' ' ' LYS . 63.9 t -151.25 152.01 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 120.585 -1.322 . . . . 0.0 109.629 -179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -115.79 101.47 8.84 Favored 'General case' 0 C--N 1.347 0.497 0 CA-C-N 120.486 1.494 . . . . 0.0 113.547 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.84 118.38 1.24 Allowed Glycine 0 CA--C 1.522 0.494 0 N-CA-C 107.717 -2.153 . . . . 0.0 107.717 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -66.73 -56.65 9.56 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 121.307 2.554 . . . . 0.0 111.014 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -63.38 -45.92 88.87 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.048 0.928 . . . . 0.0 109.328 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -57.99 -51.27 70.34 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 117.205 -1.378 . . . . 0.0 111.763 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.55 -44.97 95.54 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.498 1.499 . . . . 0.0 111.149 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -50.73 -54.1 26.03 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.807 0.843 . . . . 0.0 110.509 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.6 mt -65.88 -52.34 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.822 1.249 . . . . 0.0 110.383 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . 0.472 HD11 ' HD3' ' B' ' 116' ' ' LYS . 18.2 mt -51.73 -52.26 49.92 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.566 1.147 . . . . 0.0 111.974 -178.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 24.0 ttt -64.7 -44.26 90.84 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 118.808 -0.615 . . . . 0.0 111.25 -179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . 0.422 ' HE3' ' CE ' ' A' ' 18' ' ' MET . 24.7 ttpt -54.99 -52.18 63.93 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.93 -45.8 76.76 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.576 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.6 tptt -53.76 -59.75 4.21 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 118.949 0.795 . . . . 0.0 111.755 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -30.31 71.18 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 18.4 t -60.86 -39.04 87.66 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 120.324 1.42 . . . . 0.0 109.7 178.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.07 -38.6 63.88 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.275 0.489 . . . . 0.0 110.093 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.73 -43.29 96.94 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.93 -48.85 70.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.6 tmt? -59.56 -22.49 61.79 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.752 0.821 . . . . 0.0 110.861 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -74.71 -46.8 35.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 65.1 tp -71.99 -33.11 67.84 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.864 0.866 . . . . 0.0 113.334 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 23.1 m -92.25 147.5 34.71 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 120.101 1.319 . . . . 0.0 110.4 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -71.45 174.86 10.25 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 N-CA-C 108.398 -1.424 . . . . 0.0 108.398 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -122.74 44.3 0.87 Allowed Pre-proline 0 CA--C 1.555 1.136 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -61.91 -48.72 8.03 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.158 2.572 . . . . 0.0 113.273 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 49.7 tp -65.64 -26.41 67.79 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.453 -0.779 . . . . 0.0 109.689 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 39.7 t -67.27 -46.56 83.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.237 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -56.84 -43.81 81.5 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -64.6 -48.47 74.82 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.137 0.575 . . . . 0.0 109.975 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.36 -41.85 94.54 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.205 1.002 . . . . 0.0 110.166 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.07 -48.44 80.12 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.66 -49.82 69.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 117.893 -1.051 . . . . 0.0 111.89 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -42.46 95.67 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.118 1.326 . . . . 0.0 111.384 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -71.01 -37.55 72.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.157 0.435 . . . . 0.0 111.12 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -65.82 -39.75 91.17 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 119.028 0.831 . . . . 0.0 109.659 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 43.4 mt -66.81 -26.13 66.79 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.887 0.767 . . . . 0.0 110.003 178.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tm? -77.21 -40.31 45.51 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.295 1.038 . . . . 0.0 108.677 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.24 138.0 56.66 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.672 1.989 . . . . 0.0 109.956 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 . . . . . 0 C--O 1.252 1.188 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 179.391 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.419 ' C ' ' H ' ' A' ' 3' ' ' ASP . 69.8 m . . . . . 0 N--CA 1.465 0.282 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -67.26 14.92 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 128.227 2.611 . . . . 0.0 112.09 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.419 ' H ' ' C ' ' A' ' 1' ' ' SER . 7.2 p-10 -86.41 12.59 9.86 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 128.375 2.67 . . . . 0.0 110.535 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.67 110.24 15.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.87 104.71 1.14 Allowed 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.8 mt -92.2 169.25 10.75 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -123.93 127.92 48.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 13.5 tp -115.67 93.98 38.98 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 126.022 1.729 . . . . 0.0 107.353 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -77.8 119.92 4.94 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.062 2.508 . . . . 0.0 112.988 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -145.62 155.59 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.04 1.336 . . . . 0.0 108.775 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 ptt180 -136.0 101.4 4.71 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.2 0.6 . . . . 0.0 111.102 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.48 115.93 0.65 Allowed Glycine 0 CA--C 1.526 0.732 0 C-N-CA 126.805 2.145 . . . . 0.0 107.758 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.07 -51.98 65.92 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.6 2.7 . . . . 0.0 112.286 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -73.42 -32.38 64.38 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 123.27 0.628 . . . . 0.0 110.737 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.3 m -61.05 -43.4 98.94 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.123 1.369 . . . . 0.0 108.627 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -67.51 -54.43 20.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -54.64 -54.93 35.12 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.471 0.708 . . . . 0.0 112.909 -178.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 40.0 ttm -53.42 -54.02 42.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.983 0.913 . . . . 0.0 110.349 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.94 -28.73 67.73 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-O 118.014 -0.993 . . . . 0.0 112.911 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tt -68.22 -55.8 10.98 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.61 -40.49 72.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.031 0.932 . . . . 0.0 110.349 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.447 HG23 HD22 ' B' ' 115' ' ' LEU . 93.2 mt -67.9 -51.07 53.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.63 -0.7 . . . . 0.0 110.337 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -32.82 74.49 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.108 1.322 . . . . 0.0 110.721 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -66.16 -55.17 17.71 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.031 1.332 . . . . 0.0 110.395 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 p -54.38 -40.63 68.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 117.9 0.318 . . . . 0.0 110.326 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 tt -68.5 -55.43 11.77 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.734 1.214 . . . . 0.0 110.513 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -53.36 -52.78 58.16 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.244 1.817 . . . . 0.0 111.869 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.8 -46.22 90.46 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.993 -1.003 . . . . 0.0 109.641 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.54 -43.03 97.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 119.079 0.854 . . . . 0.0 109.281 178.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -71.69 -13.17 61.66 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -102.77 -28.96 11.78 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.299 0.954 . . . . 0.0 113.526 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.6 tp -110.81 115.03 53.88 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 125.206 1.402 . . . . 0.0 109.848 -178.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -60.98 -37.43 76.74 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.152 1.901 . . . . 0.0 112.428 -179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 47.54 115.06 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 129.727 3.211 . . . . 0.0 114.749 179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -52.53 -31.08 33.79 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.868 0.867 . . . . 0.0 112.501 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.8 m -67.83 -46.09 72.82 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.777 0.831 . . . . 0.0 108.942 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -65.28 -34.39 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -58.27 8.13 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.0 m -68.29 -49.43 60.5 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -52.2 -51.93 55.19 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 123.924 0.89 . . . . 0.0 111.256 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -69.05 -46.1 68.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.937 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -58.45 -52.99 63.29 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.986 0.514 . . . . 0.0 110.629 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -62.75 -41.18 99.08 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.676 -0.678 . . . . 0.0 109.372 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.78 -39.38 84.69 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.383 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -63.73 -52.15 61.76 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.187 1.358 . . . . 0.0 108.348 178.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.2 tm0? -57.69 -39.18 76.56 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.687 1.195 . . . . 0.0 111.712 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -78.6 -34.15 46.95 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.975 0.91 . . . . 0.0 110.291 179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -58.74 -21.16 54.71 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.136 -0.978 . . . . 0.0 110.657 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.42 -45.61 76.74 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.704 1.602 . . . . 0.0 108.253 178.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -92.57 -38.41 11.92 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.238 1.015 . . . . 0.0 111.486 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.6 tp -57.54 -32.57 67.22 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.229 1.012 . . . . 0.0 113.639 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 69.0 mt -93.1 -0.8 56.93 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 122.853 0.461 . . . . 0.0 111.029 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 42.62 -134.6 0.41 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 127.34 2.256 . . . . 0.0 108.972 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.55 65.29 1.48 Allowed 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 103.622 -2.733 . . . . 0.0 103.622 178.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -137.6 -0.72 2.13 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -178.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t -139.8 147.58 40.98 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 120.924 1.693 . . . . 0.0 111.011 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.3 m -83.35 79.27 9.46 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 126.547 1.939 . . . . 0.0 110.767 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.6 pt -64.3 158.87 3.9 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.629 0.728 . . . . 0.0 111.407 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -65.82 158.7 27.08 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.665 1.586 . . . . 0.0 110.186 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.23 0 C-N-CA 124.65 1.18 . . . . 0.0 107.899 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.54 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 72.7 m -159.13 70.31 0.48 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 104.444 -2.428 . . . . 0.0 104.444 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -118.18 -74.26 0.61 Allowed 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 123.771 0.828 . . . . 0.0 110.344 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -66.83 -35.76 80.78 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.317 0.962 . . . . 0.0 111.486 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.31 -17.54 61.3 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.533 0.733 . . . . 0.0 111.167 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . 0.488 ' HA ' ' HB3' ' D' 1104 ' ' ARG . 53.1 m -75.29 150.52 38.49 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . 0.513 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 86.9 m-85 -101.7 128.23 48.1 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.108 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -105.98 161.98 14.0 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 126.026 1.73 . . . . 0.0 109.317 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 93.7 mt -151.0 142.98 23.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 127.441 2.296 . . . . 0.0 106.285 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -144.39 98.87 3.28 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.251 1.42 . . . . 0.0 108.37 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 m -153.63 150.32 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 123.485 0.714 . . . . 0.0 111.682 -177.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -117.54 102.48 9.22 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.043 1.292 . . . . 0.0 114.201 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.31 129.28 3.82 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 106.781 -2.528 . . . . 0.0 106.781 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -66.73 -57.51 6.97 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.202 2.001 . . . . 0.0 110.88 -179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -70.35 -37.87 74.7 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -54.6 -41.89 70.48 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.233 0.613 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -75.12 -42.68 55.83 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.257 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -54.15 -54.93 32.88 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.853 1.66 . . . . 0.0 110.273 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.02 -54.92 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.466 1.506 . . . . 0.0 110.423 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -32.18 73.74 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-O 116.711 -1.614 . . . . 0.0 112.89 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 21.3 mtp -68.78 -53.24 22.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 121.019 1.736 . . . . 0.0 107.547 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -52.07 -48.55 64.6 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.297 1.039 . . . . 0.0 109.836 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.447 HD22 HG23 ' A' ' 22' ' ' ILE . 50.9 mt -67.46 -54.99 15.47 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.6 -0.715 . . . . 0.0 112.138 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -54.45 -37.85 65.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 120.095 1.316 . . . . 0.0 110.797 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -65.04 -57.59 8.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.731 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 73.0 m -55.54 -34.12 64.41 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.11 -0.947 . . . . 0.0 111.432 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -72.45 -40.24 67.17 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.713 1.205 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -62.77 -47.09 85.01 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.44 1.018 . . . . 0.0 108.478 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 75.5 mt -60.64 -47.3 86.86 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -26.77 68.02 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.263 1.025 . . . . 0.0 111.807 178.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -79.64 -54.79 5.54 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.808 0.843 . . . . 0.0 111.868 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -69.6 -32.72 71.61 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -178.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.86 148.27 34.49 Favored Pre-proline 0 CA--C 1.534 0.327 0 C-N-CA 125.105 1.362 . . . . 0.0 108.756 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -70.98 169.42 20.52 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 121.077 1.185 . . . . 0.0 109.576 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -115.7 58.88 1.46 Allowed Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.436 1.094 . . . . 0.0 113.207 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.07 -63.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 123.558 2.838 . . . . 0.0 115.645 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 9.9 tt -64.31 -33.33 75.57 Favored 'General case' 0 CA--C 1.513 -0.477 0 O-C-N 121.162 -0.961 . . . . 0.0 108.934 -179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.424 HG23 ' H ' ' B' ' 130' ' ' VAL . 15.1 t -50.27 -53.33 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 C-N-CA 125.173 1.389 . . . . 0.0 108.401 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -66.39 -51.4 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.8 m -59.16 -41.13 87.66 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.97 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -67.98 -52.77 32.07 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.019 1.328 . . . . 0.0 110.365 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -59.69 -39.78 85.67 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.401 -1.285 . . . . 0.0 110.129 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -64.28 -55.6 20.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.911 1.232 . . . . 0.0 110.058 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -56.42 -42.48 78.12 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.356 -0.84 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -67.83 -40.72 83.74 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.993 0.917 . . . . 0.0 110.828 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -61.23 -34.32 74.93 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 125.26 1.424 . . . . 0.0 110.567 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -57.73 -14.36 5.6 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.388 0.994 . . . . 0.0 113.128 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 tt -72.2 -20.54 61.56 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.814 1.188 . . . . 0.0 109.693 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -141.04 99.75 3.66 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 125.81 1.644 . . . . 0.0 108.976 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.811 0 C-N-CA 123.881 0.872 . . . . 0.0 108.683 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . 0.404 ' C ' ' H ' ' C' 1003 ' ' ASP . 37.3 m . . . . . 0 N--CA 1.463 0.192 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -78.0 32.49 0.18 Allowed 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 121.001 1.728 . . . . 0.0 112.176 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . 0.404 ' H ' ' C ' ' C' 1001 ' ' SER . 2.6 p30 -90.43 12.0 19.86 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 129.106 2.962 . . . . 0.0 110.594 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -65.05 106.0 1.17 Allowed 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 1.9 tt -69.19 95.9 0.79 Allowed 'General case' 0 C--O 1.236 0.378 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.7 mt -90.28 168.77 11.66 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.784 1.633 . . . . 0.0 107.506 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -126.44 135.23 51.12 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 28.4 tp -111.72 91.97 16.11 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.8 106.65 2.24 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.261 2.641 . . . . 0.0 109.471 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 58.9 t -144.91 153.69 14.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 119.977 1.262 . . . . 0.0 110.769 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -128.52 102.97 6.85 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 178.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.3 110.59 0.39 Allowed Glycine 0 CA--C 1.522 0.469 0 CA-C-O 115.646 -2.752 . . . . 0.0 108.878 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -62.06 -53.15 59.53 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 123.099 3.449 . . . . 0.0 111.962 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 16.7 m -67.92 -45.48 74.26 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.28 -0.887 . . . . 0.0 109.469 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.54 -52.39 61.33 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 124.051 0.94 . . . . 0.0 108.614 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -54.47 -51.39 65.17 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.141 0.976 . . . . 0.0 110.69 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 52.1 ttm -61.49 -53.84 51.1 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.654 0.781 . . . . 0.0 111.377 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.3 -36.54 84.38 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.94 -55.8 15.0 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -57.69 -39.31 76.88 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.513 0.725 . . . . 0.0 111.687 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . 0.405 HG23 HD22 ' D' 1115 ' ' LEU . 22.6 mt -65.15 -52.25 55.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 118.483 -0.77 . . . . 0.0 109.865 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -34.61 75.66 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 118.375 -1.33 . . . . 0.0 110.794 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -61.66 -55.35 31.48 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 119.053 0.842 . . . . 0.0 110.049 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.2 p -55.32 -49.09 73.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 118.094 0.407 . . . . 0.0 110.911 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.3 tt -62.24 -54.3 42.8 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.843 0.857 . . . . 0.0 111.164 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -53.95 -50.97 65.3 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.613 1.165 . . . . 0.0 110.152 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.35 -48.83 76.33 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 123.774 0.829 . . . . 0.0 110.005 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 2.2 tmt? -58.87 -22.65 59.66 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.45 1.1 . . . . 0.0 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -100.98 -12.77 18.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.058 1.743 . . . . 0.0 112.012 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.3 t80 -101.72 -13.41 17.76 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.003 1.321 . . . . 0.0 110.581 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 41.7 tp -130.91 103.16 15.81 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 126.838 2.055 . . . . 0.0 108.633 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -76.84 40.05 0.77 Allowed 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 124.485 3.457 . . . . 0.0 111.092 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -25.36 123.51 0.06 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 131.31 3.844 . . . . 0.0 113.112 -178.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 7.2 m170 -48.44 -46.53 37.8 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 124.7 1.2 . . . . 0.0 112.855 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 13.3 m -58.78 -51.24 70.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.716 0.807 . . . . 0.0 109.829 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.5 mt -57.03 -46.04 84.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.981 1.712 . . . . 0.0 110.206 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.4 -52.11 66.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 122.872 0.469 . . . . 0.0 111.619 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 27.7 m -63.26 -39.53 94.85 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.706 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 24.7 t80 -57.7 -52.97 63.25 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 178.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 48.0 ttt-85 -63.77 -31.81 73.11 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.665 0.666 . . . . 0.0 111.859 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.1 -57.85 11.07 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . 0.501 HE21 ' NE2' ' C' 1047 ' ' GLN . 54.8 tt0 -67.98 -37.87 82.01 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 124.668 1.187 . . . . 0.0 111.633 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -60.24 -47.39 86.17 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.586 -1.197 . . . . 0.0 109.834 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -64.64 -40.43 95.44 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.196 1.362 . . . . 0.0 110.012 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -59.05 -54.1 50.92 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . 0.501 ' NE2' HE21 ' C' 1043 ' ' GLN . 74.9 mt-30 -68.79 -29.75 68.18 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.464 -0.773 . . . . 0.0 111.958 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.81 -24.05 61.33 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 120.844 -1.16 . . . . 0.0 111.058 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -42.71 82.13 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 30.4 p80 -92.4 -34.0 14.32 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 118.459 -0.782 . . . . 0.0 111.014 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 24.5 tp -59.2 -47.13 86.45 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.588 1.085 . . . . 0.0 111.282 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 85.0 mt -79.06 -37.4 39.02 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 3.3 tt0 53.6 -175.52 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.717 2.007 . . . . 0.0 111.794 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 12.0 mtpp -87.55 99.91 12.39 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 104.186 -2.524 . . . . 0.0 104.186 178.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 16.0 pt20 177.66 -2.22 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 127.832 2.453 . . . . 0.0 112.148 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 10.1 t -142.84 145.91 33.63 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 50.3 m -78.16 127.03 31.66 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.669 0.788 . . . . 0.0 109.532 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 13.1 pt -106.3 152.83 7.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 C-N-CA 124.736 1.215 . . . . 0.0 107.927 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -68.59 158.53 33.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 C--O 1.249 1.034 0 O-C-N 121.231 -0.918 . . . . 0.0 110.708 179.619 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 15.0 m -150.28 95.75 2.31 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 19.6 t70 -142.45 -51.0 0.38 Allowed 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 118.733 0.697 . . . . 0.0 111.807 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . 0.471 ' H ' ' CD ' ' D' 1096 ' ' GLU . 2.2 mp0 -58.5 -38.1 76.96 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 122.802 0.441 . . . . 0.0 111.385 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -86.75 -6.49 58.81 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 122.944 0.497 . . . . 0.0 111.464 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 59.2 m -74.3 152.42 39.65 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 105.087 -2.19 . . . . 0.0 105.087 178.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -101.9 130.18 48.32 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.194 -0.942 . . . . 0.0 110.173 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -115.61 150.0 37.39 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.55 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 70.9 mt -142.53 142.27 32.19 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.82 98.56 3.07 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.281 1.033 . . . . 0.0 108.354 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.39 146.52 18.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 124.958 1.303 . . . . 0.0 110.81 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . 0.488 ' HB3' ' HA ' ' B' ' 98' ' ' THR . 0.0 OUTLIER -107.88 100.62 9.97 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.662 1.119 . . . . 0.0 113.284 -179.374 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.09 108.15 0.5 Allowed Glycine 0 C--O 1.226 -0.371 0 N-CA-C 106.385 -2.686 . . . . 0.0 106.385 177.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -51.08 -57.11 9.52 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 122.005 2.903 . . . . 0.0 113.728 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -67.84 -44.25 77.6 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.344 -0.848 . . . . 0.0 110.467 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 3.3 m120 -58.6 -30.05 66.92 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.296 1.439 . . . . 0.0 110.645 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . 0.513 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 45.7 t80 -74.82 -55.33 5.93 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 177.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -52.36 -53.93 38.27 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.497 1.044 . . . . 0.0 113.399 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -60.03 -54.47 34.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 C-N-CA 125.035 1.334 . . . . 0.0 109.119 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -35.8 81.68 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 117.442 -1.266 . . . . 0.0 110.877 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.96 -52.45 62.98 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 119.843 1.202 . . . . 0.0 108.282 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 58.0 tttp -54.96 -46.96 75.1 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.69 0.796 . . . . 0.0 109.81 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . 0.405 HD22 HG23 ' C' 1022 ' ' ILE . 33.0 mt -66.86 -52.0 48.85 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 117.907 0.321 . . . . 0.0 110.649 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -55.03 -44.65 74.82 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.399 1.079 . . . . 0.0 111.438 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.62 -57.5 11.78 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.152 1.781 . . . . 0.0 106.983 178.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.6 m -53.2 -43.72 67.39 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.506 0.722 . . . . 0.0 112.008 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.82 -31.08 64.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.348 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -65.16 -44.86 87.19 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.504 1.502 . . . . 0.0 107.468 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.74 -43.14 89.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.053 1.341 . . . . 0.0 107.783 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.21 -36.46 79.96 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.019 0.827 . . . . 0.0 110.752 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -45.37 52.79 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.807 0.843 . . . . 0.0 112.288 -179.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.4 pp -78.42 -32.83 48.85 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -94.31 146.12 30.97 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -67.0 173.97 7.54 Favored 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 122.912 2.408 . . . . 0.0 112.799 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.23 50.85 0.67 Allowed Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 125.059 1.344 . . . . 0.0 113.858 -179.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.09 -69.73 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.213 1.942 . . . . 0.0 112.245 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.87 -32.64 73.01 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.253 0.933 . . . . 0.0 110.007 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 18.0 t -53.99 -50.47 53.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 124.537 1.135 . . . . 0.0 110.074 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.89 -51.25 50.22 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.482 0.583 . . . . 0.0 111.253 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 49.5 m -54.59 -42.36 70.98 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.032 0.378 . . . . 0.0 110.841 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.03 -52.57 40.72 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 117.29 -1.338 . . . . 0.0 110.282 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.86 -43.4 94.7 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 120.121 1.328 . . . . 0.0 111.331 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -62.39 -54.96 32.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 118.875 0.761 . . . . 0.0 109.841 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -61.52 -27.89 68.93 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 2.8 tm0? -80.51 -49.71 11.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -55.37 -33.2 63.23 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.801 1.64 . . . . 0.0 109.971 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 9.6 mt -57.12 -13.97 3.49 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.038 0.935 . . . . 0.0 113.442 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 6.3 tt -75.02 -23.38 58.19 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.468 1.031 . . . . 0.0 110.731 178.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -140.86 100.01 3.74 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 126.364 1.866 . . . . 0.0 110.102 -178.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.952 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.9 p . . . . . 0 N--CA 1.463 0.216 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -104.38 3.77 32.7 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.964 0.905 . . . . 0.0 113.13 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -70.63 14.84 0.12 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.841 1.256 . . . . 0.0 114.078 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -53.97 107.28 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tp -62.85 94.57 0.07 Allowed 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.674 1.19 . . . . 0.0 113.123 -177.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.1 mt -91.01 156.2 18.12 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -130.14 142.69 50.56 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.766 1.626 . . . . 0.0 106.738 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 tp -132.12 110.47 14.14 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 119.596 1.089 . . . . 0.0 111.885 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -88.18 113.31 0.78 Allowed 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 124.766 3.644 . . . . 0.0 111.07 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.41 HG22 ' HE3' ' C' 1023 ' ' LYS . 24.2 t -140.83 148.45 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 119.788 -1.82 . . . . 0.0 107.965 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.58 102.8 5.23 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.466 -0.771 . . . . 0.0 109.924 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.26 118.12 0.79 Allowed Glycine 0 CA--C 1.521 0.424 0 N-CA-C 104.325 -3.51 . . . . 0.0 104.325 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.98 -51.46 64.21 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.965 1.883 . . . . 0.0 109.878 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -65.51 -45.74 82.38 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.842 0.857 . . . . 0.0 109.449 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.7 m -55.31 -51.81 65.51 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.794 1.638 . . . . 0.0 110.488 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -62.0 -42.56 99.28 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.424 -0.798 . . . . 0.0 110.278 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -60.46 -42.96 97.26 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.118 1.326 . . . . 0.0 111.697 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.5 ttm -69.98 -53.83 15.96 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.038 0.535 . . . . 0.0 110.911 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.18 -47.02 82.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.654 1.581 . . . . 0.0 111.422 -178.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.69 -49.09 78.93 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -57.81 -47.65 81.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.948 0.794 . . . . 0.0 111.814 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.531 HG23 HD22 ' B' ' 115' ' ' LEU . 96.6 mt -62.12 -42.12 93.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 123.419 0.688 . . . . 0.0 109.249 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.467 ' HE3' HG22 ' C' 1010 ' ' VAL . 14.0 tmtt? -63.38 -52.41 61.76 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 123.854 0.862 . . . . 0.0 108.756 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.35 -54.69 40.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.929 2.092 . . . . 0.0 110.949 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -53.82 -51.1 64.6 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.908 0.776 . . . . 0.0 109.721 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.14 -48.71 78.88 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -178.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -59.69 -51.83 68.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.145 1.378 . . . . 0.0 111.564 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.42 ' HG ' HG22 ' B' ' 130' ' ' VAL . 4.0 mm? -65.05 -42.48 94.23 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.072 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -37.18 67.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.878 -1.058 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -89.66 -17.13 28.97 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.222 1.374 . . . . 0.0 112.91 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -87.56 -57.9 2.78 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 121.149 -0.969 . . . . 0.0 113.234 -178.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.68 155.04 92.3 Favored Pre-proline 0 CA--C 1.54 0.579 0 O-C-N 121.919 -0.488 . . . . 0.0 110.826 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -60.14 112.54 1.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.83 2.353 . . . . 0.0 111.717 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -69.14 21.76 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.538 1.935 . . . . 0.0 114.376 -179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -47.23 -47.24 24.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 121.894 2.134 . . . . 0.0 114.681 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.2 m -66.72 -51.26 57.97 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.373 -0.83 . . . . 0.0 109.753 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 81.0 mt -58.3 -43.89 87.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 125.442 1.497 . . . . 0.0 110.939 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -55.95 -58.96 5.69 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.379 1.872 . . . . 0.0 109.677 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.9 m -62.73 -42.19 99.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.153 0.908 . . . . 0.0 110.071 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -55.3 -54.44 43.56 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.408 1.004 . . . . 0.0 111.223 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 43.3 ttt-85 -75.3 -29.87 60.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.308 -0.87 . . . . 0.0 112.209 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.73 -49.98 47.98 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.096 -1.002 . . . . 0.0 109.008 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -62.28 -44.14 97.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.658 1.183 . . . . 0.0 109.17 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -56.41 -51.9 66.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.369 0.986 . . . . 0.0 110.233 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -62.09 -34.97 77.32 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.984 -0.447 . . . . 0.0 111.241 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -69.43 -43.43 73.38 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.859 0.864 . . . . 0.0 110.4 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -57.36 -38.55 74.35 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.553 1.941 . . . . 0.0 110.763 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.59 -21.98 66.03 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.43 0.559 . . . . 0.0 111.793 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -70.07 -33.24 71.67 Favored 'General case' 0 C--O 1.226 -0.146 0 O-C-N 120.607 -1.308 . . . . 0.0 110.724 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -61.2 -32.75 72.51 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 117.919 0.327 . . . . 0.0 110.491 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.83 -20.82 66.01 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.24 0.616 . . . . 0.0 110.619 178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -100.47 -12.49 19.3 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.455 1.902 . . . . 0.0 110.955 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 35.32 65.18 0.41 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 129.261 3.025 . . . . 0.0 111.566 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -95.05 -20.4 19.35 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.887 1.275 . . . . 0.0 111.904 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -139.38 155.03 47.92 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.895 1.278 . . . . 0.0 108.45 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -115.83 139.92 49.72 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 125.68 1.592 . . . . 0.0 108.875 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.5 p -70.86 148.65 47.58 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 178.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.3 pt -147.78 179.41 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 127.441 2.296 . . . . 0.0 106.869 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -72.32 158.7 35.32 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.3 p . . . . . 0 C--O 1.256 1.401 0 CA-C-O 114.368 -2.729 . . . . 0.0 104.127 179.201 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.538 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 47.9 t -166.35 -179.13 4.84 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 127.062 2.145 . . . . 0.0 105.456 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -149.04 -19.06 0.3 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 124.004 0.922 . . . . 0.0 111.712 178.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -65.7 -39.22 91.01 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 118.685 0.675 . . . . 0.0 109.419 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -131.52 92.08 3.11 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.071 0.948 . . . . 0.0 110.589 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 92.3 m -120.99 164.05 17.33 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 125.749 1.62 . . . . 0.0 106.914 178.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . 0.487 ' HB3' ' CE2' ' D' 1109 ' ' PHE . 97.1 m-85 -118.59 131.32 56.2 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -113.1 158.19 20.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.383 1.473 . . . . 0.0 110.396 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 81.3 mt -144.06 135.82 26.12 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.42 98.87 4.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.515 1.526 . . . . 0.0 107.072 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 43.4 t -149.53 141.59 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.338 0.972 . . . . 0.0 109.627 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -92.83 103.98 16.27 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.22 108.44 0.49 Allowed Glycine 0 N--CA 1.465 0.627 0 CA-C-O 114.937 -3.146 . . . . 0.0 112.729 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -67.61 -58.21 5.08 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 123.55 3.675 . . . . 0.0 112.455 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -66.82 -43.08 84.71 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.294 -0.879 . . . . 0.0 110.012 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -57.63 -47.29 82.62 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.346 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -63.39 -41.73 98.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 120.302 1.41 . . . . 0.0 111.706 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -56.67 -52.39 65.11 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.718 1.144 . . . . 0.0 110.437 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.32 -52.6 53.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 C-N-CA 124.772 1.229 . . . . 0.0 110.788 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.94 -29.44 70.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 117.564 -1.208 . . . . 0.0 111.77 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.7 mtp -69.68 -52.33 26.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.69 1.586 . . . . 0.0 107.524 178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -51.7 -51.82 53.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.223 0.952 . . . . 0.0 108.706 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.531 HD22 HG23 ' A' ' 22' ' ' ILE . 65.0 mt -68.99 -35.87 77.19 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -61.51 -52.13 65.74 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 120.371 1.442 . . . . 0.0 107.488 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.13 -38.05 89.38 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 124.235 0.959 . . . . 0.0 109.891 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 5.4 t -52.8 -55.05 25.75 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 124.144 0.978 . . . . 0.0 110.52 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.47 -33.32 71.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.076 -0.964 . . . . 0.0 112.493 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -44.53 92.0 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.852 1.205 . . . . 0.0 108.409 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 54.9 mt -67.07 -48.23 68.86 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 9.6 tpt -58.67 -26.92 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.173 0.897 . . . . 0.0 110.83 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -79.63 -44.69 20.49 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 124.261 1.024 . . . . 0.0 111.052 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 pp -79.41 -26.1 41.95 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.047 1.294 . . . . 0.0 114.279 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . 0.468 HG22 ' HD2' ' B' ' 126' ' ' PRO . 0.3 OUTLIER -94.95 148.52 34.85 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.953 1.701 . . . . 0.0 108.916 -179.344 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.468 ' HD2' HG22 ' B' ' 125' ' ' VAL . 42.0 Cg_endo -73.36 179.86 5.1 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.735 2.29 . . . . 0.0 110.746 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 16.6 mp0 -121.2 44.27 0.73 Allowed Pre-proline 0 CA--C 1.563 1.47 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -63.4 -48.67 5.59 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.217 2.611 . . . . 0.0 115.284 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 69.4 tp -62.93 -41.86 99.61 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.551 1.068 . . . . 0.0 108.973 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.42 HG22 ' HG ' ' A' ' 28' ' ' LEU . 1.8 t -51.76 -48.68 37.86 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.195 0 C-N-CA 125.452 1.501 . . . . 0.0 109.706 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -61.49 -51.11 70.03 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.684 1.193 . . . . 0.0 111.767 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.5 t -62.79 -50.17 72.07 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.946 -0.471 . . . . 0.0 110.595 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 21.1 t80 -61.91 -36.12 80.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.597 1.559 . . . . 0.0 110.182 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -59.98 -48.63 80.91 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 117.832 -1.08 . . . . 0.0 108.31 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -69.13 -49.8 53.76 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.822 0.737 . . . . 0.0 111.706 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -54.15 -46.05 72.16 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.692 1.197 . . . . 0.0 111.185 -178.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -80.25 -27.67 38.62 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.928 0.891 . . . . 0.0 110.843 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -57.64 -39.66 77.48 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.184 1.357 . . . . 0.0 108.625 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 71.3 mt -58.66 -17.28 21.1 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.123 0.969 . . . . 0.0 112.459 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.18 -15.78 61.0 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.579 1.081 . . . . 0.0 111.985 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -99.88 170.28 8.63 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.124 -0.985 . . . . 0.0 109.756 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 . . . . . 0 C--O 1.244 0.801 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 179.063 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.423 0 CA-C-O 122.173 0.987 . . . . 0.0 108.864 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.29 -6.65 41.43 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.249 1.02 . . . . 0.0 112.528 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 2.3 t70 -71.35 32.08 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.2 1.8 . . . . 0.0 115.805 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -70.59 106.59 3.54 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.01 95.06 0.11 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.56 1.544 . . . . 0.0 110.352 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 5.6 mt -94.44 135.73 35.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -104.98 152.65 22.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.28 1.032 . . . . 0.0 109.276 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 55.6 tp -146.68 102.75 3.94 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.999 1.32 . . . . 0.0 109.808 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -84.25 129.64 4.51 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.291 2.661 . . . . 0.0 110.979 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . 0.467 HG22 ' HE3' ' A' ' 23' ' ' LYS . 3.6 t -144.44 150.91 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.816 1.247 . . . . 0.0 107.65 178.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.66 99.04 3.95 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.771 1.623 . . . . 0.0 109.586 177.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -170.29 137.01 4.23 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 116.773 -2.126 . . . . 0.0 107.875 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -70.62 -52.03 24.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 121.429 2.614 . . . . 0.0 112.076 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.65 -41.41 88.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.893 0.77 . . . . 0.0 110.79 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -56.19 -51.73 66.95 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 126.006 1.722 . . . . 0.0 108.742 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 36.4 t80 -68.38 -49.6 58.96 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.009 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.41 -56.8 13.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.809 1.244 . . . . 0.0 112.78 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 5.2 tmm? -59.73 -48.44 81.68 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 124.236 1.015 . . . . 0.0 110.656 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.88 -39.41 91.83 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 119.09 -0.481 . . . . 0.0 111.058 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.28 -47.4 79.66 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.405 -0.807 . . . . 0.0 109.293 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.51 -49.21 73.19 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.416 0.553 . . . . 0.0 110.88 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 82.4 mt -65.41 -51.24 66.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 123.698 0.799 . . . . 0.0 110.027 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . 0.41 ' HE3' HG22 ' A' ' 10' ' ' VAL . 11.3 tmtt? -54.22 -55.55 26.97 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.609 1.164 . . . . 0.0 110.182 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.26 -42.71 95.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.329 -178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 8.3 t -58.09 -51.16 70.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.519 0.6 . . . . 0.0 109.532 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.28 -49.04 71.07 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.13 -53.12 60.84 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.977 0.911 . . . . 0.0 111.296 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -65.25 -42.47 93.27 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.015 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 16.0 tmm? -58.12 -47.25 83.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.383 0.673 . . . . 0.0 110.324 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -78.69 -18.97 53.52 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.114 0.87 . . . . 0.0 112.7 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 15.0 t80 -83.63 -53.41 5.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 119.422 1.01 . . . . 0.0 113.178 -177.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.67 157.51 74.43 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -177.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.85 90.99 0.72 Allowed 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 124.445 3.43 . . . . 0.0 110.114 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . 0.444 HE21 ' HA ' ' C' 1034 ' ' GLN . 2.0 mm-40 -80.52 71.59 7.38 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.665 0.745 . . . . 0.0 110.724 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -58.94 -30.37 67.82 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.59 1.156 . . . . 0.0 109.069 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 14.1 m -67.1 -51.64 51.76 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.813 1.245 . . . . 0.0 109.767 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 69.9 mt -60.2 -41.93 88.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.599 0.76 . . . . 0.0 109.833 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.2 -58.33 8.41 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 87.4 m -66.15 -37.08 84.8 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.354 1.061 . . . . 0.0 112.225 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.89 -54.3 46.71 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.25 1.02 . . . . 0.0 109.162 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 54.7 ttt-85 -73.43 -31.95 64.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.118 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -63.57 -57.22 10.83 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 109.037 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -65.62 -34.37 78.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.15 -0.929 . . . . 0.0 111.335 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -61.26 -54.95 37.54 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.12 1.327 . . . . 0.0 108.73 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -63.72 -33.18 75.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.853 0.461 . . . . 0.0 111.347 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -68.52 -52.72 29.02 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 124.204 1.002 . . . . 0.0 109.74 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -52.78 -34.62 54.18 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.924 1.69 . . . . 0.0 110.965 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.48 -31.12 67.53 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 118.681 0.673 . . . . 0.0 110.721 178.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -69.93 -26.87 64.34 Favored 'General case' 0 C--N 1.342 0.269 0 O-C-N 121.074 -1.016 . . . . 0.0 111.816 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -60.26 -36.52 77.98 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.615 1.098 . . . . 0.0 110.395 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.24 -28.19 67.85 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.417 0.553 . . . . 0.0 110.788 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.24 -5.25 52.8 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.235 1.414 . . . . 0.0 112.499 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 33.38 39.46 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 129.675 3.19 . . . . 0.0 117.116 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 64.1 tttm -63.65 -22.77 67.07 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.154 -1.591 . . . . 0.0 111.573 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -142.71 178.26 7.76 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 125.963 1.705 . . . . 0.0 107.81 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 17.0 p -125.82 177.49 6.26 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.22 2.608 . . . . 0.0 107.498 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.28 138.9 50.92 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 40.5 pt -140.94 -178.51 1.53 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 126.391 1.876 . . . . 0.0 107.815 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -72.05 158.94 35.04 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 37.7 p . . . . . 0 C--O 1.256 1.437 0 CA-C-O 114.591 -2.623 . . . . 0.0 104.011 179.023 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.733 0 N-CA-C 110.736 -0.946 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 64.3 m -117.99 -177.19 3.21 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 125.108 1.363 . . . . 0.0 110.769 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -136.16 7.61 3.15 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -99.8 -47.74 4.95 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 120.417 1.462 . . . . 0.0 107.785 178.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -105.38 116.48 32.03 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 124.347 1.059 . . . . 0.0 109.573 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 3.9 m -146.67 153.76 40.65 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.563 1.145 . . . . 0.0 108.086 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -109.96 142.28 41.56 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -128.31 152.89 47.61 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.144 0.978 . . . . 0.0 111.033 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.3 mt -146.03 138.7 25.59 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.031 1.333 . . . . 0.0 107.538 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.24 105.59 5.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.816 1.247 . . . . 0.0 108.996 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 94.7 t -152.11 150.65 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 125.221 1.408 . . . . 0.0 108.925 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.15 101.78 10.79 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.743 1.156 . . . . 0.0 109.836 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.33 106.64 0.41 Allowed Glycine 0 N--CA 1.461 0.364 0 CA-C-O 114.922 -3.155 . . . . 0.0 107.034 177.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -59.0 -57.6 12.34 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 122.454 3.127 . . . . 0.0 114.92 -178.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -65.02 -47.02 78.95 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.395 0.678 . . . . 0.0 109.897 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -62.11 -41.57 98.36 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.221 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . 0.487 ' CE2' ' HB3' ' B' ' 99' ' ' TYR . 80.2 t80 -66.41 -41.48 89.24 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 119.996 1.271 . . . . 0.0 111.188 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.18 -52.79 63.12 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 66.7 mt -58.07 -53.64 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 C-N-CA 124.417 1.087 . . . . 0.0 109.162 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 39.1 mt -56.36 -34.82 67.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 117.625 -1.179 . . . . 0.0 111.447 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.3 mtp -70.52 -43.85 68.75 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.815 1.643 . . . . 0.0 108.585 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -55.34 -51.37 66.97 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 54.0 mt -70.07 -33.28 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.335 1.054 . . . . 0.0 112.964 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -60.45 -60.15 4.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.246 1.385 . . . . 0.0 108.826 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.58 -38.07 89.72 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 117.402 -1.285 . . . . 0.0 109.116 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 19.4 t -52.41 -50.16 63.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 121.266 1.848 . . . . 0.0 111.757 -179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.88 -42.12 73.86 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.41 0.55 . . . . 0.0 111.322 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.47 87.7 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.344 0.658 . . . . 0.0 110.271 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.28 -48.42 34.77 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.826 1.65 . . . . 0.0 109.676 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.6 tpt -59.77 -30.54 68.94 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.938 1.245 . . . . 0.0 110.199 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -75.93 -41.63 51.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.325 1.05 . . . . 0.0 110.454 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.48 -32.45 54.31 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.391 0.996 . . . . 0.0 112.199 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -81.87 147.9 59.62 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.63 1.172 . . . . 0.0 108.723 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -70.24 172.13 13.68 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 N-CA-C 107.582 -1.738 . . . . 0.0 107.582 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -120.85 58.38 6.75 Favored Pre-proline 0 CA--C 1.546 0.812 0 O-C-N 120.676 -1.265 . . . . 0.0 111.43 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -73.29 -59.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.682 2.921 . . . . 0.0 113.749 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.8 -40.9 85.41 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.8 t -51.07 -48.03 30.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.75 1.62 . . . . 0.0 109.53 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 10.8 t70 -65.32 -46.73 79.16 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -49.51 77.57 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 10.0 t80 -59.38 -44.18 92.78 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.346 1.458 . . . . 0.0 109.582 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -54.85 -48.82 72.42 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 117.573 -1.203 . . . . 0.0 110.269 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -68.84 -48.37 63.67 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 119.609 1.095 . . . . 0.0 111.958 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -57.26 -38.42 73.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.811 0.845 . . . . 0.0 110.283 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -81.34 -28.26 34.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.726 1.611 . . . . 0.0 110.963 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -60.36 -37.24 80.09 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.26 -9.92 5.92 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.54 -6.86 58.16 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.647 1.579 . . . . 0.0 109.926 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . 0.403 ' HG2' ' H ' ' D' 1142 ' ' ARG . 22.0 tt0 -112.77 176.61 4.94 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.548 1.539 . . . . 0.0 110.732 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . 0.403 ' H ' ' HG2' ' D' 1141 ' ' GLN . 39.5 mtm180 . . . . . 0 C--O 1.243 0.759 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 N--CA 1.47 0.553 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -76.71 33.27 0.14 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 128.549 2.74 . . . . 0.0 109.923 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -86.36 -10.89 53.48 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 127.65 2.38 . . . . 0.0 114.337 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 42.45 -147.71 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 129.123 2.969 . . . . 0.0 111.556 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 14.4 tp -134.29 108.44 8.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -115.07 168.62 9.76 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 120.226 1.375 . . . . 0.0 110.25 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -145.25 138.18 26.28 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.192 1.397 . . . . 0.0 107.417 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -112.0 97.97 40.38 Favored Pre-proline 0 C--O 1.232 0.165 0 CA-C-O 118.126 -0.94 . . . . 0.0 110.58 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.2 119.76 6.36 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.118 1.878 . . . . 0.0 107.316 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.6 t -143.59 148.57 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.282 1.033 . . . . 0.0 108.77 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.3 100.27 4.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.07 111.27 0.44 Allowed Glycine 0 C--O 1.226 -0.389 0 CA-C-O 116.463 -2.299 . . . . 0.0 108.036 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -59.8 -48.95 79.64 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 122.017 2.908 . . . . 0.0 112.564 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -71.7 -32.04 67.39 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.056 0.455 . . . . 0.0 109.907 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.6 m -65.26 -45.14 85.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.082 1.353 . . . . 0.0 109.272 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -61.35 -48.59 80.58 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.294 1.837 . . . . 0.0 109.437 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -53.7 -48.2 69.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.437 0.637 . . . . 0.0 110.416 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -67.8 -45.26 75.29 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.915 -0.491 . . . . 0.0 111.221 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.2 tp -62.65 -47.47 83.59 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 123.566 0.746 . . . . 0.0 112.876 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.44 -47.11 80.29 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.085 0.554 . . . . 0.0 109.987 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -57.69 -45.92 85.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.625 0.648 . . . . 0.0 111.287 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 65.2 mt -62.36 -52.61 57.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -57.15 -45.74 83.34 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 123.938 0.895 . . . . 0.0 111.47 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -58.9 -51.98 67.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.903 -0.57 . . . . 0.0 110.061 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 80.0 p -61.15 -40.39 93.67 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -67.25 -55.54 13.57 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.692 0.797 . . . . 0.0 109.481 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -56.94 -40.89 77.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.959 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.27 -47.49 85.77 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 119.903 1.229 . . . . 0.0 111.161 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.7 tmm? -57.69 -27.83 63.26 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.569 0.622 . . . . 0.0 110.164 178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -89.55 -27.11 20.48 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.255 -0.903 . . . . 0.0 110.921 178.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.59 -35.08 46.27 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 120.372 1.442 . . . . 0.0 110.35 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 72.9 mt -114.95 70.69 2.5 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.93 -24.92 45.36 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.7 1.6 . . . . 0.0 112.599 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -115.41 -35.46 4.61 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 117.923 -1.037 . . . . 0.0 112.491 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.45 -46.82 88.67 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.555 HG23 HG11 ' B' ' 125' ' ' VAL . 2.7 m -65.21 -46.83 79.08 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.116 1.325 . . . . 0.0 109.867 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.7 mm -61.34 -34.75 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.932 1.293 . . . . 0.0 110.733 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -63.24 -51.49 66.01 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.32 1.048 . . . . 0.0 108.444 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.05 -37.98 84.55 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.35 0.523 . . . . 0.0 111.999 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -53.18 61.26 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -34.98 77.05 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.586 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -57.87 -57.1 14.26 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -54.64 -41.1 69.67 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.455 1.025 . . . . 0.0 110.102 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -57.99 -54.5 46.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.174 0.59 . . . . 0.0 111.519 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -71.94 -35.83 69.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.507 0.594 . . . . 0.0 111.497 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -59.41 -29.62 67.87 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.98 1.312 . . . . 0.0 111.031 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -57.38 -39.67 76.54 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.361 0.982 . . . . 0.0 109.508 179.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -66.58 -47.36 73.01 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -62.43 -28.9 70.12 Favored 'General case' 0 C--N 1.339 0.117 0 CA-C-O 118.715 -0.659 . . . . 0.0 111.865 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -65.0 -40.46 94.98 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.2 tp -70.37 -49.94 43.93 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.367 1.067 . . . . 0.0 109.6 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mp -58.61 -33.09 69.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.208 0.603 . . . . 0.0 110.5 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 50.09 -134.2 1.52 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.553 1.941 . . . . 0.0 111.099 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -138.19 -8.73 1.53 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -131.43 72.65 1.51 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 120.094 1.316 . . . . 0.0 107.533 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.6 p -132.04 -164.73 1.49 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.851 2.06 . . . . 0.0 107.977 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.0 p -137.75 -166.39 1.95 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.751 1.22 . . . . 0.0 108.301 179.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.3 tt -49.94 118.82 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 124.194 0.998 . . . . 0.0 109.528 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.08 159.33 24.76 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.672 0.789 . . . . 0.0 109.867 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.6 t . . . . . 0 C--O 1.255 1.358 0 C-N-CA 127.895 2.478 . . . . 0.0 105.568 178.603 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.488 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 34.0 m -137.34 166.9 22.71 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 126.209 1.803 . . . . 0.0 107.811 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -119.69 140.01 51.34 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -69.42 -16.76 63.56 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 123.677 0.791 . . . . 0.0 111.732 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -82.77 46.13 1.06 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.316 1.055 . . . . 0.0 111.465 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.96 143.46 57.38 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 105.239 -2.134 . . . . 0.0 105.239 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -100.96 130.11 46.9 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -105.92 129.84 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.938 1.695 . . . . 0.0 107.128 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.561 HD23 ' H ' ' B' ' 102' ' ' GLN . 0.6 OUTLIER -126.08 150.18 48.36 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 179.6 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . 0.561 ' H ' HD23 ' B' ' 101' ' ' LEU . 48.9 tt0 -146.33 105.65 3.92 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.951 1.3 . . . . 0.0 113.508 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.4 t -150.48 149.76 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 CA-C-N 120.272 1.396 . . . . 0.0 109.401 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.57 99.27 6.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 121.353 1.888 . . . . 0.0 109.241 178.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.16 133.43 5.29 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 108.125 -1.99 . . . . 0.0 108.125 178.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -67.93 -58.36 4.67 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 119.563 1.681 . . . . 0.0 112.55 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -67.86 -42.48 81.27 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -51.86 -50.37 61.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.973 1.709 . . . . 0.0 111.442 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -69.67 -51.39 35.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 117.774 -1.108 . . . . 0.0 112.0 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.09 -54.45 24.86 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 124.125 0.97 . . . . 0.0 112.651 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.21 -55.35 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 123.413 0.685 . . . . 0.0 110.804 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 89.6 mt -64.9 -28.49 69.57 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.47 -52.02 20.62 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.86 1.209 . . . . 0.0 108.114 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -52.59 -50.53 62.85 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 19.3 mt -63.19 -36.12 82.58 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.032 -0.985 . . . . 0.0 112.14 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . 0.545 ' HE3' HD22 ' D' 1101 ' ' LEU . 11.1 tppt? -58.18 -56.59 20.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 120.404 1.456 . . . . 0.0 109.324 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.15 -33.74 76.48 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 119.232 -0.413 . . . . 0.0 110.618 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.3 t -63.69 -47.23 82.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.286 0.948 . . . . 0.0 109.501 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.44 -48.7 71.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.842 -1.075 . . . . 0.0 109.745 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -56.33 -39.37 72.69 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 119.364 0.984 . . . . 0.0 110.144 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.525 HD12 HG22 ' A' ' 36' ' ' THR . 2.2 mm? -67.35 -47.66 69.78 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.816 -0.552 . . . . 0.0 110.093 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -68.49 -19.42 64.54 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.308 0.504 . . . . 0.0 111.757 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.68 -43.64 20.05 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.088 -1.007 . . . . 0.0 108.692 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -76.38 -32.41 58.57 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . 0.555 HG11 HG23 ' A' ' 36' ' ' THR . 0.9 OUTLIER -94.87 147.57 33.33 Favored Pre-proline 0 N--CA 1.467 0.375 0 CA-C-N 119.45 1.023 . . . . 0.0 109.16 179.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.19 -178.41 3.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.197 1.931 . . . . 0.0 110.905 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.59 48.32 0.35 Allowed Pre-proline 0 CA--C 1.553 1.063 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 -178.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.31 -52.07 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.55 2.167 . . . . 0.0 112.593 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.53 -33.82 73.22 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.502 0.592 . . . . 0.0 109.624 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.14 -43.17 98.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -50.96 71.26 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.721 0.809 . . . . 0.0 111.202 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 74.0 m -66.85 -46.77 74.0 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -58.64 -43.9 89.88 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.733 0.813 . . . . 0.0 109.923 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -48.09 81.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 118.291 -0.861 . . . . 0.0 109.999 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.5 -54.85 40.48 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 118.766 0.712 . . . . 0.0 109.826 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -50.14 66.07 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.435 1.094 . . . . 0.0 111.632 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -65.13 -39.61 93.27 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.337 1.055 . . . . 0.0 110.62 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -56.67 -40.23 75.16 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.183 0.901 . . . . 0.0 109.936 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 56.4 mt -60.07 -24.39 64.54 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.528 0.731 . . . . 0.0 112.463 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.55 -17.2 64.56 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.854 0.862 . . . . 0.0 112.94 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.05 175.0 9.98 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.266 0.939 . . . . 0.0 109.657 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 31.6 mmm180 . . . . . 0 C--O 1.252 1.207 0 C-N-CA 125.449 1.499 . . . . 0.0 111.076 -179.494 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 21.8 p . . . . . 0 N--CA 1.475 0.819 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.09 33.21 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 130.536 3.534 . . . . 0.0 111.882 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -72.81 -43.51 62.63 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.465 1.906 . . . . 0.0 107.717 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 8.3 tt0 77.86 162.49 0.22 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 130.727 3.611 . . . . 0.0 109.906 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -90.2 101.72 14.45 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 3.3 mm? -105.02 167.26 9.82 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.71 137.66 38.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 94.25 23.41 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.16 122.38 9.22 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.735 2.29 . . . . 0.0 108.508 178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 84.4 t -144.67 148.04 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 125.0 1.32 . . . . 0.0 108.496 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.56 101.86 5.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -169.7 128.28 1.63 Allowed Glycine 0 CA--C 1.524 0.612 0 CA-C-O 115.404 -2.887 . . . . 0.0 109.714 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 36.0 mmm-85 -69.91 -50.3 43.51 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 123.25 3.525 . . . . 0.0 111.45 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -69.25 -36.96 77.7 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -58.19 -52.08 67.05 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 125.455 1.502 . . . . 0.0 110.112 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.2 t80 -63.39 -47.37 82.3 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.276 1.03 . . . . 0.0 110.244 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -53.19 -57.48 10.33 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -40.3 90.42 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.239 0.615 . . . . 0.0 111.566 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.55 -44.01 93.38 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.812 -0.613 . . . . 0.0 110.02 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.02 -48.0 72.57 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.89 0.876 . . . . 0.0 109.813 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.32 -48.63 73.87 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.951 0.5 . . . . 0.0 110.362 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 97.8 mt -65.08 -50.36 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -50.46 -46.55 56.81 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 124.37 1.068 . . . . 0.0 110.315 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.87 -49.65 67.36 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.322 -0.847 . . . . 0.0 111.402 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 87.2 p -56.0 -38.87 71.05 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.593 1.088 . . . . 0.0 113.073 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -73.02 -45.83 55.48 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -57.54 -39.15 75.97 Favored 'General case' 0 C--N 1.342 0.265 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -64.04 -45.1 90.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 116.741 -1.6 . . . . 0.0 110.938 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 26.5 ttm -58.49 -43.58 89.07 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.822 1.192 . . . . 0.0 108.381 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -65.67 -34.5 78.35 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.419 0.688 . . . . 0.0 112.251 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -81.09 -36.82 29.9 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.726 1.148 . . . . 0.0 111.806 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 50.1 mt -117.88 65.63 5.27 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 126.016 1.726 . . . . 0.0 111.115 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -74.9 -4.46 15.45 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.509 2.806 . . . . 0.0 113.643 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -138.74 -24.47 0.92 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.368 1.067 . . . . 0.0 111.764 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 1.9 t60 -68.59 -58.03 4.87 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.614 1.165 . . . . 0.0 108.887 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . 0.576 HG23 HG21 ' D' 1125 ' ' VAL . 17.3 m -62.3 -40.53 96.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.391 1.077 . . . . 0.0 110.89 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.92 -43.8 93.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.11 -47.54 84.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.751 -1.118 . . . . 0.0 108.764 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -35.95 64.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.358 1.435 . . . . 0.0 111.929 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -66.1 -53.91 32.13 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -36.63 84.64 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.727 -0.608 . . . . 0.0 111.06 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -59.31 -48.13 82.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.907 1.283 . . . . 0.0 108.75 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -63.09 -44.31 96.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.514 1.052 . . . . 0.0 109.173 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -55.03 -43.03 73.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.996 0.919 . . . . 0.0 110.623 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.56 -42.75 58.23 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.104 0.962 . . . . 0.0 110.326 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -61.87 -34.33 75.82 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 123.938 0.895 . . . . 0.0 110.777 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -59.07 -32.87 70.18 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.922 0.783 . . . . 0.0 109.618 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 6.0 t-160 -75.38 -53.96 7.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 178.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 21.1 mm100 -59.78 -29.52 68.25 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 3.5 t60 -59.39 -36.79 76.47 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.085 0.954 . . . . 0.0 108.975 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 63.9 tp -75.28 -49.92 17.69 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.723 0.809 . . . . 0.0 109.545 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.3 -27.34 67.23 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.908 0.483 . . . . 0.0 110.64 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 47.16 -126.05 1.62 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.639 2.376 . . . . 0.0 111.566 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -142.37 -46.96 0.34 Allowed 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.403 1.081 . . . . 0.0 112.255 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.45 70.29 6.94 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.18 0.9 . . . . 0.0 108.758 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 12.2 p -133.01 -158.63 0.9 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.905 2.082 . . . . 0.0 108.594 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 60.0 p -143.78 -135.97 0.09 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 15.0 tt -67.3 161.23 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 119.208 0.913 . . . . 0.0 110.338 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.33 159.45 43.34 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.771 2.028 . . . . 0.0 106.663 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 C--O 1.255 1.344 0 C-N-CA 125.472 1.509 . . . . 0.0 107.2 179.658 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.78 0 N-CA-C 110.403 -1.079 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.63 178.63 9.65 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 125.084 1.353 . . . . 0.0 108.418 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 4.0 t0 -146.92 149.9 34.12 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -92.63 9.26 35.51 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.273 0.629 . . . . 0.0 110.655 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 33.9 t70 -89.62 25.23 2.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.604 1.962 . . . . 0.0 108.399 177.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 17.3 m -60.02 135.78 57.82 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 119.758 -1.839 . . . . 0.0 109.83 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -101.89 128.99 48.04 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -106.58 155.28 19.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . 0.545 HD22 ' HE3' ' B' ' 116' ' ' LYS . 0.8 OUTLIER -152.48 127.97 10.01 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 179.389 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -119.93 106.2 11.81 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.026 2.13 . . . . 0.0 112.058 -177.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 21.2 t -155.35 150.1 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.962 1.305 . . . . 0.0 110.37 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.44 103.37 11.46 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -140.7 116.98 1.2 Allowed Glycine 0 CA--C 1.51 -0.23 0 N-CA-C 104.615 -3.394 . . . . 0.0 104.615 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 -65.76 -57.7 7.38 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.092 1.946 . . . . 0.0 113.644 -177.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -71.99 -38.85 69.58 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 119.424 1.011 . . . . 0.0 108.414 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -54.73 -50.49 68.24 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.282 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 13.9 t80 -64.69 -42.63 95.2 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 119.562 1.073 . . . . 0.0 110.432 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.12 -54.28 38.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.055 0.843 . . . . 0.0 110.942 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.73 -57.5 10.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 126.668 1.987 . . . . 0.0 111.057 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 57.1 mt -58.89 -36.34 74.51 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.651 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 1.9 tmt? -70.25 -52.13 25.37 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.755 1.161 . . . . 0.0 108.778 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.1 ttmm -51.97 -51.88 54.19 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 65.7 mt -65.7 -32.34 73.84 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.152 -0.928 . . . . 0.0 112.146 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 10.4 tppt? -63.33 -48.29 78.62 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.586 1.539 . . . . 0.0 108.719 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -66.67 -41.53 88.0 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.77 -42.2 75.15 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.513 0.725 . . . . 0.0 110.267 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.88 -52.45 50.07 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.093 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.01 -43.01 86.44 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.588 1.086 . . . . 0.0 110.355 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 2.5 mm? -61.42 -48.97 78.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.44 0.696 . . . . 0.0 110.04 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.45 -28.0 67.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.063 -0.398 . . . . 0.0 111.585 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -80.31 -23.29 40.76 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 126.693 1.997 . . . . 0.0 113.129 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -94.64 -27.51 15.84 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.287 0.635 . . . . 0.0 110.41 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . 0.576 HG21 HG23 ' C' 1036 ' ' THR . 81.2 t -95.2 147.46 33.07 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 124.936 1.294 . . . . 0.0 109.111 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . 0.425 ' HD2' HG13 ' D' 1125 ' ' VAL . 67.3 Cg_endo -71.3 -173.11 0.86 Allowed 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.926 2.417 . . . . 0.0 110.432 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.27 35.71 0.11 Allowed Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 117.749 2.5 . . . . 0.0 117.749 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.73 -51.41 4.97 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 123.446 2.267 . . . . 0.0 114.281 -178.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.26 -40.14 92.97 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.0 t -57.56 -47.77 84.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.434 0 C-N-CA 123.668 0.787 . . . . 0.0 109.406 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 44.5 t0 -60.58 -52.01 66.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.509 1.124 . . . . 0.0 110.465 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 41.3 m -60.9 -42.36 97.88 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.905 -0.497 . . . . 0.0 111.743 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.69 -52.33 39.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.914 0.886 . . . . 0.0 109.517 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.5 69.15 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.262 1.425 . . . . 0.0 111.193 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -67.32 -47.98 68.95 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.492 1.042 . . . . 0.0 110.86 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -58.86 -42.53 89.64 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.224 0.92 . . . . 0.0 109.692 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -65.18 -32.68 74.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.312 1.445 . . . . 0.0 109.2 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -59.54 -44.3 93.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.7 mt -64.39 -11.22 30.58 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.482 1.113 . . . . 0.0 113.577 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 13.2 tp -79.65 -19.34 49.36 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.726 1.148 . . . . 0.0 110.167 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -126.51 177.58 6.41 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.537 1.935 . . . . 0.0 108.666 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 39.7 mmt180 . . . . . 0 C--O 1.248 1.001 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.575 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.0 m . . . . . 0 N--CA 1.472 0.664 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -62.48 -26.55 68.59 Favored 'General case' 0 N--CA 1.464 0.254 0 O-C-N 120.587 -1.32 . . . . 0.0 111.527 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -105.65 7.81 32.85 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.496 1.918 . . . . 0.0 113.837 -179.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -58.2 104.94 0.23 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.563 1.145 . . . . 0.0 111.176 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.8 tp -73.12 106.18 4.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.48 161.08 15.38 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -136.32 116.41 13.37 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.425 2.29 . . . . 0.0 105.797 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.82 105.16 15.4 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -75.23 117.13 4.75 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.325 2.683 . . . . 0.0 110.272 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.7 t -145.11 150.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 123.563 0.745 . . . . 0.0 109.532 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -135.11 102.21 5.12 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.862 -1.149 . . . . 0.0 109.837 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.0 135.2 3.53 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 107.529 -2.229 . . . . 0.0 107.529 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -70.78 -52.25 21.85 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.561 2.181 . . . . 0.0 110.419 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -30.81 64.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.68 1.192 . . . . 0.0 108.888 -179.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.4 m -60.89 -49.92 75.53 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.74 1.216 . . . . 0.0 107.739 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -62.86 -39.9 95.84 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.264 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.46 -57.41 11.31 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.013 0.824 . . . . 0.0 111.704 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 35.6 ttm -57.71 -44.7 86.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.597 0.635 . . . . 0.0 110.359 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.6 mt -59.54 -48.57 81.15 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.382 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.76 -40.95 88.46 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.576 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -58.18 -49.45 76.99 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 120.247 1.385 . . . . 0.0 109.56 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.47 HD11 ' CG2' ' D' 1111 ' ' ILE . 93.5 mt -67.15 -51.57 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.701 -0.625 . . . . 0.0 109.769 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HE3' HG22 ' C' 1010 ' ' VAL . 12.3 tmtt? -56.69 -48.56 77.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 117.814 -1.089 . . . . 0.0 112.146 -178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.19 -55.79 30.37 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.4 m -56.74 -36.36 69.66 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.49 -37.89 50.29 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.981 0.81 . . . . 0.0 111.925 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -63.8 -50.36 69.27 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.269 -0.895 . . . . 0.0 108.692 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.413 HD13 ' HB ' ' B' ' 130' ' ' VAL . 77.3 mt -61.08 -52.08 66.44 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.861 1.265 . . . . 0.0 111.376 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.3 ppp? -56.93 -45.9 82.42 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.267 0.939 . . . . 0.0 111.854 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -74.34 -29.37 61.56 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.254 0.934 . . . . 0.0 112.879 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -71.03 -47.15 60.25 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.955 0.798 . . . . 0.0 110.425 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.1 tp -120.51 75.52 25.31 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 124.855 1.262 . . . . 0.0 108.741 -179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -80.66 67.45 8.63 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.875 3.05 . . . . 0.0 112.764 -178.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -59.44 168.96 1.36 Allowed 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.327 0.651 . . . . 0.0 111.161 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -48.26 -46.59 35.89 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 123.714 0.806 . . . . 0.0 112.267 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -58.2 -51.26 70.5 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.485 1.039 . . . . 0.0 110.766 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.32 -42.26 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.904 1.682 . . . . 0.0 109.704 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.56 -42.82 67.35 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.417 0.687 . . . . 0.0 111.535 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.281 1.433 . . . . 0.0 109.912 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.67 -51.11 70.76 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -55.23 -48.51 73.81 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.412 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -56.91 -42.07 79.26 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.75 0.82 . . . . 0.0 110.818 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -55.04 -54.76 38.95 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.777 1.231 . . . . 0.0 111.497 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -78.23 -40.76 36.37 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.339 0.518 . . . . 0.0 111.709 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -55.61 -41.09 72.94 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.51 1.124 . . . . 0.0 111.713 -178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -54.22 -45.96 72.39 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -69.04 -53.68 19.13 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.168 0.587 . . . . 0.0 110.092 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -52.7 -38.69 61.05 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.193 1.797 . . . . 0.0 113.532 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -56.12 -26.53 50.37 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.108 0.963 . . . . 0.0 113.056 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -66.34 -27.82 68.18 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.772 -1.205 . . . . 0.0 110.134 178.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 mp -95.05 9.6 38.89 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.464 2.306 . . . . 0.0 112.039 178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.3 tp -64.68 -6.24 7.42 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -178.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -76.96 80.47 3.5 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 120.582 1.537 . . . . 0.0 108.884 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -61.01 -35.39 76.73 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 124.584 1.154 . . . . 0.0 111.508 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 26.9 96.89 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 130.262 3.425 . . . . 0.0 114.161 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.7 m 70.16 55.9 0.3 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.655 1.182 . . . . 0.0 111.476 178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -158.56 108.56 2.04 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 120.841 -1.162 . . . . 0.0 110.181 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.0 tt -156.53 141.62 9.06 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 C-N-CA 126.195 1.798 . . . . 0.0 108.588 179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.444 ' HB2' ' HE2' ' B' ' 107' ' ' LYS . 3.1 tt0 -147.0 159.05 44.04 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.668 1.987 . . . . 0.0 107.76 179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 p . . . . . 0 C--O 1.256 1.398 0 CA-C-O 117.275 -1.345 . . . . 0.0 108.745 179.742 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.628 0 N-CA-C 108.911 -1.676 . . . . 0.0 108.911 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 15.0 m 62.96 86.52 0.12 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.689 1.596 . . . . 0.0 113.913 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -144.46 96.36 2.86 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 177.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -139.86 -16.6 0.99 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.087 0.955 . . . . 0.0 113.086 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.94 165.43 17.78 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.049 0.94 . . . . 0.0 109.961 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.96 143.64 48.3 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.275 -0.891 . . . . 0.0 109.572 -178.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -102.4 130.28 49.11 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.59 116.94 27.06 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.567 1.147 . . . . 0.0 108.4 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.52 141.34 35.51 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -140.47 104.35 4.75 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.0 m -155.49 150.57 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 112.011 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -110.75 101.92 10.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 120.214 1.37 . . . . 0.0 108.187 177.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.66 116.13 0.91 Allowed Glycine 0 C--N 1.332 0.342 0 CA-C-O 116.763 -2.132 . . . . 0.0 108.916 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 10.9 tpp180 -66.88 -57.14 7.57 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 121.717 2.759 . . . . 0.0 113.425 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . 0.444 ' HE2' ' HB2' ' A' ' 59' ' ' GLN . 5.5 mptt -66.29 -44.63 82.96 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -52.12 -50.51 61.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 125.756 1.622 . . . . 0.0 110.908 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -63.97 -47.07 81.85 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.942 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -51.21 -53.87 30.97 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 124.063 0.852 . . . . 0.0 110.427 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 86.7 mt -60.17 -58.22 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 125.251 1.42 . . . . 0.0 110.494 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 5.0 mp -55.62 -44.24 76.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 117.824 -1.084 . . . . 0.0 113.232 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 22.4 ttp -62.73 -48.07 80.84 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 119.907 1.231 . . . . 0.0 109.961 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -55.76 -50.94 69.06 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 118.428 0.558 . . . . 0.0 110.274 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 mt -65.51 -30.73 71.53 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 24.8 tptt -64.51 -60.0 3.66 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.65 -44.6 81.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.194 0.998 . . . . 0.0 110.896 -179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 31.0 t -52.55 -46.45 66.82 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.041 0.937 . . . . 0.0 110.33 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.67 -45.88 56.66 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.984 0.514 . . . . 0.0 111.204 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -56.34 -39.88 73.56 Favored 'General case' 0 C--O 1.238 0.473 0 O-C-N 121.672 -0.642 . . . . 0.0 110.343 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.75 -53.88 23.75 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.137 0.975 . . . . 0.0 108.523 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.31 -39.69 67.25 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.833 0.742 . . . . 0.0 112.401 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -73.3 -29.27 62.6 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.372 1.069 . . . . 0.0 110.4 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 20.8 tp -86.31 -33.23 20.67 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.853 -1.154 . . . . 0.0 113.643 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 12.4 m -94.97 148.27 34.43 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 120.019 1.281 . . . . 0.0 110.883 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.62 -174.93 1.19 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.187 1.925 . . . . 0.0 109.066 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -113.58 82.13 6.0 Favored Pre-proline 0 CA--C 1.544 0.713 0 O-C-N 121.614 -0.678 . . . . 0.0 112.244 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -80.86 -102.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.494 0 C-N-CA 124.181 3.254 . . . . 0.0 111.873 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.5 tt -55.27 -35.7 65.31 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 120.541 -1.35 . . . . 0.0 109.99 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.413 ' HB ' HD13 ' A' ' 28' ' ' LEU . 3.7 m -56.39 -37.03 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 C-N-CA 124.351 1.06 . . . . 0.0 112.581 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -77.29 -46.67 22.27 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 6.1 m -56.23 -42.46 77.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 123.385 0.428 . . . . 0.0 110.329 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -67.78 -50.53 56.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 126.168 1.787 . . . . 0.0 108.315 178.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 32.6 ttt85 -52.85 -47.74 67.55 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.601 1.091 . . . . 0.0 111.134 -178.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.85 -42.2 86.12 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.172 0.897 . . . . 0.0 112.559 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.84 -38.28 82.97 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.525 -0.734 . . . . 0.0 110.517 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.57 -46.81 78.0 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.53 -35.11 65.31 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.55 1.54 . . . . 0.0 110.975 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.32 -24.47 29.07 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.356 1.434 . . . . 0.0 111.832 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.4 tt -65.6 -36.7 84.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 110.265 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.29 102.96 4.62 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.68 1.592 . . . . 0.0 111.74 -179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 54.1 ttt-85 . . . . . 0 C--O 1.245 0.841 0 C-N-CA 125.016 1.327 . . . . 0.0 108.69 179.922 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 N--CA 1.467 0.416 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -62.82 -29.95 71.12 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 120.512 -1.368 . . . . 0.0 111.503 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -79.96 2.42 23.61 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.809 2.044 . . . . 0.0 113.909 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.73 99.61 0.16 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 120.142 1.337 . . . . 0.0 110.139 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.1 tp -69.19 95.53 0.76 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.85 0.86 . . . . 0.0 109.247 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.21 170.97 9.02 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.739 1.216 . . . . 0.0 109.519 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -146.12 154.62 42.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.973 1.309 . . . . 0.0 108.532 179.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.0 mt -125.36 91.97 47.91 Favored Pre-proline 0 N--CA 1.45 -0.439 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.94 112.4 3.28 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.592 2.194 . . . . 0.0 107.033 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . 0.5 HG22 ' HE3' ' A' ' 23' ' ' LYS . 46.7 t -144.83 155.7 14.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -135.44 103.76 5.59 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.67 112.69 0.51 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 105.62 -2.992 . . . . 0.0 105.62 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -59.49 -51.91 67.85 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 122.172 2.986 . . . . 0.0 108.615 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -71.04 -39.95 72.0 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.221 1.009 . . . . 0.0 111.145 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -63.51 -42.16 98.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.45 0.7 . . . . 0.0 110.261 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 71.2 t80 -61.68 -45.14 95.29 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.769 1.228 . . . . 0.0 108.89 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -56.64 -50.43 72.08 Favored 'General case' 0 N--CA 1.462 0.161 0 O-C-N 123.28 0.363 . . . . 0.0 110.857 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 1.3 ttm -64.79 -46.08 83.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.117 0.567 . . . . 0.0 111.293 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 46.9 mt -60.46 -46.48 89.91 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.403 -178.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.69 -49.04 70.0 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.301 -0.857 . . . . 0.0 110.265 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -54.91 -49.7 70.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.388 0.675 . . . . 0.0 111.468 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 79.2 mt -70.17 -39.27 76.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 O-C-N 121.647 -0.658 . . . . 0.0 110.372 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -61.26 -45.47 94.37 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.56 0.744 . . . . 0.0 110.752 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -52.26 65.89 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.0 0.92 . . . . 0.0 108.654 -179.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 26.7 m -58.1 -45.87 86.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 123.479 0.712 . . . . 0.0 112.33 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.43 -36.39 81.14 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.869 0.758 . . . . 0.0 111.099 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.59 -48.49 66.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 121.638 -0.664 . . . . 0.0 111.421 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.47 -40.66 70.13 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.071 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 5.2 ppp? -62.49 -40.22 95.99 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.316 0.962 . . . . 0.0 109.928 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -76.21 -34.89 59.27 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 118.961 0.8 . . . . 0.0 111.438 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 59.9 t80 -69.56 -40.06 77.01 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.088 0.858 . . . . 0.0 112.626 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 28.4 tp -126.57 75.2 74.59 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -76.71 79.91 2.94 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.888 3.059 . . . . 0.0 112.179 -178.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -63.38 163.56 10.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.724 1.209 . . . . 0.0 108.631 178.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -55.74 -35.69 66.44 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.041 0.837 . . . . 0.0 110.618 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 5.0 m -56.31 -52.23 65.28 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.697 1.135 . . . . 0.0 110.22 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.96 -46.21 92.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 128.243 2.617 . . . . 0.0 111.424 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -69.87 -47.5 62.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.809 -0.615 . . . . 0.0 111.642 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.7 m -55.12 -39.28 69.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.81 0.844 . . . . 0.0 109.062 179.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -53.58 49.23 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.272 0.629 . . . . 0.0 110.695 178.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -57.49 -44.27 84.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 118.795 -0.621 . . . . 0.0 110.046 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -54.61 -44.09 72.77 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.147 0.579 . . . . 0.0 110.208 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -61.83 -55.29 31.41 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.0 -44.06 73.55 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.86 0.755 . . . . 0.0 112.602 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -55.99 -36.36 67.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.521 1.529 . . . . 0.0 112.308 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -57.37 -36.59 71.42 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.635 0.652 . . . . 0.0 110.862 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -70.29 -53.0 18.66 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.879 0.763 . . . . 0.0 109.487 178.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -53.79 -33.28 55.47 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 124.877 1.271 . . . . 0.0 112.555 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -57.13 -33.45 67.39 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.983 0.81 . . . . 0.0 112.664 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 36.4 m80 -65.52 -32.63 74.33 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.346 0.976 . . . . 0.0 109.935 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 3.8 mp -93.19 7.95 42.18 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.642 1.577 . . . . 0.0 111.768 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 15.8 tp -62.05 -8.2 5.02 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.887 1.222 . . . . 0.0 113.994 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -68.25 72.36 0.19 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.477 2.311 . . . . 0.0 109.157 178.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 2.3 mtpp -65.64 -31.39 72.38 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.11 -0.994 . . . . 0.0 112.219 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 40.5 tt0 24.92 92.89 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.554 3.142 . . . . 0.0 113.393 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 15.2 m 68.03 69.58 0.33 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.375 1.07 . . . . 0.0 110.059 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 4.2 t -168.12 113.68 0.66 Allowed 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.318 1.447 . . . . 0.0 107.101 179.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 19.0 tt -161.8 151.19 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 124.258 1.023 . . . . 0.0 109.837 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . 0.405 HE21 ' HE2' ' D' 1107 ' ' LYS . 2.5 tt0 -146.6 159.62 43.21 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.344 2.258 . . . . 0.0 105.863 177.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 85.9 p . . . . . 0 C--O 1.253 1.259 0 CA-C-O 116.62 -1.657 . . . . 0.0 109.886 -179.219 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.853 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 73.79 89.03 0.09 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 126.442 1.897 . . . . 0.0 109.304 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 11.7 t70 -130.65 85.37 2.27 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.583 2.353 . . . . 0.0 106.042 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -138.95 -46.76 0.48 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.898 1.279 . . . . 0.0 109.077 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 27.9 t0 -55.44 117.3 3.45 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 125.29 1.436 . . . . 0.0 109.192 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.64 149.21 38.24 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.555 1.542 . . . . 0.0 110.035 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -102.38 157.23 17.06 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -137.27 158.02 45.35 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.96 0.504 . . . . 0.0 109.728 -179.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 1.3 mt -152.51 108.68 3.39 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -102.08 98.74 8.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.13 2.572 . . . . 0.0 105.874 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 1.3 m -151.86 151.43 12.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 C-N-CA 124.783 1.233 . . . . 0.0 110.046 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -122.26 102.35 8.07 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 118.994 0.815 . . . . 0.0 112.056 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.42 113.37 0.79 Allowed Glycine 0 CA--C 1.504 -0.621 0 N-CA-C 105.179 -3.168 . . . . 0.0 105.179 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -59.39 -56.85 16.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 119.667 1.734 . . . . 0.0 110.623 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . 0.405 ' HE2' HE21 ' C' 1059 ' ' GLN . 37.9 mttp -62.62 -49.31 75.69 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.289 1.036 . . . . 0.0 108.624 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -52.46 -49.54 64.44 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.89 1.276 . . . . 0.0 111.251 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.5 t80 -65.12 -39.92 93.76 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 119.412 1.005 . . . . 0.0 111.77 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -54.57 -53.56 52.91 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.209 0.913 . . . . 0.0 108.805 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . 0.47 ' CG2' HD11 ' A' ' 22' ' ' ILE . 37.8 mt -62.38 -57.79 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 115.034 -0.984 . . . . 0.0 109.998 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.66 -45.38 81.68 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 116.953 -1.499 . . . . 0.0 113.81 -178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 2.0 ttt -61.79 -49.0 78.09 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 120.851 1.66 . . . . 0.0 109.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -57.31 -52.06 66.87 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.47 -25.89 66.93 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.778 -0.576 . . . . 0.0 112.122 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 12.4 tptt -63.06 -60.54 3.3 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 118.901 0.773 . . . . 0.0 109.303 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.98 -31.95 73.44 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 124.679 1.237 . . . . 0.0 111.459 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 33.4 t -55.16 -51.99 64.72 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.016 0.826 . . . . 0.0 109.173 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.22 -42.89 79.12 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 122.197 0.199 . . . . 0.0 110.878 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -59.19 -45.0 92.22 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.531 -0.73 . . . . 0.0 110.788 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 30.6 mt -65.78 -53.82 35.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.189 0.995 . . . . 0.0 109.773 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.66 -34.24 69.17 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.885 0.766 . . . . 0.0 110.834 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -79.04 -22.21 45.74 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.712 1.142 . . . . 0.0 110.369 178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 48.9 tp -90.48 -34.3 15.63 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 120.688 -1.257 . . . . 0.0 113.124 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 13.8 m -95.28 147.45 33.04 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 119.763 1.165 . . . . 0.0 110.832 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -71.0 178.04 5.78 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.075 1.85 . . . . 0.0 108.721 178.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -108.89 87.85 4.93 Favored Pre-proline 0 CA--C 1.547 0.85 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -84.98 -100.45 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.327 0 C-N-CA 124.048 3.165 . . . . 0.0 108.884 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.8 -32.99 64.0 Favored 'General case' 0 C--O 1.223 -0.342 0 C-N-CA 126.545 1.938 . . . . 0.0 111.269 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 4.1 m -56.9 -41.33 76.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 118.869 0.758 . . . . 0.0 110.755 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -74.68 -45.45 44.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.416 1.086 . . . . 0.0 109.425 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 43.5 m -61.31 -38.47 86.98 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 20.2 t80 -67.28 -52.58 38.97 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 124.911 1.285 . . . . 0.0 107.699 178.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -48.24 69.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.394 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -61.71 -53.9 49.79 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.819 0.736 . . . . 0.0 111.42 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -58.14 -40.51 81.52 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.806 -0.558 . . . . 0.0 111.425 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.69 -33.61 71.1 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.852 0.861 . . . . 0.0 110.144 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.64 -32.86 73.97 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.912 1.285 . . . . 0.0 108.912 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 77.3 mt -54.75 -25.31 26.95 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.112 0.869 . . . . 0.0 112.387 178.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.3 tt -74.1 -30.27 62.26 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.219 1.408 . . . . 0.0 111.054 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.39 96.0 2.88 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.952 -1.092 . . . . 0.0 112.01 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 0.997 0 CA-C-O 116.185 -1.864 . . . . 0.0 109.643 179.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.465 0.287 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.21 -9.14 19.85 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.227 -0.92 . . . . 0.0 112.283 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -79.49 -12.46 59.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.866 1.266 . . . . 0.0 113.646 -179.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.72 106.13 1.13 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.877 1.271 . . . . 0.0 111.008 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 47.6 tp -72.0 118.01 14.34 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.832 0.853 . . . . 0.0 108.777 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.2 mp -113.92 162.45 16.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.369 1.867 . . . . 0.0 107.388 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -135.23 124.25 24.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.13 96.05 1.13 Allowed Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.49 1.516 . . . . 0.0 108.782 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.31 103.51 1.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.489 2.793 . . . . 0.0 112.021 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -138.61 156.16 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.514 -1.366 . . . . 0.0 109.14 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.8 ptt180 -135.31 103.11 5.39 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 104.743 -2.317 . . . . 0.0 104.743 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 114.53 0.59 Allowed Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 106.716 -2.554 . . . . 0.0 106.716 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.0 tpt85 -64.52 -51.04 64.95 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 120.519 2.16 . . . . 0.0 110.535 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.46 -32.47 71.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.805 0.73 . . . . 0.0 110.684 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -66.64 -50.93 61.35 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 110.28 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -56.87 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.877 0.871 . . . . 0.0 109.015 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -55.65 -49.5 72.74 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.418 0.287 . . . . 0.0 110.587 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 2.6 ttm -61.17 -47.25 87.04 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.67 0.668 . . . . 0.0 111.281 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.64 -32.07 73.44 Favored 'General case' 0 C--O 1.227 -0.099 0 CA-C-O 118.53 -0.748 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -71.23 -53.97 12.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.468 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.05 -48.83 77.59 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.121 0.968 . . . . 0.0 111.181 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.0 mt -71.98 -36.96 59.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 O-C-N 121.527 -0.733 . . . . 0.0 111.574 -178.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -66.31 -52.44 47.21 Favored 'General case' 0 CA--C 1.516 -0.355 0 O-C-N 121.063 -1.023 . . . . 0.0 109.228 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.64 -37.31 87.14 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.938 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -56.13 -52.11 65.5 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 119.289 0.95 . . . . 0.0 109.459 179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -65.98 -48.43 71.27 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.11 0.564 . . . . 0.0 111.666 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -50.59 73.22 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-N 118.416 0.553 . . . . 0.0 111.149 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -64.11 -38.86 92.6 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 117.692 -1.147 . . . . 0.0 109.786 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.43 -28.94 67.41 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.22 1.008 . . . . 0.0 110.208 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -90.98 -30.79 16.62 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.468 -0.77 . . . . 0.0 111.018 178.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -78.67 -25.32 44.87 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 118.149 -0.929 . . . . 0.0 113.206 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.3 pp -77.45 163.39 64.42 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -85.32 152.32 10.65 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 121.581 1.521 . . . . 0.0 108.786 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.46 -2.97 0.14 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.315 2.246 . . . . 0.0 115.544 -179.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -47.89 -58.66 4.1 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.323 1.449 . . . . 0.0 113.351 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.2 m -66.6 -32.58 74.01 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.55 -178.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 22.0 mm -62.27 -47.42 93.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -59.99 -53.94 51.86 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.661 0.785 . . . . 0.0 110.909 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.6 m -58.08 -50.17 74.38 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.384 1.874 . . . . 0.0 110.51 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.97 -49.41 77.96 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.507 0.723 . . . . 0.0 110.014 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.0 mtp85 -58.92 -43.19 91.05 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -61.32 -55.06 36.02 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.317 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -53.19 -54.31 37.76 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.924 0.89 . . . . 0.0 110.381 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -53.6 -47.92 69.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.037 1.335 . . . . 0.0 111.153 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -67.42 -46.09 74.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.71 0.804 . . . . 0.0 111.484 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -59.4 -42.37 91.61 Favored 'General case' 0 CA--C 1.528 0.1 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -59.81 -29.48 68.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 118.033 -0.984 . . . . 0.0 111.746 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -65.42 -54.41 29.06 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 106.146 -1.798 . . . . 0.0 106.146 177.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.31 -49.28 67.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.865 0.866 . . . . 0.0 109.084 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -58.5 -30.04 66.72 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.2 1.0 . . . . 0.0 113.551 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.08 -34.49 29.35 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.743 1.156 . . . . 0.0 109.376 179.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 mp -67.98 -45.61 73.64 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -69.46 167.03 17.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.014 1.726 . . . . 0.0 108.814 179.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -131.34 53.51 1.98 Allowed 'General case' 0 N--CA 1.462 0.142 0 O-C-N 121.374 -0.829 . . . . 0.0 109.426 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -148.98 161.08 42.63 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 125.724 1.61 . . . . 0.0 107.659 179.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.8 p -79.17 163.41 25.05 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.953 0.901 . . . . 0.0 110.616 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.9 t -68.72 139.08 55.37 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.3 tt -161.11 136.63 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 179.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -146.4 158.68 43.92 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.259 1.566 0 C-N-CA 128.596 2.758 . . . . 0.0 105.905 178.581 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.908 0 N-CA-C 110.744 -0.942 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 37.2 m -135.9 -179.23 5.53 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.528 1.931 . . . . 0.0 109.64 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -63.86 70.42 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 127.599 2.36 . . . . 0.0 114.364 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -139.66 -34.66 0.56 Allowed 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 129.148 2.979 . . . . 0.0 107.997 178.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . 0.252 2.7 t70 55.56 -138.45 1.05 Allowed 'General case' 0 C--O 1.236 0.39 0 C-N-CA 126.794 2.037 . . . . 0.0 110.738 -179.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 23.2 m -153.39 158.33 41.31 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 120.983 1.72 . . . . 0.0 107.977 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -111.0 139.57 46.24 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -124.75 144.1 50.42 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.874 1.67 . . . . 0.0 110.691 -177.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.6 mp -131.17 145.77 52.08 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.487 1.515 . . . . 0.0 108.872 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -145.64 107.4 4.28 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.133 1.773 . . . . 0.0 108.357 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 70.7 t -155.63 151.16 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 127.306 2.242 . . . . 0.0 108.498 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -107.51 101.71 11.03 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 105.879 -1.897 . . . . 0.0 105.879 177.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -142.73 114.54 0.87 Allowed Glycine 0 CA--C 1.523 0.563 0 CA-C-O 116.851 -2.083 . . . . 0.0 108.092 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -68.17 -58.48 4.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.854 2.827 . . . . 0.0 113.963 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -62.74 -46.44 88.07 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -54.97 -44.53 74.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 124.302 1.001 . . . . 0.0 112.031 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -65.21 -48.58 72.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 120.078 1.308 . . . . 0.0 110.789 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -58.7 -49.44 77.58 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.645 1.111 . . . . 0.0 110.816 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 68.8 mt -61.51 -53.68 45.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.312 1.445 . . . . 0.0 111.311 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 8.8 mt -63.58 -35.83 81.79 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 117.476 -1.25 . . . . 0.0 110.573 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 30.5 mtp -62.13 -46.66 88.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 120.491 1.496 . . . . 0.0 110.87 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -64.21 -51.83 61.78 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.924 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 85.3 mt -60.68 -34.82 74.91 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 8.5 tppt? -63.73 -53.83 44.91 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -62.51 -45.75 91.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 123.7 0.625 . . . . 0.0 111.95 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 22.5 m -57.09 -38.53 73.5 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.524 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -45.28 72.59 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.851 0.751 . . . . 0.0 109.77 179.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -58.84 -44.54 90.97 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.85 -32.82 69.96 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.535 -0.728 . . . . 0.0 110.086 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 27.0 ttt -66.97 -40.99 87.6 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.73 -31.37 72.33 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 118.46 0.573 . . . . 0.0 110.638 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 tp -71.53 -34.28 69.91 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.341 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.2 m -94.51 148.95 35.82 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 119.424 1.011 . . . . 0.0 112.636 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.5 -91.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.918 0 N-CA-C 107.395 -1.809 . . . . 0.0 107.395 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -160.96 57.82 0.91 Allowed Pre-proline 0 CA--C 1.546 0.793 0 CA-C-N 120.99 1.723 . . . . 0.0 111.341 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -63.37 -88.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.868 2.379 . . . . 0.0 112.365 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.91 -25.77 67.3 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 121.419 -0.8 . . . . 0.0 109.365 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.6 t -56.83 -55.0 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.521 1.129 . . . . 0.0 108.712 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -67.16 -42.1 84.89 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.405 1.002 . . . . 0.0 110.53 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.6 -49.76 69.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.889 0.476 . . . . 0.0 111.256 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -70.36 -48.62 55.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.681 1.592 . . . . 0.0 110.344 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -56.54 -41.44 76.83 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.289 0.95 . . . . 0.0 110.47 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -63.58 -51.74 64.03 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.275 0.943 . . . . 0.0 108.823 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -55.3 -41.92 72.98 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.492 0.717 . . . . 0.0 109.602 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -71.54 -28.12 63.65 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.386 -0.821 . . . . 0.0 110.475 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -63.05 -36.36 83.32 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 34.1 mt -66.48 -2.74 4.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.798 0.839 . . . . 0.0 111.861 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -99.8 -9.82 22.52 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.726 2.01 . . . . 0.0 110.11 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -114.95 116.8 29.08 Favored 'General case' 0 CA--C 1.517 -0.318 0 O-C-N 120.823 -1.173 . . . . 0.0 108.246 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 12.8 mtp85 . . . . . 0 C--O 1.247 0.941 0 N-CA-C 105.908 -1.886 . . . . 0.0 105.908 -179.799 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 121.565 0.698 . . . . 0.0 111.61 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 1.1 t70 -103.39 19.79 19.05 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 124.935 1.294 . . . . 0.0 110.815 179.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 65.5 t0 -130.92 40.34 3.49 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.367 2.267 . . . . 0.0 109.547 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -102.0 105.67 16.47 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 103.083 -2.932 . . . . 0.0 103.083 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.59 106.9 0.72 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.64 165.58 12.64 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 125.145 1.378 . . . . 0.0 108.973 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -135.06 149.66 50.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.251 1.421 . . . . 0.0 107.481 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.6 89.73 45.0 Favored Pre-proline 0 CA--C 1.54 0.567 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 178.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.05 111.28 3.24 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.6 2.867 . . . . 0.0 111.68 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 50.2 t -145.61 162.28 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 124.123 0.969 . . . . 0.0 109.03 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . 0.413 ' HG2' HH11 ' C' 1011 ' ' ARG . 8.7 ptt-85 -134.91 104.76 6.1 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 103.438 -2.801 . . . . 0.0 103.438 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.04 108.94 0.33 Allowed Glycine 0 C--O 1.227 -0.292 0 CA-C-O 117.206 -1.886 . . . . 0.0 109.15 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 26.8 tpt85 -61.03 -52.76 63.61 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.818 2.309 . . . . 0.0 112.565 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -77.52 -30.83 53.06 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.348 -0.845 . . . . 0.0 112.192 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -40.29 76.82 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 41.3 t80 -62.33 -51.33 68.05 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -49.84 -57.36 7.56 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.011 0.924 . . . . 0.0 110.952 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 7.9 tmm? -60.39 -49.06 79.06 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.7 -34.42 78.26 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 119.15 0.886 . . . . 0.0 111.267 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.0 mm? -68.14 -48.28 65.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 119.542 1.065 . . . . 0.0 109.613 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -58.8 -48.78 80.08 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.317 0.647 . . . . 0.0 110.447 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 20.4 mt -67.79 -44.33 85.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-N 118.191 0.45 . . . . 0.0 111.292 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -63.08 -46.07 89.13 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 119.003 0.82 . . . . 0.0 109.028 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -60.37 -48.74 80.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.893 0.877 . . . . 0.0 108.773 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 20.4 t -53.45 -52.07 60.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 123.718 0.807 . . . . 0.0 111.247 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.44 -58.06 6.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.289 1.435 . . . . 0.0 112.831 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -46.67 88.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -177.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.29 -39.59 92.74 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 117.69 -1.148 . . . . 0.0 109.684 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -59.12 -31.75 69.22 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.034 0.833 . . . . 0.0 109.322 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -80.68 -30.56 36.48 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.846 0.748 . . . . 0.0 110.842 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -75.88 -45.63 34.49 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.318 1.047 . . . . 0.0 113.135 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 4.6 pp -64.23 149.89 93.56 Favored Pre-proline 0 C--O 1.24 0.558 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -70.45 150.03 63.38 Favored 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 122.181 1.921 . . . . 0.0 108.835 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.46 -3.65 0.31 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.582 2.353 . . . . 0.0 116.85 -178.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 11.5 m170 -47.72 -57.75 5.16 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.778 1.631 . . . . 0.0 114.346 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 1.9 m -65.41 -36.2 83.21 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.52 -1.362 . . . . 0.0 110.948 -179.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 5.4 mm -59.47 -44.26 92.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 119.613 1.097 . . . . 0.0 108.209 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.29 -58.32 9.14 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.455 1.102 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 53.1 m -61.33 -31.34 71.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.609 0.764 . . . . 0.0 111.924 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.11 -53.72 18.75 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.73 -41.25 81.44 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 122.993 0.517 . . . . 0.0 110.46 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -55.67 -57.54 11.54 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.253 1.021 . . . . 0.0 110.557 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -68.2 -35.78 78.52 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.887 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -57.79 -48.6 79.23 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.391 0.996 . . . . 0.0 109.545 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -68.27 -29.81 68.69 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.492 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -72.05 -50.48 28.03 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 120.248 1.386 . . . . 0.0 109.494 177.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -52.15 -43.6 64.16 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 127.178 2.191 . . . . 0.0 114.207 -178.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 64.3 m80 -59.08 -45.25 91.32 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.031 0.832 . . . . 0.0 109.535 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.69 -40.13 80.19 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.634 -0.698 . . . . 0.0 109.62 179.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 36.4 m170 -58.73 -39.85 82.07 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.407 1.003 . . . . 0.0 110.37 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 36.1 mt -73.6 -30.67 63.14 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-O 118.652 -0.689 . . . . 0.0 110.662 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 8.1 mt -70.66 -45.05 65.84 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -72.47 177.37 4.67 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.637 1.975 . . . . 0.0 109.774 179.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 67.3 mttm -133.19 44.76 2.79 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 126.176 1.79 . . . . 0.0 109.008 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -142.65 154.77 44.66 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.097 0.959 . . . . 0.0 108.567 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 15.5 p -76.16 166.75 23.02 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 122.005 0.907 . . . . 0.0 110.061 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 40.2 t -74.8 153.56 38.7 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 18.1 tt -155.18 157.24 4.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -146.45 158.52 43.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 C--O 1.258 1.551 0 C-N-CA 129.991 3.316 . . . . 0.0 105.021 178.589 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.524 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 2.8 t -157.88 -156.55 0.58 Allowed 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 126.686 1.994 . . . . 0.0 106.488 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.84 72.79 2.76 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.536 0.684 . . . . 0.0 110.379 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -139.65 -22.23 0.89 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.775 2.43 . . . . 0.0 110.729 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 3.7 t70 43.89 -129.79 0.84 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 128.515 2.726 . . . . 0.0 113.518 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 79.6 m -158.35 158.72 34.83 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.865 1.666 . . . . 0.0 108.778 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.09 144.46 49.3 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.56 161.12 32.22 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.822 1.249 . . . . 0.0 112.248 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.0 mp -145.36 133.07 21.01 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.34 106.75 9.73 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 104.351 -2.463 . . . . 0.0 104.351 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 40.1 t -152.49 142.25 14.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 118.52 0.6 . . . . 0.0 109.601 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.8 100.62 9.82 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.39 115.06 0.84 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.365 -2.694 . . . . 0.0 106.365 177.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -57.77 10.68 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.682 2.741 . . . . 0.0 111.823 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 22.0 mmtt -63.31 -48.55 77.58 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -52.16 -44.17 64.48 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 123.929 0.892 . . . . 0.0 111.71 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 27.8 t80 -67.08 -50.08 62.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.061 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.33 -49.28 74.8 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.169 0.895 . . . . 0.0 110.945 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.79 -53.43 48.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 124.79 1.236 . . . . 0.0 109.61 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.75 -28.03 68.74 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.162 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 7.7 mtp -64.89 -51.8 60.0 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 120.401 1.455 . . . . 0.0 109.834 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.91 -48.22 82.58 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 123.412 0.445 . . . . 0.0 110.245 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 119.281 -0.39 . . . . 0.0 111.211 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 5.8 tppt? -55.78 -54.93 38.41 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.733 0.813 . . . . 0.0 108.896 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -58.74 -53.83 53.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.764 1.226 . . . . 0.0 110.425 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 38.2 m -56.78 -42.71 79.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.323 -0.846 . . . . 0.0 112.575 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.81 -34.8 78.98 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.761 1.164 . . . . 0.0 110.367 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -68.2 -40.35 82.21 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . 0.401 HD13 ' HA ' ' D' 1121 ' ' LEU . 3.7 mm? -69.85 -35.34 74.64 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.28 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 8.2 ttt -61.27 -49.98 74.87 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.2 -28.84 68.41 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.011 0.823 . . . . 0.0 111.301 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.8 tm? -68.97 -32.91 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.387 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 32.3 m -91.08 147.04 34.82 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 119.897 1.226 . . . . 0.0 111.448 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -72.32 -79.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.927 2.418 . . . . 0.0 111.058 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -165.44 64.24 0.98 Allowed Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.003 1.321 . . . . 0.0 109.834 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -80.78 -106.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 123.664 2.909 . . . . 0.0 113.264 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.62 -32.12 68.73 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.757 1.223 . . . . 0.0 110.145 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 14.1 t -54.24 -53.79 26.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.124 1.37 . . . . 0.0 109.277 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.32 -40.41 95.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.795 1.638 . . . . 0.0 110.981 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 22.9 t -61.91 -50.6 71.54 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.67 -33.39 74.83 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.197 0.599 . . . . 0.0 109.945 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -59.17 -47.23 86.06 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -60.58 -51.99 67.05 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -53.75 -44.71 70.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.794 1.238 . . . . 0.0 112.509 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.23 -29.16 57.45 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.245 -0.909 . . . . 0.0 111.055 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 30.7 tp60 -63.89 -35.3 80.2 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.258 -0.901 . . . . 0.0 109.312 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.14 -31.94 61.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.446 0.699 . . . . 0.0 111.357 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.15 -16.36 63.62 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.405 0.682 . . . . 0.0 112.49 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -104.46 83.59 2.07 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 120.587 -1.321 . . . . 0.0 109.623 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 . . . . . 0 C--O 1.255 1.36 0 C-N-CA 126.875 2.07 . . . . 0.0 110.714 179.306 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.482 1.164 0 CA-C-O 122.964 1.364 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -59.41 11.19 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 1 C-N-CA 132.725 4.41 . . . . 0.0 114.841 179.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -72.71 5.28 3.24 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.707 -1.246 . . . . 0.0 110.441 178.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -61.66 108.72 1.03 Allowed 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 127.749 2.42 . . . . 0.0 106.58 178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.6 tp -76.7 101.58 5.84 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 124.206 1.002 . . . . 0.0 108.771 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.6 mt -94.53 158.67 15.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 106.76 -1.571 . . . . 0.0 106.76 179.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -129.69 123.04 30.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 108.436 -0.949 . . . . 0.0 108.436 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -98.07 99.34 6.81 Favored Pre-proline 0 N--CA 1.447 -0.586 0 C-N-CA 124.033 0.933 . . . . 0.0 109.346 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.06 126.85 10.19 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.383 2.056 . . . . 0.0 107.259 177.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.3 t -146.05 146.27 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 119.203 0.911 . . . . 0.0 109.825 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.6 ptt85 -135.97 101.17 4.64 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.44 130.96 2.22 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 105.209 -3.156 . . . . 0.0 105.209 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.6 tpp85 -70.18 -52.07 26.23 Favored 'General case' 0 CA--C 1.524 -0.047 0 CA-C-N 120.869 2.334 . . . . 0.0 111.08 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -70.37 -34.72 72.93 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -57.28 -42.66 82.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.825 0.85 . . . . 0.0 108.717 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -67.0 -53.13 34.27 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 118.521 -0.752 . . . . 0.0 109.115 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -52.84 -57.23 10.91 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.162 0.985 . . . . 0.0 111.798 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -57.76 -53.6 56.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.594 0.758 . . . . 0.0 111.683 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -46.81 83.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.946 0.899 . . . . 0.0 112.119 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tt -67.79 -55.5 12.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.809 1.643 . . . . 0.0 111.275 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.26 -48.44 74.0 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 118.505 -0.76 . . . . 0.0 111.548 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.9 mt -61.37 -46.32 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 119.289 0.95 . . . . 0.0 108.913 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.3 tmtt? -55.9 -39.24 71.31 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-O 116.889 -1.529 . . . . 0.0 110.087 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -64.98 -39.5 93.58 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.71 1.141 . . . . 0.0 111.316 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.64 -52.03 66.88 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.787 0.722 . . . . 0.0 110.996 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -70.09 -37.74 75.49 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.183 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -61.77 -54.14 46.47 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-O 117.879 -1.057 . . . . 0.0 109.136 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.43 -38.98 91.52 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.577 1.08 . . . . 0.0 110.566 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.3 ttt -58.05 -32.93 68.48 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.387 0.54 . . . . 0.0 109.8 178.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -88.91 -39.37 13.83 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.296 1.038 . . . . 0.0 111.468 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.438 1.095 . . . . 0.0 111.402 -179.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -136.84 75.96 47.87 Favored Pre-proline 0 CA--C 1.535 0.377 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -81.06 48.02 2.76 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 124.378 3.385 . . . . 0.0 112.16 -178.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -145.17 -58.85 0.35 Allowed 'General case' 0 C--O 1.221 -0.44 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.255 -179.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -47.82 -57.21 5.91 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.086 1.354 . . . . 0.0 112.984 -178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.72 -44.18 77.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 119.19 0.904 . . . . 0.0 112.747 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.8 mm -66.37 -43.62 91.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 124.831 1.252 . . . . 0.0 110.337 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.01 -52.81 63.97 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.208 2.203 . . . . 0.0 108.488 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.9 m -65.18 -39.47 92.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.947 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.08 -46.78 87.4 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 119.974 1.261 . . . . 0.0 108.977 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -48.35 69.26 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.165 0.986 . . . . 0.0 109.258 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -64.04 -55.68 20.5 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.201 1.4 . . . . 0.0 111.531 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -58.33 -38.19 76.64 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.919 1.236 . . . . 0.0 112.346 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -63.37 -51.2 66.86 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -62.01 -41.24 97.85 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.276 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -50.83 -39.86 54.34 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.919 1.288 . . . . 0.0 112.491 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -57.8 -43.21 85.52 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.586 0.63 . . . . 0.0 110.177 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -75.15 -44.78 44.88 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.93 0.892 . . . . 0.0 109.126 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -51.99 -41.62 62.32 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 126.728 2.011 . . . . 0.0 110.744 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -57.88 -31.16 66.45 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.183 0.993 . . . . 0.0 111.847 179.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.0 mt -93.51 -34.23 13.46 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.597 1.159 . . . . 0.0 111.364 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 25.2 tp -71.79 -54.77 9.12 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.421 1.089 . . . . 0.0 111.052 -179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.5 38.0 0.14 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.061 2.144 . . . . 0.0 112.217 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -61.02 107.04 0.66 Allowed 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -45.88 141.41 3.08 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.348 1.459 . . . . 0.0 111.678 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.3 m -140.89 159.7 41.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.681 1.992 . . . . 0.0 106.09 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 t -83.65 172.65 12.09 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.183 0.447 . . . . 0.0 109.884 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.6 tt -155.74 167.64 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 127.688 2.395 . . . . 0.0 106.424 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -145.06 159.13 43.44 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 125.578 1.551 . . . . 0.0 108.032 179.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--O 1.257 1.489 0 C-N-CA 129.252 3.021 . . . . 0.0 105.46 179.007 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.388 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 72.3 m -144.29 116.01 8.21 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.069 1.348 . . . . 0.0 109.449 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -119.87 13.5 12.3 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 127.091 2.156 . . . . 0.0 111.59 179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -51.78 -47.05 64.34 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.517 1.527 . . . . 0.0 114.312 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -151.5 146.6 26.02 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.206 1.002 . . . . 0.0 109.53 -178.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 5.1 m -156.99 159.52 38.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.688 1.995 . . . . 0.0 106.631 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -101.37 144.84 29.7 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -126.16 159.03 34.02 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.52 0.728 . . . . 0.0 109.802 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 6.0 mp -139.69 152.28 46.57 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -142.89 98.49 3.29 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.167 1.787 . . . . 0.0 107.968 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.53 150.81 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 123.496 0.719 . . . . 0.0 111.074 -178.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -116.66 102.77 9.73 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . 0.483 ' HA3' HD22 ' B' ' 108' ' ' ASN . . . -142.81 124.36 2.35 Favored Glycine 0 C--N 1.331 0.257 0 N-CA-C 107.564 -2.214 . . . . 0.0 107.564 177.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -67.62 -58.08 5.3 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 120.481 2.14 . . . . 0.0 110.424 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -65.9 -40.92 91.96 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 121.533 -0.729 . . . . 0.0 109.579 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.483 HD22 ' HA3' ' B' ' 105' ' ' GLY . 84.5 m-20 -55.27 -50.55 69.22 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.437 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.62 -47.39 86.41 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.671 -178.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -53.86 49.82 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.764 0.793 . . . . 0.0 111.092 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 89.9 mt -61.01 -56.06 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.104 1.761 . . . . 0.0 111.506 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -61.6 -39.53 91.55 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 118.469 -0.777 . . . . 0.0 111.219 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 15.3 ttt -66.96 -52.33 44.2 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 119.168 0.895 . . . . 0.0 108.873 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -52.32 -52.05 55.26 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.183 0.593 . . . . 0.0 110.466 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.85 -38.38 79.74 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 118.207 -0.901 . . . . 0.0 112.859 -178.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 12.3 tptp -66.36 -41.84 88.91 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 120.525 1.511 . . . . 0.0 110.232 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -61.43 -44.36 97.26 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.803 1.241 . . . . 0.0 107.831 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 24.7 t -61.12 -44.9 96.63 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.999 1.32 . . . . 0.0 109.799 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -68.42 -31.83 71.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 117.223 -1.37 . . . . 0.0 110.319 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -60.91 -43.13 99.0 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 121.222 1.828 . . . . 0.0 107.723 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.24 -53.95 41.1 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.823 0.849 . . . . 0.0 110.373 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 17.2 tpt -62.36 -30.25 71.04 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -77.38 -29.19 53.13 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.921 -1.112 . . . . 0.0 110.032 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.94 -33.45 22.68 Favored 'General case' 0 C--N 1.344 0.349 0 O-C-N 121.241 -0.912 . . . . 0.0 113.34 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -95.83 148.83 35.17 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 126.59 1.956 . . . . 0.0 112.184 -179.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -70.49 -179.54 3.32 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.423 2.082 . . . . 0.0 111.037 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -113.21 46.91 0.35 Allowed Pre-proline 0 CA--C 1.557 1.232 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -178.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -64.4 -65.99 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.879 2.386 . . . . 0.0 113.036 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.48 -26.69 68.04 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.298 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.25 -56.74 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.595 1.089 . . . . 0.0 109.092 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -65.91 -31.95 73.17 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.805 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.91 -51.15 43.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.589 -0.72 . . . . 0.0 111.479 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.63 -34.09 77.11 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.744 1.156 . . . . 0.0 109.811 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -60.32 -48.65 80.85 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.745 0.818 . . . . 0.0 109.225 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.44 -41.6 65.97 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 123.048 0.539 . . . . 0.0 110.715 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -58.13 -46.08 86.24 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.928 0.891 . . . . 0.0 109.471 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -76.1 -28.59 57.57 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.59 0.756 . . . . 0.0 110.084 179.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -61.74 -31.6 71.79 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.259 0.936 . . . . 0.0 109.12 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -6.52 0.98 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.982 1.313 . . . . 0.0 113.272 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 18.2 tp -88.56 -0.73 57.55 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.018 1.327 . . . . 0.0 109.963 177.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -68.68 172.36 6.44 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 124.963 1.305 . . . . 0.0 112.095 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 . . . . . 0 C--O 1.25 1.096 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 178.452 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.467 0.396 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -55.95 -8.53 0.45 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 128.868 2.867 . . . . 0.0 114.918 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -72.33 0.8 9.07 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.377 1.071 . . . . 0.0 111.17 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -58.17 111.83 1.33 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.997 1.319 . . . . 0.0 108.888 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 24.6 tp -72.42 102.53 3.21 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.123 0.969 . . . . 0.0 109.384 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 59.4 mt -109.42 170.85 7.8 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 124.293 1.037 . . . . 0.0 109.436 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -138.05 152.73 49.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.37 100.04 17.0 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -79.6 115.66 3.41 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.567 2.845 . . . . 0.0 110.138 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 78.1 t -144.74 152.11 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 119.649 1.113 . . . . 0.0 110.194 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.15 102.51 5.21 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 106.174 -1.787 . . . . 0.0 106.174 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.17 113.66 0.55 Allowed Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 104.107 -3.597 . . . . 0.0 104.107 179.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -51.13 69.08 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 120.057 1.928 . . . . 0.0 113.048 -177.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -75.34 -34.14 61.16 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.299 1.039 . . . . 0.0 109.358 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 5.5 m -59.28 -50.21 74.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.962 1.305 . . . . 0.0 107.963 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 67.0 t80 -58.7 -51.21 70.91 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.857 1.663 . . . . 0.0 109.404 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.4 -42.33 99.35 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.49 1.041 . . . . 0.0 112.752 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.0 ttm -60.64 -50.59 72.89 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.76 -44.69 93.74 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.215 1.406 . . . . 0.0 111.569 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.42 -55.75 30.73 Favored 'General case' 0 CA--C 1.512 -0.486 0 C-N-CA 124.322 1.049 . . . . 0.0 111.482 -179.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -41.38 79.29 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.982 0.356 . . . . 0.0 111.543 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . 0.479 HG23 HD22 ' D' 1115 ' ' LEU . 81.2 mt -66.99 -43.18 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 121.655 0.74 . . . . 0.0 110.3 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -66.51 -44.83 81.48 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 120.794 -1.191 . . . . 0.0 109.021 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -62.97 -39.61 95.22 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 117.997 -1.002 . . . . 0.0 111.169 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 55.4 p -61.18 -50.44 73.13 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.08 0.855 . . . . 0.0 110.409 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -68.82 -42.47 77.2 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.911 -178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.62 -51.0 71.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . 0.657 HD22 HG23 ' D' 1130 ' ' VAL . 42.7 tp -62.25 -43.78 98.05 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.786 0.721 . . . . 0.0 109.744 179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 22.3 ttt -57.89 -35.26 70.77 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.642 0.777 . . . . 0.0 111.137 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -79.28 -49.14 12.93 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.311 1.444 . . . . 0.0 111.14 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 24.2 t80 -71.63 -23.87 61.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.749 2.02 . . . . 0.0 113.862 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 8.4 tp -142.12 73.61 21.92 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 77.1 Cg_endo -76.25 -4.89 15.65 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 124.11 3.206 . . . . 0.0 112.513 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -82.95 -69.73 0.61 Allowed 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 121.361 -0.837 . . . . 0.0 111.308 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -48.16 -52.75 19.35 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 -176.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -50.07 74.3 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 120.978 1.717 . . . . 0.0 111.552 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.8 mm -63.82 -34.99 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -61.19 -53.4 57.43 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.861 0.755 . . . . 0.0 109.005 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 13.2 m -67.33 -35.48 79.5 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.864 -0.522 . . . . 0.0 110.793 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 10.3 t80 -58.77 -52.68 64.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -37.31 81.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 123.979 0.912 . . . . 0.0 109.728 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -53.5 57.15 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.078 0.951 . . . . 0.0 109.472 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -67.02 -46.08 75.57 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.19 0.996 . . . . 0.0 111.032 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -42.23 85.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.317 1.047 . . . . 0.0 109.21 179.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -65.7 -51.47 59.1 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -52.42 -39.27 60.78 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.338 1.055 . . . . 0.0 113.429 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -55.22 -46.82 75.97 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.362 0.983 . . . . 0.0 109.103 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 73.7 m80 -75.42 -39.36 59.02 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.341 1.056 . . . . 0.0 110.917 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -57.02 -41.75 79.11 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 125.414 1.486 . . . . 0.0 110.319 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 6.8 m170 -58.8 -20.59 51.48 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.198 0.908 . . . . 0.0 111.929 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 3.9 mt -93.91 -48.91 6.06 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 125.127 1.371 . . . . 0.0 109.813 178.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 66.3 tp -65.75 -63.21 1.14 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.018 1.327 . . . . 0.0 111.493 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.51 130.49 39.69 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.543 1.537 . . . . 0.0 107.347 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 12.4 ttpp -151.55 131.05 12.99 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -54.0 140.91 29.83 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 30.6 m -144.24 155.5 43.89 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 105.172 -2.159 . . . . 0.0 105.172 179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.67 169.89 16.45 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.343 0.52 . . . . 0.0 110.832 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 17.0 tt -158.19 166.53 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 128.29 2.636 . . . . 0.0 106.062 179.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -145.27 159.18 43.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.479 1.511 . . . . 0.0 108.174 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 54.2 m . . . . . 0 C--O 1.258 1.505 0 C-N-CA 129.326 3.051 . . . . 0.0 105.496 179.094 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.691 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 3.5 m -144.57 107.68 4.54 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -135.47 92.98 2.9 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 129.996 3.318 . . . . 0.0 104.023 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -138.93 -47.15 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.472 1.109 . . . . 0.0 109.88 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 3.5 t70 -140.46 125.24 18.16 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.04 1.736 . . . . 0.0 106.423 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 8.3 m -146.13 142.06 28.12 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -102.23 142.12 33.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -122.94 151.17 42.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 7.3 mp -128.33 150.06 50.24 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 105.62 -1.992 . . . . 0.0 105.62 178.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 18.6 tm0? -145.33 98.37 3.14 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 125.897 1.679 . . . . 0.0 106.975 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.83 140.66 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 119.074 0.852 . . . . 0.0 111.573 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -103.91 103.95 13.87 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 105.165 -2.161 . . . . 0.0 105.165 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.16 114.08 0.86 Allowed Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 104.301 -3.52 . . . . 0.0 104.301 178.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -61.95 -57.52 11.4 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 120.491 2.145 . . . . 0.0 111.901 -178.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 4.5 mttp -72.22 -35.52 68.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.494 -0.754 . . . . 0.0 109.081 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -57.16 -51.32 69.79 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 118.013 -0.994 . . . . 0.0 111.035 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 87.8 t80 -66.71 -43.24 84.82 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.429 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.76 -54.0 40.09 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.407 1.003 . . . . 0.0 111.817 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -66.06 -54.07 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 125.614 1.565 . . . . 0.0 111.657 -178.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -37.54 87.68 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 117.719 -1.134 . . . . 0.0 111.873 -178.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 15.1 ttt -65.3 -51.26 61.83 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -52.32 -51.74 57.01 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 123.454 0.702 . . . . 0.0 109.664 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . 0.479 HD22 HG23 ' C' 1022 ' ' ILE . 68.1 mt -65.23 -36.54 84.48 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.397 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.6 tptp -64.98 -48.4 74.16 Favored 'General case' 0 C--O 1.228 -0.079 0 CA-C-N 120.123 1.328 . . . . 0.0 109.449 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -59.02 -46.6 87.8 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.96 1.304 . . . . 0.0 108.047 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 40.7 t -57.09 -45.95 82.96 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.53 1.132 . . . . 0.0 109.97 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 2.6 mm? -70.89 -30.52 66.9 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 117.578 -1.201 . . . . 0.0 111.059 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -62.88 -42.6 99.83 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 121.529 1.968 . . . . 0.0 107.982 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -54.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.105 0.962 . . . . 0.0 109.567 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 13.7 tpt -60.12 -30.09 69.05 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.307 0.643 . . . . 0.0 112.711 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -76.38 -35.45 58.64 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 119.084 0.856 . . . . 0.0 110.207 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.21 -31.71 33.81 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.801 1.038 . . . . 0.0 113.801 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 2.2 t -94.61 147.93 34.04 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 125.378 1.471 . . . . 0.0 112.934 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -67.31 -173.09 0.4 Allowed 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 123.674 2.916 . . . . 0.0 110.818 178.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -122.92 43.48 0.76 Allowed Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -65.62 -47.16 4.31 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.106 1.871 . . . . 0.0 113.09 -178.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 26.0 tp -68.89 -39.7 79.59 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 119.372 0.987 . . . . 0.0 109.217 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . 0.657 HG23 HD22 ' C' 1028 ' ' LEU . 2.8 t -59.26 -50.41 79.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.39 0 CA-C-O 117.377 -1.296 . . . . 0.0 109.722 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -55.09 -51.56 65.99 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.343 1.429 . . . . 0.0 109.758 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 5.3 t -57.26 -49.88 74.66 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.161 1.384 . . . . 0.0 111.549 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 12.6 t80 -68.95 -41.95 77.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.336 1.455 . . . . 0.0 112.041 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 10.1 tmm_? -53.3 -47.5 69.19 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.087 1.355 . . . . 0.0 109.885 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -70.82 -53.93 13.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.125 0.97 . . . . 0.0 110.125 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -51.48 -47.27 63.26 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.656 0.782 . . . . 0.0 112.658 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -73.57 -31.62 63.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.313 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -61.81 -34.02 75.17 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.674 1.124 . . . . 0.0 109.687 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 2.7 mm? -55.13 -14.68 1.74 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 48.7 tp -73.17 -7.33 50.93 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.8 1.64 . . . . 0.0 111.14 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -63.49 166.71 6.31 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.654 1.581 . . . . 0.0 111.069 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 90.6 mtt-85 . . . . . 0 C--O 1.241 0.647 0 N-CA-C 102.408 -3.182 . . . . 0.0 102.408 178.859 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 66.5 m . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 120.779 0.323 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -74.61 -18.99 60.47 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 126.422 1.889 . . . . 0.0 112.265 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -70.17 10.31 0.45 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 126.892 2.077 . . . . 0.0 115.85 -177.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -87.56 96.49 10.42 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 178.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.01 108.65 1.26 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.589 0.631 . . . . 0.0 110.272 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.78 168.33 10.56 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.43 1.109 . . . . 0.0 109.643 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -135.99 142.3 44.49 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 126.384 1.873 . . . . 0.0 106.999 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 39.3 tp -130.5 96.04 25.2 Favored Pre-proline 0 CA--C 1.539 0.527 0 C-N-CA 123.989 0.916 . . . . 0.0 108.747 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.46 116.76 3.62 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.537 2.825 . . . . 0.0 108.799 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.9 t -145.48 160.83 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.885 1.674 . . . . 0.0 109.804 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -134.4 105.02 6.37 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -165.9 104.88 0.23 Allowed Glycine 0 C--O 1.227 -0.334 0 N-CA-C 106.403 -2.679 . . . . 0.0 106.403 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -64.24 -52.96 56.18 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 121.196 2.498 . . . . 0.0 113.021 -177.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.91 -30.71 69.24 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.47 -0.769 . . . . 0.0 110.864 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -43.34 81.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 126.115 1.766 . . . . 0.0 109.299 -179.001 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -61.85 -49.05 77.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.138 0.975 . . . . 0.0 108.533 178.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -60.61 -43.14 97.78 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.744 0.247 . . . . 0.0 111.423 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 8.8 tmm? -63.73 -49.95 71.05 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.841 0.857 . . . . 0.0 110.359 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 mp -61.65 -52.24 65.15 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.191 -0.909 . . . . 0.0 112.179 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -42.14 94.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.463 1.029 . . . . 0.0 112.483 -177.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -59.94 -48.61 81.0 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.205 0.526 . . . . 0.0 110.48 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.3 mt -73.62 -32.15 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.021 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' C' 1010 ' ' VAL . 19.0 ttmm -59.23 -57.54 12.57 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -36.54 73.05 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 117.054 -1.45 . . . . 0.0 109.309 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 p -55.8 -48.0 76.15 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.285 1.402 . . . . 0.0 111.327 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -42.37 62.48 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 126.306 1.842 . . . . 0.0 113.716 -178.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -68.88 -52.47 29.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.609 -0.682 . . . . 0.0 109.988 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.94 -39.57 92.53 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.607 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.25 66.37 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.083 0.856 . . . . 0.0 109.703 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.02 -23.99 66.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.66 -23.46 29.45 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.446 1.099 . . . . 0.0 111.523 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp -132.93 67.42 77.81 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 127.776 2.431 . . . . 0.0 105.909 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -76.71 46.4 1.87 Allowed 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 124.603 3.536 . . . . 0.0 112.151 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -48.7 154.14 0.72 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.97 1.308 . . . . 0.0 112.577 -179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -50.99 -28.08 9.15 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.97 0.908 . . . . 0.0 113.296 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.7 m -56.91 -50.03 73.79 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.555 1.07 . . . . 0.0 108.952 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.8 mt -65.78 -53.64 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 C-N-CA 126.108 1.763 . . . . 0.0 108.826 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -52.43 -53.3 47.13 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.202 1.001 . . . . 0.0 111.721 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.1 m -64.83 -47.06 79.36 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.887 0.875 . . . . 0.0 110.494 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -61.35 -41.39 96.98 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 118.965 0.802 . . . . 0.0 111.28 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -60.37 -48.55 81.25 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.441 1.019 . . . . 0.0 110.171 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.79 -46.04 89.84 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 123.176 0.59 . . . . 0.0 110.083 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -62.02 -47.65 83.81 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 124.451 1.1 . . . . 0.0 110.821 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -54.88 -44.52 74.14 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.556 1.142 . . . . 0.0 110.512 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -57.4 -50.78 71.91 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.43 -45.52 92.71 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 117.86 0.3 . . . . 0.0 111.268 179.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -55.26 -32.03 62.03 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.295 1.438 . . . . 0.0 111.919 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -60.12 -27.92 67.43 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.788 1.176 . . . . 0.0 110.826 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -70.39 -41.92 72.41 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 120.173 -1.579 . . . . 0.0 109.208 177.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -85.24 13.39 6.48 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.543 1.937 . . . . 0.0 112.615 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.3 tt -52.67 -32.1 40.66 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.016 1.327 . . . . 0.0 113.287 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.43 -67.11 0.45 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.629 0.772 . . . . 0.0 110.795 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 57.34 -171.05 0.1 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.028 1.331 . . . . 0.0 109.555 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.2 tptp -139.93 74.34 1.46 Allowed 'General case' 0 C--N 1.338 0.105 0 O-C-N 120.406 -1.434 . . . . 0.0 109.412 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -95.76 174.3 7.04 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 124.262 1.025 . . . . 0.0 110.118 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.8 t -163.88 110.6 1.1 Allowed 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 177.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.6 m -135.27 159.91 40.06 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.671 0.788 . . . . 0.0 110.025 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.3 tt -152.95 -5.66 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.8 mp0 -83.69 159.61 21.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.814 1.188 . . . . 0.0 110.646 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 C--O 1.256 1.398 0 C-N-CA 128.496 2.718 . . . . 0.0 106.189 178.131 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.525 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 12.6 m -74.25 166.95 22.58 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.716 0.77 . . . . 0.0 110.091 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -157.21 101.6 1.91 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.977 1.311 . . . . 0.0 108.438 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -139.05 -11.38 1.27 Allowed 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.877 1.271 . . . . 0.0 112.079 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -88.23 147.22 24.95 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 7.1 m -139.94 145.1 37.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.03 129.91 48.46 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -104.31 159.41 15.73 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.841 1.656 . . . . 0.0 109.466 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 13.9 mt -149.12 142.51 25.23 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.871 1.668 . . . . 0.0 107.831 179.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -146.03 108.21 4.4 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.5 m -154.51 150.18 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.106 1.362 . . . . 0.0 109.488 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.87 101.57 8.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.225 1.375 . . . . 0.0 108.916 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.0 115.85 0.88 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-O 115.887 -2.618 . . . . 0.0 109.918 178.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -65.24 -56.91 10.09 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 122.364 3.082 . . . . 0.0 111.023 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -63.55 -47.75 80.3 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 -52.64 -48.81 66.17 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.326 -0.845 . . . . 0.0 111.349 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.94 -43.74 94.93 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 119.954 1.252 . . . . 0.0 112.074 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.48 -48.82 79.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.863 1.21 . . . . 0.0 110.332 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 85.0 mt -61.23 -53.71 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 124.43 1.092 . . . . 0.0 110.757 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.66 -31.69 73.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 117.911 -1.042 . . . . 0.0 111.601 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 16.2 mtp -64.41 -52.38 58.42 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 120.265 1.393 . . . . 0.0 109.468 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -58.14 -43.23 87.18 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.6 mt -63.2 -50.67 69.38 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.419 0.688 . . . . 0.0 111.941 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -69.69 -50.84 39.96 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 119.447 1.021 . . . . 0.0 112.669 -178.52 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -56.64 -46.78 80.81 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 118.909 0.777 . . . . 0.0 110.443 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 3.8 t -64.21 -36.17 83.18 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.721 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.696 HD12 HD21 ' D' 1108 ' ' ASN . 1.6 tm? -69.83 -43.31 72.26 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 179.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -60.25 -33.98 73.06 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.898 1.226 . . . . 0.0 109.784 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -73.15 -44.05 60.62 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.2 tpt -63.98 -25.77 68.28 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.465 1.106 . . . . 0.0 109.7 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.5 -46.32 17.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.665 1.986 . . . . 0.0 109.606 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 pp -75.4 -32.33 60.72 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.098 0.863 . . . . 0.0 113.118 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -91.63 147.85 36.06 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.46 -176.8 1.52 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.367 2.045 . . . . 0.0 110.429 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.96 56.58 0.37 Allowed Pre-proline 0 CA--C 1.551 1.006 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.36 -74.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.263 2.642 . . . . 0.0 113.109 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 6.8 tt -56.12 -44.35 79.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 25.5 t -50.97 -53.79 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 126.959 2.104 . . . . 0.0 112.103 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.52 -42.66 91.75 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 119.307 0.958 . . . . 0.0 111.421 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 29.5 m -64.39 -44.34 91.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.464 0.575 . . . . 0.0 109.727 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -56.92 -51.93 67.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.829 1.652 . . . . 0.0 108.78 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -54.18 -46.96 72.51 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 117.48 -1.248 . . . . 0.0 111.245 -178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -68.56 -49.83 56.46 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 120.997 1.726 . . . . 0.0 112.086 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -56.98 -37.67 71.95 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.837 0.455 . . . . 0.0 110.975 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -77.57 -41.98 36.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 110.051 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -54.23 -32.52 56.14 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.912 1.233 . . . . 0.0 110.442 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.28 -19.64 55.74 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.854 -0.529 . . . . 0.0 111.828 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 1.3 tt -70.05 -29.05 65.98 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 120.727 -1.233 . . . . 0.0 110.308 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.45 91.85 6.01 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.787 1.635 . . . . 0.0 107.916 -179.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? . . . . . 0 C--O 1.247 0.936 0 C-N-CA 127.908 2.483 . . . . 0.0 109.493 -179.099 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 16.9 m . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 120.787 0.327 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 8.5 t0 -103.33 -2.52 26.95 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.209 1.404 . . . . 0.0 112.561 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.44 -12.13 60.18 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.539 0.736 . . . . 0.0 112.224 -179.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.94 98.78 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.725 1.61 . . . . 0.0 112.508 -178.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 10.0 tt -68.05 120.08 13.69 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.34 167.55 10.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 123.373 1.558 . . . . 0.0 109.702 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -136.12 148.01 48.04 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 126.905 2.082 . . . . 0.0 106.287 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 9.0 tp -137.11 94.57 12.43 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.38 111.17 3.22 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 124.209 3.273 . . . . 0.0 109.035 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . 0.419 HG21 ' HE3' ' A' ' 23' ' ' LYS . 54.0 t -145.35 156.01 13.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -135.65 105.04 6.01 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.132 -0.98 . . . . 0.0 109.869 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.7 114.96 0.6 Allowed Glycine 0 CA--C 1.529 0.919 0 N-CA-C 106.503 -2.639 . . . . 0.0 106.503 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -67.86 -50.68 55.16 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 122.73 3.265 . . . . 0.0 111.086 -179.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -41.49 85.86 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -48.72 79.94 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 124.518 1.127 . . . . 0.0 110.055 -179.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 55.0 t80 -57.26 -54.74 43.38 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.921 0.889 . . . . 0.0 110.864 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -62.57 -37.52 86.5 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 12.0 tmm? -66.14 -49.8 66.19 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.627 -0.671 . . . . 0.0 109.444 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.21 -45.2 93.99 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.494 0.717 . . . . 0.0 110.308 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -61.69 -54.37 43.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.022 0.929 . . . . 0.0 111.327 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -54.97 -48.37 73.33 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.809 0.844 . . . . 0.0 111.238 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 96.7 mt -71.46 -40.59 72.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 119.113 -0.47 . . . . 0.0 111.011 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -47.4 85.83 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 119.532 1.06 . . . . 0.0 108.16 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.03 -46.39 85.41 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.517 1.136 . . . . 0.0 108.754 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 34.1 p -54.39 -50.06 68.41 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 118.398 0.544 . . . . 0.0 111.656 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -46.47 89.14 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 122.114 0.959 . . . . 0.0 111.57 -178.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -52.64 64.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.834 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.86 -48.56 71.17 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.154 1.781 . . . . 0.0 112.937 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -41.38 63.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.845 1.658 . . . . 0.0 109.185 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -87.72 -25.09 23.63 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 118.16 -0.924 . . . . 0.0 111.671 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -75.69 -23.04 56.15 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.89 1.677 . . . . 0.0 111.15 178.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 39.5 tp -126.8 70.87 73.73 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 125.837 1.655 . . . . 0.0 106.907 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -75.97 73.83 4.72 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 123.117 2.545 . . . . 0.0 111.25 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -77.69 163.72 25.93 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 124.39 1.076 . . . . 0.0 109.957 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 50.7 m170 -64.07 -26.57 68.61 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.699 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 3.0 m -56.63 -47.44 79.67 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 58.2 mt -69.58 -49.94 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 C-N-CA 126.534 1.933 . . . . 0.0 109.783 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -55.02 -54.45 42.87 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.809 0.844 . . . . 0.0 111.252 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 3.9 m -59.92 -46.09 90.48 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.336 0.655 . . . . 0.0 109.741 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 23.0 t80 -59.1 -45.3 91.21 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.632 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.45 -48.82 80.1 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.654 0.782 . . . . 0.0 110.435 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -44.03 91.54 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 121.876 -0.515 . . . . 0.0 110.541 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -64.44 -42.44 95.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 118.539 -0.743 . . . . 0.0 110.727 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.1 mm100 -60.74 -35.19 75.74 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.644 1.178 . . . . 0.0 110.744 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -64.95 -54.42 30.92 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.25 -41.45 99.06 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.4 -0.188 . . . . 0.0 110.629 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -52.72 -35.15 55.35 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.172 1.389 . . . . 0.0 111.66 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 1.3 t60 -58.25 -33.77 69.73 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 120.131 1.332 . . . . 0.0 110.354 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -70.72 -34.85 72.34 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 120.931 -1.106 . . . . 0.0 111.215 178.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -93.02 -0.86 57.07 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.498 1.919 . . . . 0.0 114.378 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 7.9 tt -44.98 -29.64 0.87 Allowed 'General case' 0 C--O 1.234 0.245 0 C-N-CA 130.021 3.328 . . . . 0.0 116.303 -177.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 6.6 mp -59.37 -54.1 50.57 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 118.835 0.743 . . . . 0.0 112.003 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 6.2 tt0 58.43 -173.41 0.09 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.32 1.048 . . . . 0.0 109.066 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 6.2 tptt -136.64 35.77 2.67 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.064 -1.648 . . . . 0.0 109.404 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -58.36 158.33 7.49 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 126.243 1.817 . . . . 0.0 113.632 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 2.7 t -158.42 94.51 1.28 Allowed 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 105.888 -1.893 . . . . 0.0 105.888 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 68.8 m -134.92 135.42 41.54 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 14.2 tt -142.68 15.5 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 124.397 1.079 . . . . 0.0 111.572 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -114.81 159.65 20.37 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.865 1.266 . . . . 0.0 110.368 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 55.0 m . . . . . 0 C--O 1.255 1.374 0 C-N-CA 127.791 2.436 . . . . 0.0 106.322 179.029 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.105 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 18.3 m -75.96 163.23 27.38 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 126.146 1.778 . . . . 0.0 111.161 -178.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 31.8 t70 -151.32 94.74 2.06 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.683 0.793 . . . . 0.0 110.456 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -139.15 25.82 2.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 127.542 2.337 . . . . 0.0 109.143 -179.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 15.6 t70 -139.66 139.99 36.79 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.868 1.667 . . . . 0.0 107.402 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 65.6 m -139.98 156.56 46.58 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.201 1.4 . . . . 0.0 107.727 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -111.09 140.69 45.43 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.845 0.831 . . . . 0.0 108.78 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.56 159.71 31.39 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.474 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 84.9 mt -146.23 146.95 30.97 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 177.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -143.63 112.84 6.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 17.4 m -155.47 151.33 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 C-N-CA 125.806 1.642 . . . . 0.0 109.258 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 102.19 11.73 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.71 108.97 0.53 Allowed Glycine 0 C--N 1.335 0.499 0 CA-C-O 117.043 -1.976 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -58.02 9.01 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 121.425 2.613 . . . . 0.0 112.573 -179.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -71.16 -42.77 68.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.575 -0.703 . . . . 0.0 109.144 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . 0.696 HD21 HD12 ' B' ' 119' ' ' LEU . 33.6 m-80 -54.05 -49.29 69.32 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.596 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 78.1 t80 -62.31 -44.65 96.01 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.335 0.97 . . . . 0.0 110.901 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.7 -45.31 94.67 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 118.836 0.744 . . . . 0.0 112.4 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 78.9 mt -66.97 -50.9 60.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 125.768 1.627 . . . . 0.0 109.457 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.59 -36.94 82.11 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 118.257 -0.878 . . . . 0.0 109.985 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 22.7 mtp -60.59 -52.55 64.7 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 119.464 1.029 . . . . 0.0 109.162 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -60.77 -42.01 96.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 118.486 -0.769 . . . . 0.0 111.229 -179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 69.1 mt -66.25 -46.61 76.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 118.601 0.637 . . . . 0.0 111.911 -179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 4.8 tptt -69.3 -54.04 16.63 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 117.122 -1.418 . . . . 0.0 111.328 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -53.17 -47.59 68.69 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 108.376 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 30.9 t -55.15 -54.28 45.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.334 0.654 . . . . 0.0 110.43 179.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -30.76 71.79 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 118.86 -0.591 . . . . 0.0 110.741 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -60.27 -49.07 79.07 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 120.075 1.307 . . . . 0.0 108.093 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.59 -41.18 80.0 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.124 -0.941 . . . . 0.0 108.525 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.8 tpt -64.37 -20.9 66.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.702 1.137 . . . . 0.0 111.402 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -83.12 -37.36 23.87 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.151 0.98 . . . . 0.0 108.56 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.22 -32.82 17.24 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 67.1 t -89.84 141.16 28.03 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 126.16 1.784 . . . . 0.0 109.35 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.78 177.25 5.07 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 123.332 2.688 . . . . 0.0 112.28 179.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -111.31 53.2 0.36 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -178.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.81 -70.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.482 2.121 . . . . 0.0 112.666 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.39 -39.07 82.21 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 16.5 t -52.16 -56.34 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.033 1.733 . . . . 0.0 110.654 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.43 -44.02 75.87 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 119.516 1.053 . . . . 0.0 111.84 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 36.8 m -57.13 -42.15 80.37 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 47.7 t80 -69.82 -44.37 70.11 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.651 1.581 . . . . 0.0 109.012 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -54.5 -48.83 71.4 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 117.911 -1.043 . . . . 0.0 110.362 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -66.48 -53.9 29.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.952 0.796 . . . . 0.0 110.992 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -54.86 -38.83 67.96 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.779 0.832 . . . . 0.0 113.203 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.47 -37.39 31.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.422 0.689 . . . . 0.0 109.966 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -57.74 -38.05 74.65 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.667 0.667 . . . . 0.0 110.049 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 74.4 mt -59.48 -15.23 16.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.895 0.878 . . . . 0.0 113.194 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -78.45 -16.93 57.03 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.171 0.988 . . . . 0.0 110.365 178.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.54 106.17 13.96 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.773 1.629 . . . . 0.0 108.194 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? . . . . . 0 C--O 1.246 0.896 0 CA-C-O 115.639 -2.124 . . . . 0.0 109.228 -179.263 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.466 0.357 0 CA-C-O 120.805 0.336 . . . . 0.0 111.449 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.79 -60.6 2.15 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 178.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -138.28 -51.63 0.59 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -174.25 112.97 0.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 103.768 -2.678 . . . . 0.0 103.768 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.7 tt -63.12 101.08 0.26 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.188 0.995 . . . . 0.0 109.895 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mp -92.74 173.73 7.62 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -133.35 120.31 20.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.11 0.964 . . . . 0.0 108.902 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.6 tp -104.22 101.21 25.2 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 124.178 0.991 . . . . 0.0 109.442 179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -80.8 118.92 3.52 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.312 2.675 . . . . 0.0 110.248 178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -144.64 156.49 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 125.483 1.513 . . . . 0.0 107.03 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.6 103.67 5.53 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.082 -1.011 . . . . 0.0 109.497 178.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.11 125.19 1.29 Allowed Glycine 0 C--O 1.226 -0.349 0 N-CA-C 106.013 -2.835 . . . . 0.0 106.013 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -51.26 59.79 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 121.129 2.465 . . . . 0.0 109.642 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -72.63 -30.77 64.6 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.211 1.004 . . . . 0.0 110.559 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 m -66.83 -51.56 54.14 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.297 1.439 . . . . 0.0 109.277 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -63.69 -50.37 69.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.478 0.711 . . . . 0.0 109.774 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -57.99 -57.54 12.38 Favored 'General case' 0 C--O 1.231 0.1 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -63.16 -39.29 94.25 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.697 0.681 . . . . 0.0 112.751 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.2 mt -72.85 -35.1 67.16 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 118.134 -0.936 . . . . 0.0 111.125 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -69.71 -41.47 75.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.095 1.316 . . . . 0.0 107.765 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -56.38 -48.75 76.22 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.473 1.109 . . . . 0.0 109.713 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.69 -46.76 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.482 0.713 . . . . 0.0 109.983 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -53.94 -50.18 67.02 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 124.003 0.921 . . . . 0.0 110.103 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -71.57 -42.89 67.25 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.77 -1.11 . . . . 0.0 111.623 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.8 t -53.7 -51.48 63.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.573 1.078 . . . . 0.0 108.79 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.47 -56.91 14.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 124.695 1.247 . . . . 0.0 110.553 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -56.24 -43.24 78.47 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.972 0.806 . . . . 0.0 112.58 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.62 -43.91 75.34 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.85 1.204 . . . . 0.0 110.454 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.54 -38.5 84.69 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.029 0.932 . . . . 0.0 109.258 179.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.99 -37.72 84.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.689 1.196 . . . . 0.0 110.214 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -79.72 -24.04 41.92 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.556 1.142 . . . . 0.0 112.92 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 27.6 tp -122.09 65.85 21.74 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 120.297 1.408 . . . . 0.0 112.439 -178.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.97 144.55 34.43 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.246 1.964 . . . . 0.0 109.167 178.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.32 172.12 19.18 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.308 1.843 . . . . 0.0 107.184 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -48.35 -47.89 36.83 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 125.123 1.369 . . . . 0.0 114.159 -178.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.0 m -55.83 -43.84 77.35 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.104 1.32 . . . . 0.0 110.808 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.07 -55.03 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 125.039 1.335 . . . . 0.0 109.594 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -61.3 -42.85 99.36 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 m -65.72 -31.9 73.16 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -49.98 70.43 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 178.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -55.87 -48.5 75.44 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.003 0.921 . . . . 0.0 109.862 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -64.07 -41.81 97.21 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.63 0.772 . . . . 0.0 111.24 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.332 -0.162 0 O-C-N 121.137 -0.977 . . . . 0.0 110.66 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -66.5 -35.53 80.48 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -69.76 -31.22 69.05 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.532 1.133 . . . . 0.0 111.525 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -56.2 -37.36 69.53 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 111.979 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -54.12 -29.74 46.06 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.325 0.65 . . . . 0.0 111.297 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -54.61 -26.19 31.19 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.957 1.703 . . . . 0.0 111.678 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -70.57 -59.8 2.63 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -58.97 -36.41 74.8 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.26 1.024 . . . . 0.0 110.469 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -55.73 -24.41 34.73 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.954 2.102 . . . . 0.0 112.322 178.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 tp -62.25 -34.96 77.52 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.978 0.511 . . . . 0.0 111.494 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -55.06 114.85 1.92 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 124.257 1.023 . . . . 0.0 109.535 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -70.8 -26.24 63.22 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.119 0.968 . . . . 0.0 112.708 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -70.45 -165.37 0.1 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.887 0.875 . . . . 0.0 109.61 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 m 71.68 -22.68 0.2 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.041 1.736 . . . . 0.0 114.255 178.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.5 t -97.6 112.37 24.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.708 1.14 . . . . 0.0 111.231 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.4 tt -161.62 -15.3 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 126.451 1.901 . . . . 0.0 111.526 178.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 44.2 mm-40 -146.66 151.52 37.37 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 128.441 2.696 . . . . 0.0 105.985 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.0 m . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.484 -1.246 . . . . 0.0 107.69 179.022 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.091 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 1.5 t -81.59 -95.93 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -125.36 -11.95 6.84 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.834 0.854 . . . . 0.0 111.642 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -92.01 -18.82 23.1 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 125.252 1.421 . . . . 0.0 110.409 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 39.91 67.85 0.44 Allowed 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 128.718 2.807 . . . . 0.0 111.397 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m -57.51 138.43 55.15 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.401 1.08 . . . . 0.0 109.116 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -102.02 137.02 40.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.626 1.171 . . . . 0.0 108.901 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -114.15 149.83 35.08 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.931 1.693 . . . . 0.0 108.466 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mt -144.91 145.87 31.76 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.126 1.37 . . . . 0.0 108.041 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -151.73 110.76 3.88 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.413 0.685 . . . . 0.0 111.514 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -154.02 150.87 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.246 1.818 . . . . 0.0 107.704 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 24.2 ptt85 -99.18 101.86 13.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.79 1.177 . . . . 0.0 110.092 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.35 114.55 0.81 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 116.128 -2.484 . . . . 0.0 113.323 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 tpp85 -67.35 -56.77 8.37 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 122.751 3.275 . . . . 0.0 111.052 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -64.99 -50.62 65.61 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.996 1.718 . . . . 0.0 108.503 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -47.35 64.73 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.743 2.817 . . . . 0.0 109.393 -178.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -66.64 -47.39 72.71 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.157 0.89 . . . . 0.0 111.187 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -57.04 -43.08 81.61 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.342 0.973 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 60.2 mt -61.25 -54.69 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.813 1.245 . . . . 0.0 107.727 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.81 -37.36 76.21 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 117.871 -1.061 . . . . 0.0 112.524 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 60.0 mtp -65.44 -54.23 31.52 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 119.921 1.237 . . . . 0.0 111.298 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 13.9 ptpt -61.85 -43.0 99.72 Favored 'General case' 0 C--N 1.34 0.175 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.74 -51.48 58.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.427 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . 0.405 ' HE3' HG11 ' D' 1103 ' ' VAL . 41.4 tptt -54.84 -58.86 5.87 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.466 0.707 . . . . 0.0 110.672 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -52.68 -49.22 65.73 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.659 1.984 . . . . 0.0 111.432 -179.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 12.4 t -62.07 -43.58 98.53 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.086 0.403 . . . . 0.0 110.987 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' B' ' 119' ' ' LEU . 11.7 tp -62.98 -40.15 96.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 118.587 -0.721 . . . . 0.0 109.149 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -47.06 86.91 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -59.35 -52.3 66.22 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.717 0.807 . . . . 0.0 111.692 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 8.0 tmm? -62.73 -28.22 69.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.678 0.791 . . . . 0.0 111.349 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.78 -22.18 22.27 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.302 1.441 . . . . 0.0 113.214 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.93 -33.73 17.16 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.39 1.45 . . . . 0.0 111.145 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 3.7 t -94.94 147.5 33.17 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -65.79 -170.83 0.19 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.604 2.869 . . . . 0.0 111.182 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -112.19 78.0 2.32 Favored Pre-proline 0 CA--C 1.544 0.738 0 O-C-N 120.214 -1.554 . . . . 0.0 113.226 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -77.97 -97.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.73 2.953 . . . . 0.0 112.483 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.1 tt -55.76 -40.73 72.98 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.744 1.218 . . . . 0.0 109.881 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -53.37 -46.11 57.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.48 1.112 . . . . 0.0 111.238 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.15 -42.05 73.03 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 121.1 -1.0 . . . . 0.0 110.36 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 1.5 t -57.83 -46.62 84.47 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -67.29 -39.48 85.98 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 125.623 1.569 . . . . 0.0 111.11 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -47.8 70.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 119.311 0.96 . . . . 0.0 109.024 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.44 -50.96 61.61 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -51.22 -44.15 61.59 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.309 1.043 . . . . 0.0 112.422 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 12.1 tm0? -76.59 -40.68 48.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.85 0.86 . . . . 0.0 110.666 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -53.64 -34.84 59.96 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.885 0.874 . . . . 0.0 111.435 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.02 -10.21 3.98 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.1 tt -93.14 -22.25 19.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.439 1.895 . . . . 0.0 109.94 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -83.82 177.04 8.51 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 120.261 -1.525 . . . . 0.0 110.006 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 127.362 2.265 . . . . 0.0 105.909 179.483 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.463 0.214 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 4.0 t70 -69.9 -59.09 3.14 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 178.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 10.6 t70 -142.17 -53.25 0.42 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.824 0.675 . . . . 0.0 112.824 177.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -176.86 124.47 0.15 Allowed 'General case' 0 CA--C 1.523 -0.08 0 C-N-CA 126.525 1.93 . . . . 0.0 106.868 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 5.0 tp -61.49 105.08 0.48 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.0 1.32 . . . . 0.0 111.366 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 14.4 mt -93.36 133.73 36.31 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -103.45 103.34 13.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.937 1.295 . . . . 0.0 107.824 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 25.6 tp -97.79 111.8 59.89 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 117.609 -1.186 . . . . 0.0 110.586 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -81.89 115.74 2.75 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.504 2.803 . . . . 0.0 111.686 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 37.6 t -143.88 148.97 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 120.039 1.291 . . . . 0.0 109.357 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.42 102.74 5.05 Favored 'General case' 0 C--N 1.346 0.428 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 179.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.06 136.36 4.06 Favored Glycine 0 CA--C 1.519 0.325 0 CA-C-O 115.104 -3.053 . . . . 0.0 105.475 176.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -53.46 14.69 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 122.991 3.396 . . . . 0.0 106.96 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.62 -30.23 66.82 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 2.4 m -66.58 -52.23 47.73 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.14 0.882 . . . . 0.0 108.947 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.48 -52.65 62.65 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -57.27 -56.54 20.53 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 124.025 0.93 . . . . 0.0 112.829 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ttm -60.53 -34.8 74.64 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.165 1.348 . . . . 0.0 112.045 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 45.1 mt -68.66 -53.06 24.73 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -50.09 74.85 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 124.131 0.972 . . . . 0.0 111.523 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -55.59 -48.45 74.82 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.885 1.274 . . . . 0.0 110.243 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . 0.442 ' CG2' HD22 ' D' 1115 ' ' LEU . 54.7 mt -70.09 -37.25 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 121.695 -0.628 . . . . 0.0 109.963 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -62.64 -51.64 66.47 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.247 1.019 . . . . 0.0 110.791 179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.63 -36.99 76.63 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 124.368 1.067 . . . . 0.0 108.617 -178.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 42.4 t -56.5 -48.6 76.83 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.829 1.195 . . . . 0.0 107.854 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 1.6 tm? -67.55 -54.05 23.18 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.479 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.26 -52.26 63.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.692 0.678 . . . . 0.0 112.644 -178.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 85.3 mt -64.9 -47.7 76.84 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.233 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.7 tmt? -57.59 -41.7 81.69 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.38 -33.46 74.3 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.085 -1.01 . . . . 0.0 110.004 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -72.16 -18.61 61.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.072 0.949 . . . . 0.0 109.766 178.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 45.6 tp -128.3 70.46 79.15 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.842 1.257 . . . . 0.0 109.11 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -80.18 142.04 14.96 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.384 2.056 . . . . 0.0 108.371 179.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -162.01 172.62 15.64 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.031 1.732 . . . . 0.0 108.078 -179.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -50.16 -34.54 22.75 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 116.087 -1.911 . . . . 0.0 114.171 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 85.5 m -57.64 -45.2 85.76 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 122.29 2.314 . . . . 0.0 109.534 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.6 mp -61.86 -54.59 32.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 C-N-CA 125.297 1.439 . . . . 0.0 108.623 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.31 -33.88 73.0 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 51.5 m -69.92 -52.56 23.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -47.3 76.9 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.699 0.682 . . . . 0.0 110.397 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -61.42 -49.36 77.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.626 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -68.97 -29.28 67.47 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 118.943 0.792 . . . . 0.0 112.939 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -66.97 -35.69 80.52 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.324 0.965 . . . . 0.0 108.584 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -78.61 -40.93 33.07 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -54.81 -40.93 70.01 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.803 1.241 . . . . 0.0 110.357 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -53.51 -35.3 60.51 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.047 1.339 . . . . 0.0 112.193 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -55.09 -28.65 54.04 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.79 1.236 . . . . 0.0 111.178 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -50.67 -29.91 12.34 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.76 1.224 . . . . 0.0 111.414 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -64.13 -56.73 12.78 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.013 0.925 . . . . 0.0 109.014 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 30.6 m170 -64.9 -34.9 79.49 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.263 0.625 . . . . 0.0 109.681 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.4 -28.34 69.18 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.18 0.992 . . . . 0.0 111.218 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 11.2 tp -57.39 -31.8 66.18 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.498 0.719 . . . . 0.0 110.747 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -59.96 154.01 19.89 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.771 1.629 . . . . 0.0 110.529 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -114.87 -25.04 8.37 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.52 1.128 . . . . 0.0 111.983 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -68.54 174.79 3.87 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.652 0.739 . . . . 0.0 110.822 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 27.7 m 67.51 -13.56 0.23 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.631 1.972 . . . . 0.0 115.149 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 8.0 t -87.3 85.26 7.16 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 120.46 1.482 . . . . 0.0 108.427 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 17.9 tt -141.93 -19.71 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -125.61 158.98 33.32 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 125.372 1.469 . . . . 0.0 108.993 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 3.8 t . . . . . 0 C--O 1.247 0.973 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 -179.447 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.244 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 3.8 t -69.44 -51.12 39.25 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 14.6 t70 -154.75 -40.02 0.09 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.512 0.725 . . . . 0.0 111.876 -179.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -68.92 -16.07 63.65 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 117.251 -1.356 . . . . 0.0 114.479 -178.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 7.2 m-20 38.54 77.93 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 128.622 2.769 . . . . 0.0 111.966 -179.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 30.1 m -62.05 152.27 33.07 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 125.414 1.486 . . . . 0.0 110.805 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -107.83 130.28 55.0 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.127 0.971 . . . . 0.0 110.913 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -109.96 144.02 39.08 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 127.584 2.354 . . . . 0.0 107.636 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 12.5 mt -140.98 143.48 34.51 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.267 1.427 . . . . 0.0 109.211 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -145.37 110.32 5.16 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.773 1.229 . . . . 0.0 110.21 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . 0.405 HG11 ' HE3' ' B' ' 116' ' ' LYS . 26.2 t -151.11 151.27 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.492 1.517 . . . . 0.0 110.316 -179.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -110.9 101.89 10.43 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 120.346 1.43 . . . . 0.0 107.312 176.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -144.55 108.93 0.51 Allowed Glycine 0 CA--C 1.521 0.451 0 CA-C-O 116.607 -2.219 . . . . 0.0 109.649 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 11.8 tpp85 -59.91 -58.2 9.58 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 121.697 2.749 . . . . 0.0 115.434 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -68.76 -47.47 66.15 Favored 'General case' 0 CA--C 1.508 -0.649 0 O-C-N 121.124 -0.985 . . . . 0.0 108.927 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -53.96 -43.4 69.87 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.998 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 58.6 t80 -66.12 -49.22 68.26 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.377 0.99 . . . . 0.0 110.886 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -52.76 -49.64 65.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.877 0.846 . . . . 0.0 110.625 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 64.4 mt -57.8 -53.78 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 126.058 1.743 . . . . 0.0 107.994 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 3.1 mp -59.0 -40.5 85.08 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.659 -1.162 . . . . 0.0 112.279 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 58.2 mtp -58.68 -53.22 60.79 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 120.442 1.474 . . . . 0.0 110.577 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -64.15 -40.57 96.43 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 119.981 -0.688 . . . . 0.0 112.313 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . 0.442 HD22 ' CG2' ' C' 1022 ' ' ILE . 55.3 mt -70.95 -33.39 70.43 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 121.705 -0.622 . . . . 0.0 112.518 -178.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 23.9 tptt -64.88 -58.6 5.74 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -49.74 -48.76 49.97 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 127.693 2.397 . . . . 0.0 110.93 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 20.7 t -56.3 -54.05 50.02 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.474 1.11 . . . . 0.0 111.695 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . 0.4 HD12 ' HA ' ' D' 1119 ' ' LEU . 5.7 tp -59.19 -42.61 91.27 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.862 0.465 . . . . 0.0 110.842 -178.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.05 -41.24 91.89 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.223 1.009 . . . . 0.0 110.988 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 1.1 mm? -65.24 -53.63 41.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.546 -0.74 . . . . 0.0 109.854 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 55.8 mmm -57.8 -27.62 63.29 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -179.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -85.12 -36.71 20.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.67 -32.14 28.29 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.275 0.943 . . . . 0.0 113.19 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.37 149.22 40.69 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 126.446 1.898 . . . . 0.0 108.134 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -65.44 174.09 5.65 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.993 2.462 . . . . 0.0 111.036 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . 0.413 ' HA ' HG22 ' D' 1130 ' ' VAL . 16.4 mp0 -112.51 61.89 0.65 Allowed Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.359 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.68 -86.87 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.1 3.2 . . . . 0.0 111.408 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 7.1 tt -57.1 -43.53 82.32 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.131 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . 0.413 HG22 ' HA ' ' D' 1127 ' ' GLN . 3.0 m -51.24 -40.86 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-O 118.213 -0.898 . . . . 0.0 112.124 -177.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 29.8 t70 -76.45 -41.84 45.99 Favored 'General case' 0 C--N 1.338 0.102 0 CA-C-N 118.748 0.704 . . . . 0.0 110.165 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -49.91 73.85 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 77.3 t80 -64.91 -40.01 94.4 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 127.028 2.131 . . . . 0.0 108.813 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.37 -43.51 67.84 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.599 1.091 . . . . 0.0 108.238 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -77.62 -44.92 26.69 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.86 0.864 . . . . 0.0 111.867 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -56.79 -49.85 74.09 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.53 1.132 . . . . 0.0 110.441 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -64.02 -46.58 83.82 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.425 2.29 . . . . 0.0 108.787 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -55.32 -32.02 62.15 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.22 1.008 . . . . 0.0 111.57 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -2.42 1.37 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.98 -14.38 16.51 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.044 1.738 . . . . 0.0 108.854 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . 0.412 ' HG2' ' H ' ' D' 1142 ' ' ARG . 8.8 tt0 -95.35 175.8 6.44 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 119.783 -1.823 . . . . 0.0 108.015 178.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . 0.412 ' H ' ' HG2' ' D' 1141 ' ' GLN . 36.1 ptt-85 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 125.613 1.565 . . . . 0.0 107.991 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 N--CA 1.471 0.584 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.93 32.8 0.32 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.35 1.06 . . . . 0.0 110.735 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -115.75 11.04 15.55 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.156 1.782 . . . . 0.0 114.257 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.67 108.53 5.73 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.2 tp -65.68 94.88 0.21 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.935 1.694 . . . . 0.0 108.847 -179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.76 137.25 36.91 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.754 1.221 . . . . 0.0 112.182 -178.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -104.19 159.23 15.87 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -142.08 101.04 5.82 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.36 125.88 10.55 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.256 1.971 . . . . 0.0 110.105 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.2 t -144.99 134.95 18.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 123.237 0.615 . . . . 0.0 110.179 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 ptt85 -136.91 102.85 4.99 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.92 117.63 0.75 Allowed Glycine 0 N--CA 1.45 -0.427 1 N-CA-C 102.786 -4.126 . . . . 0.0 102.786 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmm-85 -57.89 -51.37 69.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 121.359 2.58 . . . . 0.0 111.457 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -66.48 -40.82 89.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.906 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.86 -45.64 92.92 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.46 -0.775 . . . . 0.0 111.361 -179.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -58.93 -47.49 84.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.71 1.204 . . . . 0.0 109.814 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.67 -57.16 12.58 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.933 0.77 . . . . 0.0 110.736 179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.0 ptm -65.16 -42.84 93.36 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-O 118.711 -0.661 . . . . 0.0 112.26 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.01 -45.29 87.09 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.21 0.913 . . . . 0.0 111.175 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.5 -53.39 58.12 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 123.611 0.764 . . . . 0.0 109.496 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -40.91 97.17 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -178.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.439 HD11 ' CG2' ' D' 1111 ' ' ILE . 91.5 mt -67.91 -45.33 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 tmpt? -63.96 -44.35 93.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.281 -0.636 . . . . 0.0 109.281 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -61.03 -50.87 71.56 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 118.146 -0.93 . . . . 0.0 109.428 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.3 p -53.19 -40.0 64.09 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.84 1.2 . . . . 0.0 111.177 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.09 -49.96 25.56 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.475 0.58 . . . . 0.0 111.664 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.44 -53.76 53.62 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.889 1.676 . . . . 0.0 110.61 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.96 -43.33 95.11 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.499 1.519 . . . . 0.0 109.718 -179.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.8 ttt -63.47 -35.82 81.73 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.413 0.685 . . . . 0.0 110.55 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -78.29 -31.14 48.77 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.347 -0.845 . . . . 0.0 111.57 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -76.46 -35.04 58.66 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 123.424 0.69 . . . . 0.0 111.252 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 tp -128.73 76.45 78.8 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.65 -50.38 0.37 Allowed 'Trans proline' 0 N--CA 1.447 -1.218 0 N-CA-C 107.095 -1.925 . . . . 0.0 107.095 178.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 59.78 176.66 0.09 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 122.284 1.04 . . . . 0.0 109.186 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -70.08 -22.79 63.01 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 120.172 -1.58 . . . . 0.0 109.927 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.2 m -63.91 -52.4 60.06 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 117.988 -1.006 . . . . 0.0 111.065 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 35.7 mm -71.68 -42.04 71.1 Favored 'Isoleucine or valine' 0 C--N 1.346 0.413 0 CA-C-N 120.134 1.334 . . . . 0.0 108.934 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -57.1 -42.26 80.44 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.347 0.522 . . . . 0.0 111.071 -178.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 66.3 m -64.28 -52.44 58.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 109.667 178.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -50.75 71.25 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 123.628 0.771 . . . . 0.0 111.738 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 18.4 ttp85 -62.6 -38.6 90.81 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 118.2 -0.905 . . . . 0.0 109.777 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -56.62 -52.81 63.45 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 119.63 1.104 . . . . 0.0 110.564 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -65.28 -41.73 93.87 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 123.339 0.399 . . . . 0.0 110.635 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -61.77 -41.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.989 0.813 . . . . 0.0 110.254 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -66.0 -29.96 70.42 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.099 0.96 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -47.51 61.22 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.0 tm0? -60.68 -41.11 94.45 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.168 0.987 . . . . 0.0 109.155 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 14.0 t-160 -55.91 -34.7 65.82 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.77 1.628 . . . . 0.0 111.43 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -66.06 -45.16 82.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.805 1.184 . . . . 0.0 109.242 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -64.48 -38.71 91.98 Favored 'General case' 0 N--CA 1.458 -0.042 0 C-N-CA 122.963 0.505 . . . . 0.0 110.937 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.22 -28.86 70.03 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.474 1.11 . . . . 0.0 110.528 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.43 7.36 42.6 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.56 1.544 . . . . 0.0 111.61 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.4 tp60 -75.68 91.53 2.9 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -160.03 134.48 7.57 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 105.525 -2.028 . . . . 0.0 105.525 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -53.23 -55.99 20.03 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.313 0.645 . . . . 0.0 112.043 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 63.32 -164.11 0.26 Allowed 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.5 p -77.23 2.86 14.28 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -178.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.6 tt -135.5 167.44 25.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-N 120.855 1.661 . . . . 0.0 110.946 -178.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -68.98 98.68 0.98 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.256 -0.902 . . . . 0.0 111.808 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 71.4 m . . . . . 0 C--O 1.257 1.461 0 C-N-CA 130.539 3.535 . . . . 0.0 106.145 178.67 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 CA-C-O 119.675 -0.514 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 23.7 t -129.25 -162.16 1.18 Allowed 'General case' 0 C--O 1.241 0.617 0 C-N-CA 127.189 2.196 . . . . 0.0 106.157 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -65.64 120.07 12.27 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 177.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -77.61 15.03 0.88 Allowed 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -178.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -128.98 165.48 21.04 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 126.012 1.725 . . . . 0.0 108.536 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.09 173.01 17.08 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 126.239 1.816 . . . . 0.0 108.843 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -129.56 129.64 44.71 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -114.38 167.81 10.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.339 1.055 . . . . 0.0 109.567 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 20.1 tp -149.22 154.71 39.51 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.882 178.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -150.41 98.81 2.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.957 1.703 . . . . 0.0 110.342 178.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.9 t -146.74 150.05 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 119.899 -1.751 . . . . 0.0 108.62 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -116.34 100.24 7.75 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 122.284 1.04 . . . . 0.0 108.701 177.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.38 107.79 0.46 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 106.819 -2.513 . . . . 0.0 106.819 177.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.39 -56.78 15.16 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 121.512 2.656 . . . . 0.0 111.932 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -67.01 -47.0 72.79 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -52.06 -45.51 64.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.017 1.327 . . . . 0.0 112.269 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -69.96 -43.44 71.52 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.238 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -56.74 -48.18 78.37 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.948 0.88 . . . . 0.0 110.42 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 63.9 mt -65.12 -52.35 54.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 125.29 1.436 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -36.02 82.29 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.392 -1.766 . . . . 0.0 112.269 -178.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 9.5 mtm -64.12 -52.29 59.89 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.86 1.664 . . . . 0.0 108.55 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -48.24 -52.13 22.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.039 0.936 . . . . 0.0 109.423 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.401 HD22 HG23 ' A' ' 22' ' ' ILE . 80.6 mt -68.33 -32.8 73.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . 0.451 ' HE3' HG11 ' D' 1103 ' ' VAL . 30.3 tptt -70.35 -52.08 25.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.32 -1.487 . . . . 0.0 109.451 -178.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -54.45 -52.34 62.15 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 127.783 2.433 . . . . 0.0 106.165 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 29.3 t -52.76 -48.11 66.99 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.733 1.213 . . . . 0.0 112.595 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -52.47 57.73 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.66 -37.96 83.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.332 0.969 . . . . 0.0 111.263 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.49 -40.82 93.53 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 117.983 -1.008 . . . . 0.0 109.486 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 54.3 ttp -66.46 -28.94 68.98 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.868 0.758 . . . . 0.0 109.546 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.18 -32.75 65.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.462 1.028 . . . . 0.0 112.075 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 -32.76 26.08 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . 0.458 HG22 ' HD2' ' B' ' 126' ' ' PRO . 4.0 p -85.26 148.1 49.1 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.08 0.952 . . . . 0.0 109.664 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.458 ' HD2' HG22 ' B' ' 125' ' ' VAL . 60.5 Cg_endo -63.31 173.6 4.07 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.939 1.371 . . . . 0.0 110.133 178.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.43 55.16 1.71 Allowed Pre-proline 0 CA--C 1.548 0.877 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -77.73 -49.61 0.09 OUTLIER 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 123.116 2.544 . . . . 0.0 114.35 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -28.51 69.55 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.118 -0.989 . . . . 0.0 108.46 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 11.4 t -61.4 -49.84 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -55.2 -51.36 66.78 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.602 1.561 . . . . 0.0 111.152 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 m -67.91 -46.31 71.91 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -57.98 -49.22 77.57 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.244 0.617 . . . . 0.0 109.409 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -43.26 67.87 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.903 1.681 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.09 -57.08 5.37 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.122 0.487 . . . . 0.0 111.844 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -61.09 -29.72 69.92 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.309 0.643 . . . . 0.0 112.094 -178.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.22 -37.73 52.73 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 178.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -58.55 -33.07 69.5 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.741 1.155 . . . . 0.0 109.395 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.43 -21.02 49.48 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 119.11 -0.471 . . . . 0.0 111.243 178.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.73 -10.7 59.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.144 1.378 . . . . 0.0 112.075 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -121.49 173.93 7.08 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.321 -1.487 . . . . 0.0 107.728 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.179 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.464 0.253 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -88.29 2.97 51.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.899 0.772 . . . . 0.0 111.524 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 4.3 p30 -79.9 5.22 14.4 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 126.143 1.777 . . . . 0.0 113.508 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -80.58 91.13 5.76 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.946 -1.096 . . . . 0.0 112.838 -178.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 18.9 tp -67.37 108.99 2.97 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.838 0.855 . . . . 0.0 109.283 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.4 mt -104.42 153.3 21.27 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -126.08 101.4 6.76 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.43 1.092 . . . . 0.0 109.175 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.03 113.0 40.05 Favored Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -91.49 122.44 0.71 Allowed 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 123.21 2.607 . . . . 0.0 109.751 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.1 t -142.27 154.59 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 125.834 1.653 . . . . 0.0 109.398 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 26.0 ptt180 -136.73 101.81 4.72 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 121.399 1.909 . . . . 0.0 111.034 177.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -168.18 138.28 5.05 Favored Glycine 0 N--CA 1.46 0.235 0 CA-C-O 116.326 -2.374 . . . . 0.0 107.645 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -52.1 27.62 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 121.008 2.404 . . . . 0.0 111.294 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.46 -41.9 92.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.364 0.529 . . . . 0.0 109.796 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -47.63 84.87 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -179.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 52.8 t80 -65.11 -40.81 95.04 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.439 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -55.11 -57.68 10.73 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.986 0.812 . . . . 0.0 108.994 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 24.6 ptm -67.65 -35.42 78.86 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.8 -41.63 91.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.533 1.061 . . . . 0.0 110.844 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.33 -47.93 58.81 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 178.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -56.6 -48.61 77.05 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.128 0.971 . . . . 0.0 112.888 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 93.3 mt -70.33 -35.89 64.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 119.304 0.956 . . . . 0.0 110.242 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -36.34 83.46 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.6 -54.84 10.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 117.871 -1.062 . . . . 0.0 110.607 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 11.5 p -53.51 -43.59 68.43 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.363 1.438 . . . . 0.0 113.856 -178.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.98 -47.52 51.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.812 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -64.35 -46.09 84.94 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 67.5 mt -62.16 -44.9 95.6 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.963 0.905 . . . . 0.0 109.909 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -59.25 -41.68 89.34 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.755 0.822 . . . . 0.0 109.079 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -75.08 -25.28 58.47 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.784 0.434 . . . . 0.0 111.169 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.56 -39.17 58.57 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.373 0.988 . . . . 0.0 110.849 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 59.0 tp -127.62 71.48 77.58 Favored Pre-proline 0 C--O 1.236 0.347 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.98 -57.76 0.12 Allowed 'Trans proline' 0 N--CA 1.444 -1.401 0 N-CA-C 108.491 -1.388 . . . . 0.0 108.491 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 1.5 tt0 61.31 -176.58 0.12 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.496 1.118 . . . . 0.0 108.36 -178.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -29.29 70.63 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 120.427 -1.421 . . . . 0.0 112.828 -179.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.84 -53.41 58.25 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.448 1.022 . . . . 0.0 111.883 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 47.6 mm -73.25 -40.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-O 118.548 -0.739 . . . . 0.0 110.51 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -58.98 -49.2 78.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.874 0.761 . . . . 0.0 110.474 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 24.0 m -61.45 -40.16 93.46 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 122.972 0.509 . . . . 0.0 110.965 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -53.83 26.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.825 0.45 . . . . 0.0 111.196 -179.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 16.7 ttp85 -62.26 -40.71 97.09 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.212 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -59.05 -47.87 83.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.646 0.657 . . . . 0.0 109.334 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -65.09 -45.54 84.79 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.612 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -56.37 -48.32 77.07 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.71 0.804 . . . . 0.0 110.0 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -58.49 -40.36 82.55 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.978 0.911 . . . . 0.0 110.22 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -69.1 -46.1 68.57 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.976 0.91 . . . . 0.0 110.771 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 14.7 tm0? -56.93 -46.96 81.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.354 1.062 . . . . 0.0 108.611 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 45.3 t-80 -58.34 -26.06 62.67 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.488 1.515 . . . . 0.0 112.3 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -58.7 -45.24 89.94 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 119.735 1.152 . . . . 0.0 108.047 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -67.51 -29.67 69.14 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.954 0.502 . . . . 0.0 111.58 179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 2.4 tt -67.52 -48.74 66.17 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.1 -8.35 58.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.187 0.595 . . . . 0.0 112.563 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -61.64 97.57 0.08 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.401 1.48 . . . . 0.0 110.762 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -169.61 149.1 3.82 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 125.638 1.575 . . . . 0.0 107.252 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -61.47 -66.63 0.51 Allowed 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.707 1.203 . . . . 0.0 110.641 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . 0.452 HG22 ' H ' ' C' 1057 ' ' SER . 1.2 m 65.71 -167.06 0.22 Allowed 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 -178.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . 0.452 ' H ' HG22 ' C' 1056 ' ' THR . 0.1 OUTLIER -73.82 20.15 0.1 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.982 1.713 . . . . 0.0 113.001 -179.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 15.0 tt -141.73 171.03 12.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 O-C-N 120.689 -1.257 . . . . 0.0 109.644 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -82.51 98.59 9.01 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 4.1 m . . . . . 0 C--O 1.246 0.91 0 C-N-CA 126.487 1.915 . . . . 0.0 110.068 -179.841 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.694 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 43.8 m -148.84 -167.72 2.9 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.965 2.106 . . . . 0.0 106.552 178.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.46 127.51 32.52 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.689 1.196 . . . . 0.0 109.285 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -83.08 2.19 36.45 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.091 -1.006 . . . . 0.0 110.259 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.46 160.42 21.22 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.813 1.645 . . . . 0.0 111.016 -178.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.52 167.07 31.58 Favored 'General case' 0 C--O 1.242 0.658 0 C-N-CA 127.068 2.147 . . . . 0.0 106.383 178.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -131.74 129.74 41.02 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -112.43 174.11 6.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.258 0.623 . . . . 0.0 112.317 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 17.4 tp -150.32 153.35 35.95 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.713 178.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.15 98.82 2.74 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.88 2.072 . . . . 0.0 109.065 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . 0.451 HG11 ' HE3' ' B' ' 116' ' ' LYS . 60.9 t -153.18 147.03 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.384 -0.823 . . . . 0.0 108.861 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -103.98 102.84 12.61 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.659 -1.276 . . . . 0.0 108.406 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -142.13 110.53 0.63 Allowed Glycine 0 C--O 1.223 -0.586 0 CA-C-O 117.289 -1.839 . . . . 0.0 111.695 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -67.42 -57.17 7.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 121.225 2.512 . . . . 0.0 110.189 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -69.79 -42.57 73.59 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 122.143 0.973 . . . . 0.0 109.538 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.05 -43.06 99.45 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.764 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 10.2 t80 -69.99 -37.96 75.88 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 120.086 1.312 . . . . 0.0 110.829 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -56.17 -47.49 78.16 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.425 1.011 . . . . 0.0 109.493 178.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . 0.439 ' CG2' HD11 ' A' ' 22' ' ' ILE . 22.5 mt -62.42 -50.16 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.826 1.25 . . . . 0.0 109.15 178.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -49.04 77.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 125.457 1.503 . . . . 0.0 112.082 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.31 -52.16 63.09 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 120.957 1.708 . . . . 0.0 109.114 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -48.79 -51.82 27.23 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.157 0.583 . . . . 0.0 111.12 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 41.8 mt -71.25 -39.67 71.49 Favored 'General case' 0 N--CA 1.457 -0.11 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 33.6 tptt -65.27 -46.1 81.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 120.121 1.328 . . . . 0.0 110.161 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -57.18 -54.92 41.36 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.856 1.662 . . . . 0.0 106.691 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 5.5 t -52.74 -43.93 66.07 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.081 0.952 . . . . 0.0 111.765 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.81 -49.01 62.06 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -63.07 -42.05 99.57 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 5.3 mp -65.42 -45.66 83.01 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 117.846 -1.074 . . . . 0.0 108.852 179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 22.7 ttp -64.35 -22.57 67.0 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.749 1.613 . . . . 0.0 111.362 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -72.25 -40.36 67.75 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 177.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.71 -33.08 35.56 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -79.53 147.98 68.89 Favored Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 124.752 1.221 . . . . 0.0 109.867 -179.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -72.92 -174.16 1.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.543 2.162 . . . . 0.0 110.162 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . 0.253 13.3 pt20 -126.63 54.04 10.84 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.48 -52.51 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.935 2.423 . . . . 0.0 112.51 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.45 -41.78 85.9 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . 0.426 HG23 ' H ' ' D' 1130 ' ' VAL . 3.4 t -53.74 -50.27 52.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 C-N-CA 124.401 1.08 . . . . 0.0 110.529 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.29 70.22 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.491 0.662 . . . . 0.0 111.606 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 27.8 t -60.46 -46.28 90.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.792 0.837 . . . . 0.0 110.786 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.25 -45.24 81.29 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 124.716 1.206 . . . . 0.0 110.926 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.74 -45.26 66.92 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 124.5 1.12 . . . . 0.0 108.747 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -65.75 -55.96 14.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.229 0.468 . . . . 0.0 111.02 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.74 -30.88 64.0 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.579 -0.701 . . . . 0.0 112.408 -178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 -35.58 34.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.103 0.961 . . . . 0.0 108.772 178.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -58.12 -33.17 68.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.45 1.023 . . . . 0.0 108.935 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.42 -17.68 59.86 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.191 0.451 . . . . 0.0 112.135 178.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 1.9 tt -80.82 -35.3 33.09 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.411 1.484 . . . . 0.0 108.912 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -89.69 163.86 14.94 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.571 0.7 . . . . 0.0 110.192 179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? . . . . . 0 C--O 1.251 1.164 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 178.022 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.6 p . . . . . 0 CA--C 1.541 0.631 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -92.83 -7.98 44.81 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.461 -1.399 . . . . 0.0 112.916 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.9 m-20 -134.07 39.33 3.12 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -78.85 85.5 4.83 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.355 1.062 . . . . 0.0 108.699 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.5 tp -64.13 102.74 0.53 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.6 mt -112.77 167.71 10.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.833 2.053 . . . . 0.0 107.709 -179.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -130.26 159.43 36.92 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.808 0.843 . . . . 0.0 109.799 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.4 tp -140.39 94.72 8.41 Favored Pre-proline 0 CA--C 1.538 0.482 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.115 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.85 110.3 3.0 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 124.303 3.336 . . . . 0.0 111.653 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -139.32 151.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 124.535 1.134 . . . . 0.0 109.215 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -135.98 101.81 4.84 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.3 115.79 0.64 Allowed Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 106.269 -2.732 . . . . 0.0 106.269 178.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.55 -52.01 66.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 121.315 2.558 . . . . 0.0 109.828 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -68.96 -30.72 69.2 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.4 m -63.39 -53.13 57.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.068 0.947 . . . . 0.0 109.182 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -64.87 -47.6 77.28 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.73 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -53.41 -44.87 69.07 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.422 0.556 . . . . 0.0 111.722 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.5 mtp -73.79 -43.78 57.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.554 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mp -55.24 -50.88 68.33 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.058 0.845 . . . . 0.0 109.186 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -52.71 63.2 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 126.759 2.023 . . . . 0.0 111.289 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -55.5 -49.38 72.71 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.005 0.821 . . . . 0.0 112.225 -178.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.438 HG23 HD22 ' B' ' 115' ' ' LEU . 80.9 mt -66.12 -48.84 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -55.13 -47.21 75.36 Favored 'General case' 0 C--N 1.338 0.105 0 C-N-CA 124.06 0.944 . . . . 0.0 111.0 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -59.03 -50.14 75.2 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.047 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.8 p -53.81 -51.44 63.5 Favored 'General case' 0 C--N 1.344 0.34 0 CA-C-N 119.937 1.244 . . . . 0.0 112.936 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -62.57 -49.74 74.06 Favored 'General case' 0 C--N 1.345 0.41 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.47 -43.31 94.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.638 -178.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.87 -36.71 85.22 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.634 -0.666 . . . . 0.0 109.778 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -60.26 -44.39 95.34 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -78.69 -17.33 56.08 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.987 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -81.46 -24.13 37.0 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.003 1.274 . . . . 0.0 109.735 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.8 tp -127.36 71.69 76.87 Favored Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.14 0.976 . . . . 0.0 109.006 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.3 150.92 81.4 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.166 1.911 . . . . 0.0 110.049 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -159.5 165.73 32.39 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.302 1.041 . . . . 0.0 110.607 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -58.23 -40.6 82.15 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.52 1.128 . . . . 0.0 111.098 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.3 m -57.08 -51.13 70.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.234 1.414 . . . . 0.0 109.905 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 66.8 mt -59.1 -45.19 92.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 124.99 1.316 . . . . 0.0 108.92 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -60.23 -45.46 93.14 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 122.403 0.281 . . . . 0.0 111.503 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.4 m -61.26 -48.19 82.58 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.109 0.963 . . . . 0.0 108.525 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.4 -50.42 71.65 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.784 0.833 . . . . 0.0 109.179 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.3 ttt-85 -56.09 -47.04 78.8 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 119.221 -0.419 . . . . 0.0 110.985 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -56.93 15.03 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.429 1.092 . . . . 0.0 110.423 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -55.76 -35.86 66.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.357 1.063 . . . . 0.0 111.352 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -69.51 -48.74 59.52 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -60.26 -38.8 84.65 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.59 1.156 . . . . 0.0 111.183 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -26.13 66.6 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.037 0.935 . . . . 0.0 110.715 178.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.71 -39.12 76.5 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 120.129 1.331 . . . . 0.0 110.743 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -64.54 -42.28 95.82 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.4 1.455 . . . . 0.0 109.757 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -62.55 -42.46 99.55 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -65.65 -37.35 86.3 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.095 0.558 . . . . 0.0 111.063 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.1 mt -68.09 -26.37 65.79 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.827 1.251 . . . . 0.0 110.611 178.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.6 tp -101.73 16.73 24.91 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.407 1.483 . . . . 0.0 110.366 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 45.7 56.84 5.5 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.954 3.302 . . . . 0.0 113.821 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -105.37 153.04 22.2 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -49.82 98.85 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.125 1.37 . . . . 0.0 111.727 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.8 p -148.03 -62.58 0.26 Allowed 'General case' 0 CA--C 1.527 0.078 0 C-N-CA 124.793 1.237 . . . . 0.0 110.416 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m 56.09 79.2 0.18 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.598 1.559 . . . . 0.0 110.214 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.4 tt -116.93 136.88 52.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 O-C-N 121.856 -0.528 . . . . 0.0 110.962 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -72.43 158.98 34.74 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 124.101 0.96 . . . . 0.0 110.825 179.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.15 1.78 . . . . 0.0 107.457 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.518 0 N-CA-C 108.264 -1.934 . . . . 0.0 108.264 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 48.4 m -136.29 -179.59 5.77 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -108.36 146.75 32.54 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -17.31 56.37 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -72.73 168.81 17.99 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.612 0.72 . . . . 0.0 111.272 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 51.7 m -100.96 155.06 18.18 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.945 2.098 . . . . 0.0 107.868 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . 0.43 ' HB3' ' CD2' ' D' 1109 ' ' PHE . 37.7 m-85 -120.68 130.58 54.15 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 121.675 0.75 . . . . 0.0 109.445 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -112.26 159.12 18.93 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 127.529 2.332 . . . . 0.0 109.846 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.445 ' HB3' ' HE2' ' D' 1116 ' ' LYS . 28.5 mt -150.65 142.27 23.59 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 179.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -147.69 106.92 3.87 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.117 1.767 . . . . 0.0 112.068 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.433 ' CG2' ' HE3' ' D' 1116 ' ' LYS . 53.2 t -155.22 149.75 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 120.39 1.45 . . . . 0.0 110.425 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.1 102.42 14.95 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 102.575 -3.12 . . . . 0.0 102.575 176.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -143.65 109.78 0.56 Allowed Glycine 0 C--O 1.226 -0.381 0 CA-C-O 115.671 -2.738 . . . . 0.0 106.44 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -68.32 -56.98 6.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 121.873 2.837 . . . . 0.0 112.002 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -64.31 -46.55 83.06 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.29 -51.19 60.0 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 125.062 1.345 . . . . 0.0 110.781 -178.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' D' 1099 ' ' TYR . 57.4 t80 -65.78 -45.74 81.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 119.753 1.161 . . . . 0.0 112.497 -178.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -55.55 -53.65 53.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.031 0.832 . . . . 0.0 109.964 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.0 -57.17 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 124.902 1.281 . . . . 0.0 109.452 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 49.6 mt -57.08 -27.99 62.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.823 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 1.5 mmm -72.39 -52.16 17.25 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.35 -45.44 69.13 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.438 HD22 HG23 ' A' ' 22' ' ' ILE . 42.6 mt -67.03 -31.47 72.02 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -68.01 -56.55 8.51 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -52.89 -57.0 11.72 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 128.64 2.776 . . . . 0.0 110.319 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 11.6 t -54.47 -52.12 62.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.083 1.353 . . . . 0.0 111.6 -179.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.441 ' HB3' HD21 ' D' 1108 ' ' ASN . 4.3 mm? -66.99 -30.75 70.95 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.485 1.039 . . . . 0.0 111.161 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -65.8 -45.43 82.41 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 120.998 1.726 . . . . 0.0 108.347 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 30.1 mt -63.14 -49.86 72.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.13 0.972 . . . . 0.0 109.582 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 4.8 ttt -56.86 -35.49 68.95 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.654 0.782 . . . . 0.0 110.605 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -72.43 -33.03 66.8 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.383 1.073 . . . . 0.0 112.458 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.1 pp -93.15 -31.37 14.81 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 66.3 t -84.32 145.68 46.03 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 125.476 1.51 . . . . 0.0 108.392 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.74 -176.7 1.01 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.549 2.833 . . . . 0.0 111.959 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.78 34.76 0.21 Allowed Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.1 -44.87 21.85 Favored 'Trans proline' 0 C--N 1.35 0.62 0 CA-C-N 122.857 2.056 . . . . 0.0 112.766 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.5 -26.17 67.04 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 13.9 t -72.23 -47.76 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -59.24 -51.7 68.84 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.785 1.234 . . . . 0.0 111.319 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 19.4 m -62.08 -49.15 77.09 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 122.358 -0.214 . . . . 0.0 110.822 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -63.09 -38.37 90.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.306 -0.246 . . . . 0.0 110.996 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -44.69 87.57 Favored 'General case' 0 C--N 1.337 0.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -66.18 -44.44 83.98 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.244 0.618 . . . . 0.0 109.996 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -59.66 -55.29 36.29 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.172 0.989 . . . . 0.0 111.233 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -37.49 84.8 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -58.21 -34.84 70.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.719 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.86 -25.33 68.23 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 120.314 1.415 . . . . 0.0 111.457 178.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.3 -25.29 51.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.461 1.028 . . . . 0.0 112.911 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -127.83 105.65 8.58 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 119.622 1.101 . . . . 0.0 109.267 -178.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 126.161 1.784 . . . . 0.0 107.762 -179.882 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 97.9 p . . . . . 0 C--O 1.224 -0.244 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -73.07 0.17 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 121.247 1.839 . . . . 0.0 110.436 -178.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -76.59 40.25 0.23 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.483 1.513 . . . . 0.0 111.669 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.43 77.38 1.91 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 126.03 1.732 . . . . 0.0 107.986 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.73 109.32 0.9 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.14 151.36 34.5 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 105.709 -1.96 . . . . 0.0 105.709 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -117.83 101.28 8.18 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.36 0.982 . . . . 0.0 109.461 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 10.3 tp -75.52 112.04 17.22 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 117.154 -1.403 . . . . 0.0 109.845 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -88.84 117.46 0.88 Allowed 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 124.46 3.44 . . . . 0.0 111.514 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.8 t -145.75 149.24 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.129 0.877 . . . . 0.0 112.981 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -133.64 100.41 4.78 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 175.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.57 104.19 0.22 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 105.633 -2.987 . . . . 0.0 105.633 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 24.2 tpt180 -57.27 -51.43 69.41 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 121.122 2.461 . . . . 0.0 111.8 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.7 -41.5 87.92 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 118.593 0.633 . . . . 0.0 110.261 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.3 m -62.53 -35.98 81.14 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.131 0.972 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 35.0 t80 -69.45 -50.45 45.47 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.825 -1.172 . . . . 0.0 109.298 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -56.33 -54.51 44.65 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.502 1.121 . . . . 0.0 110.297 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 45.9 mtp -63.45 -38.05 89.64 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.506 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.88 -46.15 86.18 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 120.106 1.321 . . . . 0.0 110.021 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.33 -48.21 76.42 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 123.924 0.89 . . . . 0.0 111.431 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -55.65 -49.09 73.82 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.612 0.765 . . . . 0.0 110.783 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . . . . . . . . . 95.6 mt -66.54 -49.62 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -53.38 -44.43 68.61 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 124.132 0.973 . . . . 0.0 111.164 -179.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -62.65 -48.67 78.32 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 117.669 -1.158 . . . . 0.0 109.42 -179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 86.4 p -53.64 -46.85 70.66 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.822 1.192 . . . . 0.0 112.781 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.93 -58.08 5.14 Favored 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 123.331 0.652 . . . . 0.0 112.552 -179.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.94 -52.47 62.89 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.372 1.069 . . . . 0.0 111.398 -178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.9 -43.33 94.88 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.496 -0.752 . . . . 0.0 111.757 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 17.0 tmm? -62.95 -43.76 97.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 118.72 0.691 . . . . 0.0 110.956 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -67.51 -23.45 65.46 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.684 0.675 . . . . 0.0 111.02 179.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -80.93 -23.01 39.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.282 0.633 . . . . 0.0 110.407 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 24.5 tp -116.55 66.46 3.48 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 124.687 1.195 . . . . 0.0 110.609 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -68.22 142.43 55.42 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 121.249 1.3 . . . . 0.0 109.162 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.2 163.27 38.68 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.376 1.47 . . . . 0.0 107.903 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -72.19 -24.74 61.46 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.387 0.994 . . . . 0.0 111.345 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 57.0 m -61.63 -50.62 71.81 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 72.1 mt -59.79 -47.12 92.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 126.341 1.856 . . . . 0.0 108.726 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -54.51 -48.22 72.17 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.779 1.632 . . . . 0.0 111.033 -179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 10.0 m -66.3 -46.13 78.02 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.122 0.969 . . . . 0.0 108.87 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -42.72 81.11 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 124.011 0.925 . . . . 0.0 110.192 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -58.54 -46.76 86.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.51 -41.81 96.2 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.643 -1.17 . . . . 0.0 111.0 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.34 -49.46 72.16 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.951 1.25 . . . . 0.0 109.111 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -60.33 -47.25 86.82 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.072 0.949 . . . . 0.0 110.28 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -64.65 -29.73 70.73 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.73 0.812 . . . . 0.0 111.977 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -43.66 92.24 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.685 1.194 . . . . 0.0 110.764 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -55.93 -40.81 73.65 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.238 0.615 . . . . 0.0 111.653 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -59.94 -44.08 94.59 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.493 0.717 . . . . 0.0 109.27 179.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -70.59 -35.69 73.17 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.684 -0.635 . . . . 0.0 111.956 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 1.3 t60 -57.4 -33.25 67.65 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.127 1.371 . . . . 0.0 110.406 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 52.5 mt -55.96 -47.41 77.66 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 9.7 mp -79.39 16.18 1.08 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.034 1.334 . . . . 0.0 111.821 179.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 56.11 23.08 6.54 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.835 2.454 . . . . 0.0 113.813 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -66.66 153.06 44.12 Favored 'General case' 0 CA--C 1.519 -0.225 0 O-C-N 121.186 -0.947 . . . . 0.0 108.676 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 7.5 pm0 -55.48 108.62 0.45 Allowed 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 178.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 4.9 p -144.08 -40.62 0.28 Allowed 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 124.275 1.03 . . . . 0.0 110.991 -178.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 3.9 m 28.03 68.26 0.07 Allowed 'General case' 0 C--O 1.238 0.454 0 C-N-CA 129.651 3.18 . . . . 0.0 111.586 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 20.6 tt -114.98 131.73 66.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 125.67 1.588 . . . . 0.0 110.75 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.71 158.53 35.21 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 5.3 p . . . . . 0 C--O 1.257 1.487 0 C-N-CA 124.127 0.971 . . . . 0.0 109.492 179.312 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.455 0 N-CA-C 108.764 -1.734 . . . . 0.0 108.764 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 19.3 m -152.99 158.53 42.17 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -71.37 167.76 18.87 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.36 0.22 24.77 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -177.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 35.7 t0 -81.54 159.51 24.12 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.278 0.944 . . . . 0.0 113.317 -179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 29.0 m -82.56 149.13 27.65 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.862 1.265 . . . . 0.0 109.426 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . 0.426 ' HB3' ' CD2' ' B' ' 109' ' ' PHE . 43.8 m-85 -107.16 134.8 49.73 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.59 144.67 47.99 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 128.206 2.602 . . . . 0.0 112.437 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 62.2 mt -147.57 155.16 41.55 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.353 1.461 . . . . 0.0 110.145 178.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -152.16 108.84 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.565 1.546 . . . . 0.0 111.927 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 95.0 t -153.19 150.15 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-N 120.344 1.429 . . . . 0.0 109.757 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.54 102.92 12.82 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.2 113.68 0.79 Allowed Glycine 0 N--CA 1.454 -0.141 0 N-CA-C 106.65 -2.58 . . . . 0.0 106.65 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -64.92 -57.03 9.86 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 121.265 2.533 . . . . 0.0 110.538 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 19.8 mttp -63.18 -42.5 99.37 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.965 0.802 . . . . 0.0 108.98 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . 0.441 HD21 ' HB3' ' B' ' 119' ' ' LEU . 88.7 m-20 -60.03 -40.75 90.42 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.296 -178.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . 0.43 ' CD2' ' HB3' ' B' ' 99' ' ' TYR . 28.8 t80 -65.25 -43.7 90.51 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 120.372 1.442 . . . . 0.0 109.23 178.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -58.37 -53.75 54.82 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.113 0.87 . . . . 0.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.75 -57.91 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.197 1.399 . . . . 0.0 110.132 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 66.8 mt -59.47 -35.85 74.87 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 117.15 -1.405 . . . . 0.0 111.309 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.07 -49.46 74.42 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 120.557 1.526 . . . . 0.0 108.602 178.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 51.8 mttm -53.57 -50.94 64.47 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.29 -33.01 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' B' ' 101' ' ' LEU . 27.8 tptt -64.79 -57.96 7.52 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -52.28 -49.39 64.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.487 1.915 . . . . 0.0 108.319 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 28.7 t -52.96 -55.02 26.54 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 126.238 1.815 . . . . 0.0 114.281 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.56 -36.47 82.73 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.473 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -68.81 -38.1 79.68 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.738 1.154 . . . . 0.0 110.222 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 46.7 mt -65.33 -44.93 86.24 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.923 -0.486 . . . . 0.0 109.882 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttt -61.86 -38.32 87.8 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.244 1.018 . . . . 0.0 110.693 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.47 -44.08 79.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.749 -0.594 . . . . 0.0 110.643 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.3 pp -75.65 -31.78 59.95 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -92.42 147.37 34.28 Favored Pre-proline 0 N--CA 1.47 0.542 0 CA-C-N 120.105 1.32 . . . . 0.0 110.064 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -73.2 177.48 7.78 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.057 1.838 . . . . 0.0 108.95 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.61 47.12 0.28 Allowed Pre-proline 0 CA--C 1.556 1.178 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -178.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.45 -48.03 0.64 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.091 1.861 . . . . 0.0 112.981 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.92 -25.89 68.35 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 17.2 t -72.12 -48.15 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 126.22 1.808 . . . . 0.0 108.755 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.67 -41.41 81.48 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.505 0.722 . . . . 0.0 110.145 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 50.8 m -70.84 -50.23 37.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.352 1.061 . . . . 0.0 110.877 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 22.1 t80 -61.53 -35.59 78.16 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.323 0.965 . . . . 0.0 110.368 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.61 -47.16 86.68 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -60.84 -48.12 83.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.499 1.045 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -56.57 -57.86 10.56 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.312 1.045 . . . . 0.0 111.448 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -34.86 78.95 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.859 -0.526 . . . . 0.0 111.976 -178.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.87 -27.53 68.29 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 1.4 tt -60.42 -38.75 85.05 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.92 3.16 7.14 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.581 1.952 . . . . 0.0 112.338 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -140.64 124.12 16.89 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 121.332 1.878 . . . . 0.0 112.776 -178.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 . . . . . 0 C--O 1.252 1.227 1 C-N-CA 132.323 4.249 . . . . 0.0 106.422 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.3 p . . . . . 0 N--CA 1.466 0.361 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -59.9 -63.43 1.3 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.859 1.264 . . . . 0.0 109.305 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.85 -49.82 19.22 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 76.36 168.11 0.26 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.903 2.081 . . . . 0.0 111.574 179.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 13.0 tp -73.16 94.7 1.98 Allowed 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.4 mt -93.32 161.24 14.48 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.029 0.931 . . . . 0.0 110.761 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -134.16 118.61 17.87 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.627 1.571 . . . . 0.0 108.756 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 43.6 tp -108.96 100.2 38.87 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 123.796 0.838 . . . . 0.0 110.532 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.74 125.42 7.45 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.202 2.601 . . . . 0.0 111.16 178.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.2 t -145.15 146.18 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.788 1.635 . . . . 0.0 107.919 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -126.01 100.19 6.25 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.4 126.14 1.37 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -66.99 -52.68 39.75 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 120.781 2.291 . . . . 0.0 109.712 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.95 -33.72 75.2 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 122.4 0.28 . . . . 0.0 110.751 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -45.87 92.22 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -67.03 -40.05 87.11 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.089 0.404 . . . . 0.0 111.435 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -60.48 -57.36 13.07 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.588 0.755 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.4 ppp? -62.87 -38.94 92.88 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 118.822 -0.608 . . . . 0.0 110.591 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.38 -50.6 72.24 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mt -59.51 -47.31 86.03 Favored 'General case' 0 C--O 1.23 0.066 0 CA-C-O 118.183 -0.913 . . . . 0.0 112.298 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -62.59 -47.37 84.11 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.489 1.04 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.5 mt -65.03 -41.03 90.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 123.707 0.803 . . . . 0.0 110.371 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -62.47 -60.07 4.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.569 1.148 . . . . 0.0 108.726 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.19 -47.14 84.35 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 124.192 0.932 . . . . 0.0 110.557 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.7 t -52.46 -51.61 58.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.287 0.949 . . . . 0.0 112.631 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.46 -47.67 69.44 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.462 0.574 . . . . 0.0 109.484 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -55.25 -49.44 72.03 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 118.203 0.456 . . . . 0.0 111.665 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.26 -46.23 67.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 117.541 -1.219 . . . . 0.0 110.112 -178.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -36.02 72.39 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 120.134 1.334 . . . . 0.0 110.596 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -69.64 -35.59 75.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.104 1.362 . . . . 0.0 110.678 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -83.72 -36.86 23.36 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.673 0.789 . . . . 0.0 113.016 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.62 149.85 96.81 Favored Pre-proline 0 CA--C 1.536 0.406 0 CA-C-N 119.228 0.922 . . . . 0.0 108.55 179.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -67.74 165.58 27.2 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.63 1.553 . . . . 0.0 109.404 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -82.01 4.72 21.72 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.941 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -48.68 -57.86 5.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.672 1.123 . . . . 0.0 113.219 -178.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.9 m -59.84 -38.24 81.51 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.751 0.705 . . . . 0.0 110.963 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.58 -42.45 96.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.95 0.9 . . . . 0.0 109.16 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -62.82 -50.08 72.39 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.557 0.743 . . . . 0.0 109.132 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.46 -37.52 83.87 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.265 0.555 . . . . 0.0 110.191 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -66.73 -54.08 26.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.318 1.047 . . . . 0.0 111.362 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -63.94 -33.23 75.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.845 1.202 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -61.32 -57.99 10.07 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.678 -1.231 . . . . 0.0 107.678 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -65.17 -30.71 71.64 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.205 0.911 . . . . 0.0 113.206 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -58.17 -46.72 85.24 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -76.11 -51.34 12.43 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 111.593 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -49.42 -37.32 25.12 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 116.698 -1.62 . . . . 0.0 113.649 -177.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -54.48 -47.79 72.57 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 121.486 1.948 . . . . 0.0 112.565 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -61.29 -39.04 88.98 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.833 0.742 . . . . 0.0 109.64 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -68.84 -34.43 75.48 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.704 0.802 . . . . 0.0 110.912 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -63.0 -41.58 99.62 Favored 'General case' 0 C--N 1.338 0.08 0 CA-C-N 119.417 1.008 . . . . 0.0 109.138 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.6 mp -60.59 -32.01 71.13 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.263 0.483 . . . . 0.0 109.98 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 69.7 mt -76.18 2.21 13.73 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 117.162 -1.399 . . . . 0.0 113.368 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 14.31 82.14 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 129.79 3.236 . . . . 0.0 114.268 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -80.0 48.49 0.98 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.279 -0.888 . . . . 0.0 110.806 179.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 41.35 54.56 3.51 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.357 2.263 . . . . 0.0 111.091 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.22 47.87 0.39 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.067 1.347 . . . . 0.0 111.708 -179.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.3 95.92 1.75 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.3 tt -160.21 156.44 3.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 127.186 2.194 . . . . 0.0 105.791 179.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -146.32 158.5 43.89 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.1 p . . . . . 0 C--O 1.257 1.46 0 C-N-CA 128.584 2.754 . . . . 0.0 103.622 179.368 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.462 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 20.0 m -94.86 -166.19 1.43 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.938 2.095 . . . . 0.0 109.011 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -67.15 167.22 12.48 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -55.91 -28.44 56.74 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.542 1.537 . . . . 0.0 111.449 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 44.55 77.09 0.08 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 126.709 2.004 . . . . 0.0 111.207 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.9 142.05 26.09 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.051 0.453 . . . . 0.0 110.491 179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -122.65 148.75 44.91 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.094 0.957 . . . . 0.0 109.425 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -134.3 160.18 38.69 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 124.603 1.161 . . . . 0.0 109.292 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 79.1 mt -144.3 161.19 39.57 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -150.57 110.11 4.02 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.287 1.835 . . . . 0.0 106.954 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 1.9 m -155.89 151.32 9.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.115 0.966 . . . . 0.0 111.473 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.443 ' HB3' ' HA ' ' D' 1098 ' ' THR . 3.7 ptt180 -117.6 100.62 7.75 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 119.744 1.156 . . . . 0.0 111.682 178.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -145.4 119.65 1.25 Allowed Glycine 0 CA--C 1.521 0.427 0 CA-C-O 116.429 -2.317 . . . . 0.0 109.058 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -61.55 -56.89 15.09 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 121.451 2.626 . . . . 0.0 109.298 178.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -58.59 -47.13 85.33 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.23 0.612 . . . . 0.0 109.652 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -58.89 -44.71 91.22 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 112.525 -179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -64.13 -44.92 90.72 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 120.645 1.566 . . . . 0.0 110.596 -178.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -56.37 -54.16 48.78 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 122.016 0.912 . . . . 0.0 111.694 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.519 HG21 HD11 ' C' 1022 ' ' ILE . 57.6 mt -69.1 -49.18 64.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -177.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 76.7 mt -61.44 -38.17 86.2 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 119.75 1.159 . . . . 0.0 110.657 -179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 69.4 mtp -61.42 -52.89 62.71 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.316 0.962 . . . . 0.0 110.032 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -63.34 -40.73 98.11 Favored 'General case' 0 C--N 1.344 0.326 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.379 -178.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.84 -36.45 78.17 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.547 1.067 . . . . 0.0 111.207 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 7.2 tptp -70.66 -47.34 60.45 Favored 'General case' 0 N--CA 1.462 0.152 0 O-C-N 120.343 -1.473 . . . . 0.0 108.484 178.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -58.16 -51.59 69.07 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.411 1.485 . . . . 0.0 110.233 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 27.3 m -61.0 -39.94 91.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 118.321 -0.847 . . . . 0.0 111.509 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -41.96 89.92 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 119.128 0.876 . . . . 0.0 109.122 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.16 -36.72 84.97 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.48 0.582 . . . . 0.0 111.149 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -68.17 -47.97 66.56 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 33.1 ttp -65.9 -27.97 68.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 118.728 0.695 . . . . 0.0 109.993 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -68.63 -39.57 80.69 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 118.061 -0.971 . . . . 0.0 109.191 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.9 -24.23 44.3 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.993 1.27 . . . . 0.0 111.55 179.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.54 145.05 66.64 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.21 -84.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.841 0 N-CA-C 108.377 -1.432 . . . . 0.0 108.377 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -167.65 63.04 0.63 Allowed Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 125.013 1.325 . . . . 0.0 110.14 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -70.93 -106.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 124.049 3.166 . . . . 0.0 112.178 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.41 -25.6 66.06 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 120.906 -1.122 . . . . 0.0 109.168 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 t -54.98 -45.15 76.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.509 1.124 . . . . 0.0 108.559 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -74.9 -44.17 50.3 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.861 0.865 . . . . 0.0 110.998 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 22.9 t -61.96 -51.55 67.63 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.288 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.6 -39.5 93.83 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.072 0.949 . . . . 0.0 110.488 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -55.83 -46.98 77.99 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-N 118.999 0.818 . . . . 0.0 109.152 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -65.36 -51.89 57.44 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.89 -47.69 70.84 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.148 0.979 . . . . 0.0 112.996 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.98 -34.5 75.41 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.576 1.08 . . . . 0.0 109.053 179.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.81 -28.05 69.2 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.039 -1.038 . . . . 0.0 109.536 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 58.9 mt -63.45 -15.65 58.34 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.087 0.858 . . . . 0.0 112.235 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 7.8 tt -77.1 -21.46 54.27 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.917 1.287 . . . . 0.0 110.302 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -96.07 172.63 7.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.994 1.318 . . . . 0.0 111.804 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 . . . . . 0 C--O 1.244 0.795 0 C-N-CA 127.511 2.324 . . . . 0.0 107.73 -179.296 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 81.2 p . . . . . 0 N--CA 1.463 0.221 0 CA-C-O 118.864 -0.588 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 38.8 t0 -69.39 -75.65 0.11 Allowed 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 125.685 1.594 . . . . 0.0 111.279 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.86 -44.3 77.44 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 125.251 1.42 . . . . 0.0 109.672 -176.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 7.3 tp10 76.17 167.78 0.26 Allowed 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 127.374 2.27 . . . . 0.0 112.673 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 6.5 tp -72.86 95.91 2.01 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.881 1.672 . . . . 0.0 106.787 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 46.3 mt -100.31 168.81 9.54 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -140.23 147.23 39.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.878 1.271 . . . . 0.0 108.743 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 33.3 tp -124.02 94.5 45.48 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.037 1.335 . . . . 0.0 108.02 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.56 121.48 5.59 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.764 2.309 . . . . 0.0 109.505 179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 23.9 t -144.94 159.92 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.298 1.039 . . . . 0.0 109.674 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 12.7 ptt-85 -136.52 102.9 5.08 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.988 1.267 . . . . 0.0 109.186 176.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -166.97 139.01 5.5 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-O 117.613 -1.66 . . . . 0.0 110.274 178.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -71.03 -52.09 21.55 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.618 2.209 . . . . 0.0 106.901 177.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.3 -46.5 67.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.669 1.188 . . . . 0.0 107.817 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 3.0 m -56.41 -44.93 80.83 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.217 0.462 . . . . 0.0 111.308 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 50.2 t80 -65.29 -51.57 59.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.765 0.712 . . . . 0.0 111.0 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -54.97 -57.11 12.99 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.477 1.111 . . . . 0.0 111.414 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.1 ppp? -61.02 -46.78 89.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.513 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 33.9 mt -61.68 -48.18 81.98 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 117.747 -1.121 . . . . 0.0 110.427 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 2.9 mm? -60.63 -53.14 61.11 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 120.048 1.295 . . . . 0.0 110.632 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -55.58 -48.62 74.52 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . 0.519 HD11 HG21 ' B' ' 111' ' ' ILE . 84.5 mt -67.69 -43.07 86.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 122.996 0.518 . . . . 0.0 112.264 -178.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -66.57 -48.92 68.08 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 118.159 -0.924 . . . . 0.0 109.817 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.83 -44.86 91.96 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.238 -0.887 . . . . 0.0 108.611 -178.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 16.2 t -56.97 -38.09 72.52 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.661 1.119 . . . . 0.0 111.737 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 3.5 tm? -71.09 -57.75 4.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.195 0.598 . . . . 0.0 110.743 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -56.35 -48.04 77.6 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 122.875 0.47 . . . . 0.0 110.119 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.14 -47.04 86.75 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 118.279 -0.867 . . . . 0.0 109.523 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.3 68.66 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.372 0.987 . . . . 0.0 110.907 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -71.58 -34.59 70.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.663 0.785 . . . . 0.0 111.734 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -77.84 -27.51 49.91 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.887 1.221 . . . . 0.0 110.637 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 1.2 mp -73.54 157.33 87.88 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.946 0.898 . . . . 0.0 109.357 178.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -77.49 161.77 31.1 Favored 'Trans proline' 0 N--CA 1.452 -0.94 0 C-N-CA 121.873 1.715 . . . . 0.0 110.074 178.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -75.54 -2.78 30.61 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 117.671 -1.157 . . . . 0.0 113.833 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -48.31 -58.47 4.54 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 120.18 1.355 . . . . 0.0 112.985 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 23.8 m -65.49 -34.1 77.47 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.981 -1.074 . . . . 0.0 111.123 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.91 -44.94 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.268 1.427 . . . . 0.0 109.921 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.77 -56.75 13.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.584 1.153 . . . . 0.0 108.759 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 83.0 m -59.24 -36.43 75.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.339 -0.838 . . . . 0.0 110.67 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 32.0 t80 -61.09 -53.89 51.46 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.293 0.951 . . . . 0.0 109.158 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -41.67 94.47 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.975 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.58 -46.58 89.69 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.061 0.846 . . . . 0.0 110.708 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -66.41 -40.23 89.45 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 118.957 0.799 . . . . 0.0 110.625 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -57.74 -52.62 64.72 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.701 1.2 . . . . 0.0 108.822 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -64.15 -43.86 93.92 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.069 0.948 . . . . 0.0 111.017 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -57.95 -35.99 71.91 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 117.078 -1.439 . . . . 0.0 113.108 -179.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -54.99 -43.73 73.85 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 121.028 1.74 . . . . 0.0 111.423 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 8.6 m80 -62.62 -37.5 86.55 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 122.082 -0.386 . . . . 0.0 110.237 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 93.0 mm-40 -71.31 -40.87 70.52 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.339 -0.85 . . . . 0.0 111.199 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 62.9 m170 -53.83 -41.01 66.92 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 124.989 1.316 . . . . 0.0 112.292 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 7.6 mp -56.75 -25.83 55.85 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.229 0.922 . . . . 0.0 112.654 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 11.3 mp -90.1 -1.12 57.9 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.725 1.21 . . . . 0.0 112.883 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 23.82 73.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 128.972 2.909 . . . . 0.0 113.476 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -71.39 64.75 0.41 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.655 1.582 . . . . 0.0 110.518 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 55.8 tt0 25.22 58.89 0.05 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 129.112 2.965 . . . . 0.0 111.522 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 9.1 m -83.2 55.72 3.24 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 1.2 t -165.24 100.43 0.73 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 16.6 tt -166.78 156.47 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 127.789 2.436 . . . . 0.0 105.742 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -146.48 158.42 43.89 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 20.0 p . . . . . 0 C--O 1.255 1.368 0 C-N-CA 128.783 2.833 . . . . 0.0 103.518 179.277 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.921 0 N-CA-C 110.927 -0.869 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 15.9 m -103.31 -156.17 0.55 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.103 1.361 . . . . 0.0 108.024 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -68.7 175.39 3.57 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.64 1.176 . . . . 0.0 110.439 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -30.01 69.42 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.673 1.189 . . . . 0.0 108.095 177.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 26.2 t70 36.43 78.32 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 130.851 3.66 . . . . 0.0 113.726 178.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . 0.443 ' HA ' ' HB3' ' B' ' 104' ' ' ARG . 40.6 m -157.62 136.8 11.77 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.498 1.919 . . . . 0.0 106.368 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -115.69 158.27 23.03 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -138.13 161.26 37.26 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.973 0.909 . . . . 0.0 108.961 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 69.3 mt -139.08 153.36 48.03 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 107.521 -1.289 . . . . 0.0 107.521 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -146.94 99.49 3.19 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 127.861 2.465 . . . . 0.0 105.798 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.49 151.09 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 124.467 1.107 . . . . 0.0 111.146 -178.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.49 102.06 8.01 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 122.212 1.006 . . . . 0.0 110.266 178.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.63 110.02 0.57 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 106.848 -2.501 . . . . 0.0 106.848 178.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 -55.53 -57.46 11.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 121.358 2.579 . . . . 0.0 112.43 -179.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 98.7 mttt -66.37 -39.51 89.16 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.001 -0.437 . . . . 0.0 110.026 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -56.5 -50.71 71.0 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.976 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 52.6 t80 -62.08 -43.88 97.89 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.15 0.886 . . . . 0.0 111.464 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.33 -51.62 69.01 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 118.551 0.614 . . . . 0.0 110.823 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 83.9 mt -66.9 -54.53 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 124.58 1.152 . . . . 0.0 110.742 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.34 -32.66 68.73 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.189 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 31.4 mtp -66.3 -52.08 50.92 Favored 'General case' 0 C--N 1.345 0.383 0 CA-C-N 119.764 1.166 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -60.69 -41.56 95.4 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 119.303 -0.959 . . . . 0.0 110.712 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.07 -60.79 2.64 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.659 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . . . . . . . . . 15.7 tptp -53.88 -45.11 70.94 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.298 0.954 . . . . 0.0 112.724 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.05 -49.75 74.72 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.661 0.6 . . . . 0.0 109.481 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 41.9 m -61.71 -34.84 76.5 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.85 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -66.07 -42.07 89.91 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.928 1.291 . . . . 0.0 108.508 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.32 -44.01 89.19 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.83 -38.02 89.09 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.114 -0.946 . . . . 0.0 111.424 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.6 ttp -77.26 -20.05 55.69 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 120.548 1.522 . . . . 0.0 109.957 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -81.89 -26.07 34.45 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.077 -1.014 . . . . 0.0 111.079 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 1.8 pp -92.08 -33.55 14.74 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.316 -0.865 . . . . 0.0 110.441 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 80.5 t -85.32 147.14 46.47 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.93 -88.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.018 3.145 . . . . 0.0 114.818 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -170.64 58.64 0.29 Allowed Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.341 1.456 . . . . 0.0 110.864 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.3 -90.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.421 2.747 . . . . 0.0 113.39 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.6 -25.1 67.24 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 2.7 t -54.61 -56.4 10.54 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.675 1.19 . . . . 0.0 108.937 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 13.2 t0 -69.4 -44.64 71.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.683 0.674 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 7.6 t -55.82 -50.44 70.52 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.118 0.567 . . . . 0.0 111.621 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 17.9 t80 -69.08 -43.75 73.92 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -45.58 69.51 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 119.411 1.005 . . . . 0.0 110.56 179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -64.76 -53.12 52.15 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 119.623 1.101 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.5 -40.89 75.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.44 1.496 . . . . 0.0 111.39 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.04 -32.29 39.5 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.341 1.856 . . . . 0.0 110.251 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -57.08 -39.25 74.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 58.0 mt -53.62 -21.44 6.74 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.58 -10.46 59.57 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.489 1.116 . . . . 0.0 111.99 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . 0.425 ' CD ' ' H ' ' D' 1142 ' ' ARG . 0.0 OUTLIER -102.15 172.84 6.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.564 1.146 . . . . 0.0 111.045 -179.632 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . 0.425 ' H ' ' CD ' ' D' 1141 ' ' GLN . 10.0 ptt180 . . . . . 0 C--O 1.248 1.005 0 C-N-CA 127.921 2.488 . . . . 0.0 106.787 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -79.64 -3.41 47.04 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.323 -0.86 . . . . 0.0 109.55 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -103.51 -0.76 29.4 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.121 2.168 . . . . 0.0 113.762 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -112.14 122.4 47.63 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.94 127.29 32.12 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 43.0 mt -120.47 173.91 6.87 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.297 1.439 . . . . 0.0 109.634 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -139.84 149.82 43.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -116.12 96.55 47.57 Favored Pre-proline 0 CA--C 1.536 0.439 0 C-N-CA 124.772 1.229 . . . . 0.0 108.653 -179.437 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.71 110.97 1.69 Allowed 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.3 3.333 . . . . 0.0 112.9 -178.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.9 t -144.84 158.77 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.849 1.204 . . . . 0.0 110.46 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 50.0 ttt-85 -135.05 103.44 5.56 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.062 1.345 . . . . 0.0 108.651 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.22 132.6 2.65 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 108.181 -1.968 . . . . 0.0 108.181 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt85 -70.63 -51.35 28.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 121.132 2.466 . . . . 0.0 109.885 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.09 -36.3 77.43 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.3 m -63.29 -52.22 62.86 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.218 -0.896 . . . . 0.0 109.787 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -58.17 -47.79 82.3 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 119.719 1.145 . . . . 0.0 110.337 -179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -54.15 -57.19 12.07 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.803 0.69 . . . . 0.0 112.319 -179.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -66.95 -43.8 82.22 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.076 0.55 . . . . 0.0 111.929 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.2 tp -55.83 -49.21 73.89 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.785 0.834 . . . . 0.0 110.016 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 tt -70.48 -47.87 58.5 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.032 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -55.35 -44.84 76.33 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 119.887 1.221 . . . . 0.0 113.657 -178.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -75.4 -32.17 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -68.29 -41.88 80.32 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.462 -1.399 . . . . 0.0 109.252 178.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.34 -55.5 17.88 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 125.653 1.581 . . . . 0.0 110.791 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 p -54.16 -43.41 70.59 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 118.626 0.648 . . . . 0.0 110.594 179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.3 tt -68.01 -56.49 8.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 118.391 -0.814 . . . . 0.0 110.808 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -53.71 -43.39 68.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.406 1.003 . . . . 0.0 111.743 -178.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.9 -53.68 19.79 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.165 -0.922 . . . . 0.0 108.842 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -54.93 -49.08 72.19 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.122 1.328 . . . . 0.0 110.835 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -64.03 -27.18 68.94 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.047 0.84 . . . . 0.0 110.995 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -77.39 -49.26 15.26 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.516 1.053 . . . . 0.0 110.687 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.494 HD22 HD22 ' B' ' 129' ' ' LEU . 0.5 OUTLIER -118.67 67.14 7.43 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 125.084 1.353 . . . . 0.0 113.027 -179.02 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -79.47 60.92 8.01 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 123.342 2.694 . . . . 0.0 108.459 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -142.46 -68.41 0.36 Allowed 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 t60 -48.63 -57.78 5.73 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.561 1.145 . . . . 0.0 112.992 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.74 -49.12 78.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.331 1.452 . . . . 0.0 111.813 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.6 mm -60.68 -43.51 95.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 124.924 1.289 . . . . 0.0 109.699 -178.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.62 -53.16 61.44 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 125.524 1.53 . . . . 0.0 108.407 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.6 m -63.3 -34.67 78.2 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.085 -0.96 . . . . 0.0 110.96 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -61.53 -49.16 77.81 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 120.618 1.554 . . . . 0.0 107.942 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.61 -45.86 92.28 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.238 1.015 . . . . 0.0 109.093 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -60.34 -44.8 95.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.543 1.537 . . . . 0.0 111.93 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.24 -45.89 91.29 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 125.076 1.351 . . . . 0.0 110.528 -179.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -60.05 -50.95 71.7 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.05 -0.66 . . . . 0.0 110.635 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -65.52 -35.27 80.36 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 118.505 -0.759 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -52.03 -40.05 60.49 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-N 119.293 0.951 . . . . 0.0 111.022 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -52.81 -47.04 67.92 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.425 0.557 . . . . 0.0 109.88 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -75.11 -37.01 61.61 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 178.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -58.68 -36.61 74.45 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.339 -0.838 . . . . 0.0 111.247 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -61.04 -34.67 75.22 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.084 0.857 . . . . 0.0 110.598 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.8 tp -68.18 -29.59 68.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.134 0.574 . . . . 0.0 110.301 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.74 16.54 25.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.542 1.937 . . . . 0.0 110.881 179.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -59.84 149.21 32.0 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.118 -0.989 . . . . 0.0 110.954 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -131.01 176.38 8.3 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.719 1.208 . . . . 0.0 109.375 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -74.74 -173.23 1.78 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.479 1.112 . . . . 0.0 108.091 178.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.5 t -66.11 174.36 2.59 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 122.486 1.136 . . . . 0.0 111.528 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.1 t -93.27 -165.49 1.34 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.71 2.404 . . . . 0.0 107.204 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 tt -79.03 14.67 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.059 0 C-N-CA 124.538 1.135 . . . . 0.0 109.926 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 -102.49 119.9 39.61 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 127.034 2.133 . . . . 0.0 106.837 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.0 p . . . . . 0 C--O 1.258 1.509 0 CA-C-O 114.461 -2.685 . . . . 0.0 107.228 178.613 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.945 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 32.0 m -61.79 -33.82 74.8 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 117.767 0.784 . . . . 0.0 111.478 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 49.91 56.32 8.07 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.126 1.77 . . . . 0.0 111.634 178.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -67.34 -26.61 66.58 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -178.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.17 145.78 47.84 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.9 161.85 36.95 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -113.16 131.08 55.99 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -107.22 159.74 16.12 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.016 0.926 . . . . 0.0 112.574 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 mp -143.65 156.17 44.48 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 126.004 1.722 . . . . 0.0 106.97 178.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 100.85 2.86 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.452 1.901 . . . . 0.0 106.574 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.584 HG21 ' HD2' ' D' 1116 ' ' LYS . 3.6 m -149.22 151.55 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -178.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 22.9 ptt85 -118.52 101.7 8.34 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 122.68 1.228 . . . . 0.0 109.066 177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.13 106.59 0.42 Allowed Glycine 0 N--CA 1.451 -0.366 1 N-CA-C 102.924 -4.07 . . . . 0.0 102.924 176.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -60.26 -56.69 18.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.099 2.949 . . . . 0.0 111.353 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -62.93 -39.9 95.98 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -61.99 -52.38 64.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.019 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -52.5 -51.39 59.73 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 120.206 1.366 . . . . 0.0 111.819 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -58.36 -53.49 57.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.671 0.668 . . . . 0.0 111.03 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 82.2 mt -61.3 -54.11 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 O-C-N 121.438 -0.789 . . . . 0.0 110.731 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 82.8 mt -54.97 -41.7 71.49 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.384 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 14.2 mtp -57.2 -51.26 70.05 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 120.928 1.695 . . . . 0.0 108.848 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.33 -52.33 66.1 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 122.611 0.365 . . . . 0.0 110.291 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 43.2 mt -58.6 -42.89 89.17 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 122.775 0.43 . . . . 0.0 111.12 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . 0.538 ' HD2' HG11 ' D' 1103 ' ' VAL . 25.5 ttpt -62.5 -57.43 11.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.6 1.16 . . . . 0.0 110.889 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -60.45 -41.17 93.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 118.649 0.658 . . . . 0.0 110.016 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 2.9 t -61.02 -42.24 98.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.986 -0.446 . . . . 0.0 109.874 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.26 -35.92 71.57 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-O 117.351 -1.309 . . . . 0.0 109.92 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -63.52 -40.01 95.91 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.252 1.387 . . . . 0.0 108.931 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 36.3 mt -66.89 -53.35 33.07 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 5.7 tpt -56.89 -34.66 68.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.041 0.936 . . . . 0.0 110.355 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -67.43 -41.73 84.32 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.485 1.514 . . . . 0.0 110.857 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.45 -33.03 64.68 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.529 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 20.3 m -86.79 148.7 46.52 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-N 119.521 1.055 . . . . 0.0 111.831 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -75.94 -106.1 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.05 2.5 . . . . 0.0 106.875 178.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.73 74.44 7.12 Favored Pre-proline 0 CA--C 1.542 0.638 0 O-C-N 119.71 -1.869 . . . . 0.0 111.431 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -81.12 -100.51 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 124.725 3.617 . . . . 0.0 111.539 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . 0.494 HD22 HD22 ' A' ' 32' ' ' LEU . 9.7 tt -56.11 -34.71 66.3 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 120.724 -1.235 . . . . 0.0 109.499 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 73.5 t -51.83 -54.44 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 126.114 1.765 . . . . 0.0 109.698 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.09 -49.52 77.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.036 0.934 . . . . 0.0 110.007 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 25.9 t -56.03 -50.54 70.64 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.363 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -67.01 -35.01 78.97 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.541 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 3.7 tmm_? -58.08 -48.53 79.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.643 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.75 -42.6 70.27 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.078 0.854 . . . . 0.0 111.763 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -57.17 -45.42 83.69 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 118.64 0.655 . . . . 0.0 111.233 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -77.32 -31.72 54.8 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.092 0.957 . . . . 0.0 110.773 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -57.72 -37.78 74.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 119.792 1.178 . . . . 0.0 109.188 178.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.8 -18.21 53.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.737 0.815 . . . . 0.0 112.237 179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 19.9 tp -78.0 -19.21 54.87 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.461 1.104 . . . . 0.0 111.141 179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.88 173.55 7.71 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 121.036 -1.04 . . . . 0.0 109.84 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.176 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 98.3 p . . . . . 0 N--CA 1.47 0.572 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -96.6 -4.01 41.9 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.722 1.209 . . . . 0.0 108.54 177.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 25.9 t0 -109.02 -22.21 12.26 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.347 1.459 . . . . 0.0 113.103 -178.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -85.02 138.43 32.45 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.307 0.958 . . . . 0.0 109.004 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 26.9 tp -78.22 108.29 11.43 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.99 165.04 11.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.288 0.949 . . . . 0.0 111.456 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -142.58 156.67 45.12 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.455 1.502 . . . . 0.0 108.17 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -135.0 105.79 10.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.393 -179.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -79.58 116.5 3.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.437 2.758 . . . . 0.0 110.941 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 3.8 t -145.03 147.13 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.593 1.088 . . . . 0.0 111.039 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -133.97 101.61 5.12 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.5 126.97 1.49 Allowed Glycine 0 CA--C 1.519 0.315 0 N-CA-C 105.447 -3.061 . . . . 0.0 105.447 177.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -65.68 -51.57 58.4 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 121.54 2.67 . . . . 0.0 108.791 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.22 -42.82 83.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.338 0.655 . . . . 0.0 109.758 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 8.0 m -55.78 -47.71 76.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.213 1.405 . . . . 0.0 108.785 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 51.0 t80 -69.32 -50.48 46.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.515 1.126 . . . . 0.0 111.068 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.68 -51.0 66.88 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.952 1.301 . . . . 0.0 112.761 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 2.4 ttm -65.6 -51.3 60.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.804 0.442 . . . . 0.0 110.147 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -41.54 95.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.253 -178.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.79 -38.25 79.84 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 120.502 1.501 . . . . 0.0 108.85 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -59.38 -42.14 90.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.164 0.893 . . . . 0.0 108.735 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . 0.478 HG23 HD22 ' D' 1115 ' ' LEU . 94.1 mt -72.66 -38.28 58.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.797 0.839 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -61.45 -54.43 43.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 O-C-N 121.071 -1.018 . . . . 0.0 109.492 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -53.08 60.86 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.132 1.373 . . . . 0.0 111.058 -178.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 35.7 p -55.24 -51.56 66.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.99 -41.58 82.06 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 118.774 -0.632 . . . . 0.0 112.439 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.33 -44.93 95.36 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.59 -48.86 65.62 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.665 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 7.7 tmm? -55.36 -44.64 76.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.587 0.63 . . . . 0.0 109.977 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -79.9 -19.9 47.1 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 118.122 -0.942 . . . . 0.0 113.43 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 72.1 t80 -86.3 -27.73 24.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.437 1.017 . . . . 0.0 110.169 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . . . . . . . . . 25.3 tp -135.62 61.26 42.03 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 125.548 1.539 . . . . 0.0 110.177 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.69 58.03 6.25 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.476 2.784 . . . . 0.0 107.707 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.36 -71.64 0.47 Allowed 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 127.984 2.514 . . . . 0.0 107.431 -178.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 71.2 t60 -52.7 -57.73 9.14 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.711 1.204 . . . . 0.0 113.884 -178.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -45.19 83.73 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.113 -0.992 . . . . 0.0 111.686 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 9.4 mm -64.13 -34.45 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 124.908 1.283 . . . . 0.0 110.037 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -69.77 -56.69 6.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 14.0 m -54.01 -40.87 67.38 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.571 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . . . . . . . . . 3.7 t80 -60.25 -54.41 46.11 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.69 1.586 . . . . 0.0 109.819 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -34.72 78.03 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.518 0.727 . . . . 0.0 111.908 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -72.29 -46.64 54.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.811 1.244 . . . . 0.0 109.841 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -60.01 -42.12 93.64 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.336 1.054 . . . . 0.0 110.937 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -67.31 -47.59 70.12 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.136 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -57.74 -40.83 80.6 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.124 0.57 . . . . 0.0 110.493 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -54.49 -32.58 58.21 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.036 0.934 . . . . 0.0 111.623 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -56.34 -53.36 58.25 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.291 0.951 . . . . 0.0 110.009 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 9.2 m170 -72.63 -26.6 61.73 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 119.079 -0.486 . . . . 0.0 109.871 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -65.92 -36.41 83.3 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.988 0.813 . . . . 0.0 109.987 179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 32.6 m170 -59.11 -32.64 70.01 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 119.044 0.838 . . . . 0.0 111.215 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 46.2 tp -67.66 -28.04 67.37 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.753 0.706 . . . . 0.0 109.935 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.25 16.09 27.19 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.478 2.311 . . . . 0.0 110.743 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -55.61 99.29 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.648 1.179 . . . . 0.0 112.952 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -80.33 171.6 14.85 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -76.26 -172.37 2.06 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 177.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 6.8 t -64.79 173.97 2.04 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 122.393 1.092 . . . . 0.0 112.136 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 22.9 t -93.95 -166.39 1.49 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.712 2.405 . . . . 0.0 107.582 179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 16.6 tt -77.4 4.31 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 C-N-CA 124.451 1.101 . . . . 0.0 110.362 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 15.3 mp0 -90.35 123.46 34.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.234 1.813 . . . . 0.0 107.62 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 24.2 p . . . . . 0 C--O 1.255 1.373 0 CA-C-O 114.68 -2.581 . . . . 0.0 107.126 178.518 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.538 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 20.1 m -128.37 -42.34 1.5 Allowed 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 123.508 0.723 . . . . 0.0 111.363 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 41.0 m-20 49.91 60.0 4.12 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.685 1.594 . . . . 0.0 108.107 -179.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -64.01 -27.66 69.27 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 113.29 -1.777 . . . . 0.0 108.668 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -68.85 116.99 9.96 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 125.261 1.424 . . . . 0.0 107.41 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.89 163.61 16.29 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.977 0.911 . . . . 0.0 110.914 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -101.58 128.45 47.83 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.903 -2.629 . . . . 0.0 103.903 178.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -103.59 145.04 30.63 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.984 1.314 . . . . 0.0 108.874 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 5.6 mp -140.1 151.39 45.31 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -139.95 111.1 6.99 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.712 1.605 . . . . 0.0 108.861 179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . 0.538 HG11 ' HD2' ' B' ' 116' ' ' LYS . 0.0 OUTLIER -155.82 150.86 10.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 124.485 1.114 . . . . 0.0 111.805 179.394 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 10.3 ptt85 -124.53 99.73 6.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 122.093 0.949 . . . . 0.0 108.501 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.43 119.76 1.4 Allowed Glycine 0 CA--C 1.509 -0.318 0 N-CA-C 105.932 -2.867 . . . . 0.0 105.932 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -63.52 -56.91 12.29 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 121.533 2.666 . . . . 0.0 108.426 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 25.2 mtpt -69.36 -38.29 78.0 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.155 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -58.63 -52.57 65.1 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.709 -178.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.39 -41.86 98.97 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.149 -0.969 . . . . 0.0 111.832 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -60.66 -53.94 51.33 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.507 0.723 . . . . 0.0 111.555 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 55.1 mt -70.32 -45.92 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 118.459 -0.782 . . . . 0.0 109.679 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.66 -44.71 81.62 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 119.576 1.08 . . . . 0.0 110.363 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 27.1 mtp -60.53 -45.98 91.83 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.008 1.276 . . . . 0.0 109.736 178.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -56.63 -49.63 74.41 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . 0.478 HD22 HG23 ' C' 1022 ' ' ILE . 34.1 mt -60.17 -48.46 81.63 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.58 0.752 . . . . 0.0 111.243 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . 0.584 ' HD2' HG21 ' B' ' 103' ' ' VAL . 24.3 ttpt -54.62 -59.62 4.46 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.03 1.332 . . . . 0.0 110.653 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.54 -47.97 75.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.008 0.923 . . . . 0.0 110.07 -179.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 34.4 t -53.35 -53.22 54.21 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 124.005 0.922 . . . . 0.0 111.119 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.82 -30.94 66.02 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 117.614 -1.184 . . . . 0.0 111.89 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -62.41 -41.65 98.84 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.969 1.713 . . . . 0.0 108.384 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . . . . . . . . . 35.8 mt -67.95 -47.04 69.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 4.6 tpt -57.01 -35.84 69.72 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.377 0.671 . . . . 0.0 111.639 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.23 -43.08 74.77 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.872 1.669 . . . . 0.0 110.438 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.33 -25.32 60.58 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 33.5 m -92.65 148.85 36.97 Favored Pre-proline 0 CA--C 1.537 0.474 0 CA-C-N 119.226 0.921 . . . . 0.0 108.992 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -74.13 -105.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.059 2.506 . . . . 0.0 108.041 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -151.07 66.04 7.05 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 120.239 -1.538 . . . . 0.0 106.946 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.22 -103.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.427 2.751 . . . . 0.0 113.064 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . . . . . . . . . 4.3 tt -62.52 -25.73 68.18 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.96 -1.088 . . . . 0.0 109.438 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 45.8 t -53.86 -56.96 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 C-N-CA 125.69 1.596 . . . . 0.0 109.192 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.22 -39.12 86.23 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.08 0.237 . . . . 0.0 111.08 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 1.9 t -60.12 -50.9 71.87 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.609 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 39.5 t80 -67.23 -33.09 74.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.097 0.959 . . . . 0.0 109.345 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -48.5 80.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 117.089 -1.434 . . . . 0.0 110.009 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -72.13 -46.42 56.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 120.052 1.296 . . . . 0.0 110.918 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.93 -46.54 64.72 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.497 0.719 . . . . 0.0 110.324 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . 0.295 1.7 tp60 -81.08 -26.03 36.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -59.46 -36.2 75.51 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 120.403 1.456 . . . . 0.0 107.183 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 31.0 mt -61.97 -18.08 59.17 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.103 0.961 . . . . 0.0 112.243 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 8.3 tp -68.09 -25.89 65.55 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.239 1.415 . . . . 0.0 111.635 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.38 172.6 9.01 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.721 1.608 . . . . 0.0 110.532 -179.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.331 0 CA-C-O 118.216 -0.897 . . . . 0.0 109.221 -179.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.467 0.39 0 CA-C-O 120.893 0.378 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.0 -38.73 89.22 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 129.083 2.953 . . . . 0.0 111.061 -178.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -93.09 1.11 57.36 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 125.813 1.645 . . . . 0.0 112.863 -179.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -81.47 146.64 30.12 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.871 1.268 . . . . 0.0 111.233 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 42.7 tp -84.74 121.52 27.8 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 104.552 -2.388 . . . . 0.0 104.552 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 45.2 mt -108.15 161.94 14.52 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -140.5 104.89 4.85 Favored 'General case' 0 CA--C 1.522 -0.129 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 tp -87.87 110.22 33.42 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.362 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -87.04 123.26 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.424 3.416 . . . . 0.0 112.045 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 t -146.1 154.81 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 O-C-N 120.546 -1.346 . . . . 0.0 107.682 178.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 -135.08 100.67 4.63 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.69 134.72 3.37 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 106.674 -2.571 . . . . 0.0 106.674 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -69.87 -52.76 22.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 121.397 2.599 . . . . 0.0 110.595 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -66.43 -42.94 86.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.598 0.759 . . . . 0.0 110.004 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 62.8 m -65.32 -34.04 77.39 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.213 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -73.07 -48.35 36.67 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 120.96 1.709 . . . . 0.0 108.774 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -53.43 -56.08 19.78 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 123.936 0.894 . . . . 0.0 110.553 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 20.9 ptm -60.85 -42.68 98.28 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.617 -0.706 . . . . 0.0 111.127 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.07 -47.01 81.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 119.989 1.268 . . . . 0.0 111.755 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -55.84 19.81 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.538 0.608 . . . . 0.0 110.278 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -56.68 -47.7 79.27 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 125.614 1.566 . . . . 0.0 112.828 -178.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.42 -36.18 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.333 0.653 . . . . 0.0 109.89 -179.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.7 -48.89 65.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.17 -1.581 . . . . 0.0 108.197 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -55.22 -52.03 64.68 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.426 1.49 . . . . 0.0 110.327 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.2 p -56.72 -41.53 77.63 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.7 0.682 . . . . 0.0 111.572 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.1 -48.72 61.82 Favored 'General case' 0 CA--C 1.521 -0.163 0 O-C-N 121.412 -0.805 . . . . 0.0 111.432 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.39 -53.98 51.08 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 126.762 2.025 . . . . 0.0 111.928 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.53 -38.72 90.47 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 117.303 -1.332 . . . . 0.0 110.184 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 10.8 tmm? -63.44 -45.17 92.13 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.034 1.288 . . . . 0.0 107.792 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -64.89 -22.41 66.99 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.59 0.632 . . . . 0.0 110.508 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.82 -25.7 22.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.478 -1.389 . . . . 0.0 111.132 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.3 mt -131.89 63.33 68.5 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 126.926 2.09 . . . . 0.0 107.722 -179.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -73.51 7.13 2.38 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 123.281 2.654 . . . . 0.0 114.561 -178.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -112.9 -56.31 2.43 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 119.518 1.054 . . . . 0.0 110.081 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -48.24 -52.63 20.25 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -178.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.43 -48.46 77.67 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.815 -0.553 . . . . 0.0 111.768 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.2 mm -62.52 -34.43 64.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.732 0.813 . . . . 0.0 111.203 -179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -61.72 -56.73 16.56 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.583 1.553 . . . . 0.0 108.472 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.7 m -61.35 -42.26 98.39 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' B' ' 121' ' ' LEU . 2.4 t80 -56.69 -53.42 57.94 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.438 0.695 . . . . 0.0 111.982 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -65.17 -39.62 93.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 118.762 -0.637 . . . . 0.0 110.821 -178.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.26 -49.26 78.33 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.34 -48.79 79.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.2 1.8 . . . . 0.0 110.559 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.16 -46.06 79.42 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 123.898 0.879 . . . . 0.0 110.148 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 tt0 -69.18 -42.64 75.58 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.021 1.328 . . . . 0.0 111.114 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -56.34 -52.1 65.79 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 125.69 1.596 . . . . 0.0 108.864 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -54.54 -49.32 70.56 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.485 0.714 . . . . 0.0 109.59 179.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -64.41 -28.19 69.52 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.192 0.905 . . . . 0.0 112.305 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -71.72 -59.6 2.67 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.085 -1.009 . . . . 0.0 108.98 178.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -58.42 -20.32 43.66 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.663 1.185 . . . . 0.0 112.715 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 54.6 tp -61.33 -30.06 70.27 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.729 1.611 . . . . 0.0 111.047 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.7 tp -92.23 -69.92 0.72 Allowed 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.45 0.568 . . . . 0.0 109.664 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -162.46 167.45 23.53 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.851 1.661 . . . . 0.0 107.042 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.9 ttpt 70.7 114.74 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 127.712 2.405 . . . . 0.0 110.412 -179.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -119.52 167.76 11.66 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 107.281 -1.378 . . . . 0.0 107.281 179.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.6 m -131.43 -64.81 0.79 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m 46.37 39.08 5.95 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.4 tt -61.01 141.48 17.3 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 O-C-N 121.635 -0.666 . . . . 0.0 109.619 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -129.55 158.27 39.73 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.432 1.893 . . . . 0.0 107.914 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.257 1.482 0 C-N-CA 126.512 1.925 . . . . 0.0 107.628 179.889 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.256 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 8.0 t -156.39 -178.78 7.58 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -137.34 73.94 1.46 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 102.741 -3.059 . . . . 0.0 102.741 178.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -127.38 -14.37 5.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -178.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -88.16 156.07 19.44 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 119.687 1.131 . . . . 0.0 110.397 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m -84.67 152.07 24.03 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -109.45 143.79 38.57 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -117.48 161.64 19.25 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.175 1.39 . . . . 0.0 110.23 -177.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' B' ' 101' ' ' LEU . 12.0 tp -161.22 117.32 2.18 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -119.16 103.17 9.29 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.214 1.406 . . . . 0.0 109.367 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.485 HG11 ' HE2' ' D' 1116 ' ' LYS . 93.4 t -150.03 150.62 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.29 1.036 . . . . 0.0 110.318 -179.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -108.44 102.67 11.75 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.806 1.242 . . . . 0.0 108.673 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -144.5 122.16 1.72 Allowed Glycine 0 N--CA 1.467 0.723 0 CA-C-O 115.802 -2.665 . . . . 0.0 109.067 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -68.03 -59.62 3.12 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 122.504 3.152 . . . . 0.0 113.387 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -73.24 -43.86 60.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -51.39 -51.0 58.52 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.799 1.639 . . . . 0.0 110.471 -178.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -72.11 -39.77 68.63 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 119.764 1.165 . . . . 0.0 111.411 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.53 -53.48 50.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.871 0.843 . . . . 0.0 109.544 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.488 HG21 HD11 ' C' 1022 ' ' ILE . 12.5 mt -61.6 -48.27 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.752 1.621 . . . . 0.0 109.427 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -57.49 -41.04 79.94 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 117.983 -1.008 . . . . 0.0 111.311 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' MET . . . . . . . . . . . . . 20.2 mtp -66.25 -44.73 82.86 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.357 1.435 . . . . 0.0 110.179 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -55.63 -45.98 77.5 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 73.3 mt -72.59 -27.39 62.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.032 1.333 . . . . 0.0 112.84 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' LYS . . . . . 0.417 ' HE2' HG11 ' D' 1103 ' ' VAL . 0.0 OUTLIER -64.13 -60.68 2.92 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.46 1.104 . . . . 0.0 109.032 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -63.09 -38.14 90.01 Favored 'General case' 0 C--O 1.223 -0.316 0 O-C-N 124.403 1.065 . . . . 0.0 108.755 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 41.9 t -52.78 -54.25 36.64 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.922 0.783 . . . . 0.0 112.219 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.15 -33.09 72.88 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 118.273 -0.87 . . . . 0.0 111.036 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.7 -43.08 97.68 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 120.02 1.282 . . . . 0.0 109.601 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 40' ' ' TYR . 80.8 mt -65.26 -50.22 66.63 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.742 1.217 . . . . 0.0 109.566 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 10.4 tpt -62.77 -29.94 71.08 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.668 0.387 . . . . 0.0 110.936 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -76.13 -41.7 49.21 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.637 0.775 . . . . 0.0 110.714 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 pp -78.12 -33.47 50.53 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 1.2 t -86.74 146.63 41.66 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 119.298 0.954 . . . . 0.0 109.208 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.31 -172.74 0.37 Allowed 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.2 2.6 . . . . 0.0 109.575 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -107.64 62.51 0.22 Allowed Pre-proline 0 CA--C 1.548 0.876 0 O-C-N 120.288 -1.507 . . . . 0.0 113.519 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.37 -87.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.757 2.304 . . . . 0.0 112.792 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.3 -39.48 83.14 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 121.486 -0.759 . . . . 0.0 110.239 -178.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.9 m -56.05 -48.02 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 117.051 -1.452 . . . . 0.0 111.716 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -75.39 -32.22 60.71 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 120.869 1.668 . . . . 0.0 111.795 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 7.6 t -65.41 -46.89 78.21 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -69.35 -39.39 78.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.168 0.987 . . . . 0.0 109.459 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.02 -48.68 77.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 119.24 0.927 . . . . 0.0 110.122 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -68.85 -46.53 68.26 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -57.89 -44.17 86.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.393 0.542 . . . . 0.0 111.404 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -72.99 -33.61 65.91 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.864 1.666 . . . . 0.0 110.626 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -61.8 -37.24 83.65 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 119.524 1.056 . . . . 0.0 110.08 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . . . . . . . . . 84.3 mt -59.79 -24.21 63.92 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 122.675 0.39 . . . . 0.0 110.474 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 11.8 tp -70.85 -12.96 61.85 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.623 1.169 . . . . 0.0 110.959 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -141.1 81.28 1.78 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.432 1.493 . . . . 0.0 109.424 179.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? . . . . . 0 C--O 1.247 0.959 0 C-N-CA 127.975 2.51 . . . . 0.0 108.423 -179.554 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C 1001 ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 119.562 -0.256 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C 1002 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.05 -43.15 77.59 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 126.916 2.087 . . . . 0.0 113.368 -178.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1003 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.26 1.31 56.63 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.619 1.567 . . . . 0.0 113.093 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1004 ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -79.05 138.65 38.09 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.721 0.808 . . . . 0.0 112.535 -178.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 58.1 tp -73.39 112.84 9.83 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 177.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1006 ' ' LEU . . . . . . . . . . . . . 11.3 mt -107.43 162.18 14.16 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.067 1.347 . . . . 0.0 108.783 -179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1007 ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -137.71 144.35 41.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.202 1.001 . . . . 0.0 108.544 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1008 ' ' LEU . . . . . . . . . . . . . 13.8 tp -118.57 96.25 49.73 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1009 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -77.79 115.27 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 123.298 2.665 . . . . 0.0 109.452 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1010 ' ' VAL . . . . . . . . . . . . . 6.7 t -143.51 153.14 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 123.677 0.791 . . . . 0.0 110.462 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1011 ' ' ARG . . . . . . . . . . . . . 41.5 ttt-85 -132.93 101.79 5.38 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 103.92 -2.622 . . . . 0.0 103.92 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1012 ' ' GLY . . . . . . . . . . . . . . . -167.66 121.94 1.0 Allowed Glycine 0 CA--C 1.516 0.155 0 N-CA-C 105.479 -3.048 . . . . 0.0 105.479 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1013 ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -66.43 -52.32 47.71 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 121.913 2.856 . . . . 0.0 109.801 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1014 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.37 -47.76 75.29 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 1.5 m -55.26 -41.47 72.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 118.826 -0.607 . . . . 0.0 111.343 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1016 ' ' TYR . . . . . . . . . . . . . 29.8 t80 -73.9 -50.0 22.22 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.799 1.181 . . . . 0.0 111.095 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -54.47 -50.71 67.1 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.87 0.759 . . . . 0.0 110.707 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1018 ' ' MET . . . . . . . . . . . . . 25.7 ptm -65.52 -43.06 91.22 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.433 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1019 ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.66 -42.08 99.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 120.014 1.279 . . . . 0.0 109.804 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1020 ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.48 -56.46 21.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1021 ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -56.74 -48.8 76.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.247 0.619 . . . . 0.0 112.5 -178.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1022 ' ' ILE . . . . . 0.488 HD11 HG21 ' B' ' 111' ' ' ILE . 97.9 mt -67.36 -36.32 76.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.362 1.065 . . . . 0.0 112.143 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1023 ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -48.8 46.33 Favored 'General case' 0 CA--C 1.512 -0.498 0 O-C-N 120.44 -1.412 . . . . 0.0 108.267 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1024 ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.14 -41.94 97.65 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.727 0.811 . . . . 0.0 109.298 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1025 ' ' SER . . . . . . . . . . . . . 95.4 p -59.97 -46.38 89.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.495 1.043 . . . . 0.0 110.818 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1026 ' ' LEU . . . . . . . . . . . . . 8.1 tt -67.89 -51.07 52.29 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.745 0.818 . . . . 0.0 111.647 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1027 ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -59.91 -53.73 54.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 124.009 0.924 . . . . 0.0 111.513 -178.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1028 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -65.72 -31.65 72.77 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 119.112 0.869 . . . . 0.0 111.581 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1029 ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -69.01 -45.57 70.19 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 178.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1030 ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -65.34 -29.85 70.63 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.611 -0.68 . . . . 0.0 110.222 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1031 ' ' TYR . . . . . . . . . . . . . 3.9 t80 -80.28 -31.87 38.24 Favored 'General case' 0 C--N 1.339 0.116 0 C-N-CA 124.193 0.997 . . . . 0.0 111.267 179.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1032 ' ' LEU . . . . . 0.554 HD11 HD22 ' D' 1129 ' ' LEU . 15.6 mt -129.7 68.95 81.24 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 124.999 1.32 . . . . 0.0 110.812 -178.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1033 ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -78.39 2.77 7.76 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 123.45 2.766 . . . . 0.0 115.181 -178.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1034 ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -98.72 -46.47 5.67 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 120.626 1.557 . . . . 0.0 110.876 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1035 ' ' HIS . . . . . . . . . . . . . 77.8 m80 -62.69 -58.66 6.72 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -177.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1036 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.87 -51.6 66.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.882 0.765 . . . . 0.0 111.573 -178.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1037 ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.48 -37.75 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 124.254 1.021 . . . . 0.0 112.35 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1038 ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -69.21 -53.84 17.86 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.285 0.948 . . . . 0.0 109.076 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1039 ' ' THR . . . . . . . . . . . . . 22.2 m -52.61 -43.69 65.53 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.447 0.567 . . . . 0.0 110.425 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1040 ' ' TYR . . . . . 0.406 ' CD2' HD21 ' D' 1121 ' ' LEU . 3.5 t80 -61.68 -54.27 44.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.306 1.442 . . . . 0.0 111.049 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1041 ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -62.74 -33.46 75.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.959 0.345 . . . . 0.0 110.487 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1042 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -65.3 -44.93 86.35 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1043 ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -59.14 -48.72 80.59 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 119.78 1.173 . . . . 0.0 109.535 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1044 ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -53.81 -51.61 62.98 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.386 0.674 . . . . 0.0 111.16 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1045 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.84 -41.64 82.63 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.061 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1046 ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.33 -40.81 96.64 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.1 0.864 . . . . 0.0 109.307 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1047 ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -59.91 -47.29 86.39 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1048 ' ' HIS . . . . . . . . . . . . . 2.2 m80 -59.98 -42.46 94.24 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.472 0.709 . . . . 0.0 110.111 178.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1049 ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -62.29 -53.18 58.84 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.067 0.947 . . . . 0.0 110.427 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1050 ' ' HIS . . . . . . . . . . . . . 49.3 m170 -65.21 -24.67 67.42 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.41 1.084 . . . . 0.0 111.012 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1051 ' ' LEU . . . . . . . . . . . . . 40.9 tp -63.18 -28.95 70.4 Favored 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.064 -1.022 . . . . 0.0 109.484 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1052 ' ' LEU . . . . . . . . . . . . . 49.1 tp -82.34 -65.43 1.01 Allowed 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 106.681 -1.6 . . . . 0.0 106.681 177.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1053 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.08 171.67 10.8 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.197 0.999 . . . . 0.0 109.642 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C 1054 ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? 59.85 87.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.178 1.791 . . . . 0.0 112.503 178.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1055 ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -82.14 99.67 9.37 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1056 ' ' THR . . . . . . . . . . . . . 2.5 m -65.8 -30.58 71.24 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1057 ' ' SER . . . . . . . . . . . . . 28.1 m 0.33 76.28 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 129.918 3.287 . . . . 0.0 117.68 -179.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1058 ' ' ILE . . . . . . . . . . . . . 18.8 tt -79.93 154.26 4.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1059 ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -136.06 159.42 41.76 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.498 1.119 . . . . 0.0 110.033 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C 1060 ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.247 0.959 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1093 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.348 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D 1094 ' ' SER . . . . . . . . . . . . . 39.1 t -152.92 175.06 13.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1095 ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.99 48.46 2.34 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 127.747 2.419 . . . . 0.0 107.7 178.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D 1096 ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -79.57 -30.61 41.69 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.454 -0.779 . . . . 0.0 109.151 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1097 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.32 131.48 51.12 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 128.288 2.635 . . . . 0.0 112.566 -178.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D 1098 ' ' THR . . . . . . . . . . . . . 1.3 m -83.17 146.4 28.65 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1099 ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -102.64 145.42 29.68 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.918 -1.114 . . . . 0.0 108.894 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1100 ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -124.58 143.64 50.59 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 125.274 1.43 . . . . 0.0 107.324 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1101 ' ' LEU . . . . . . . . . . . . . 9.4 tp -144.9 142.26 29.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 118.327 -0.844 . . . . 0.0 108.928 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1102 ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -139.51 107.97 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.031 1.332 . . . . 0.0 109.138 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1103 ' ' VAL . . . . . 0.417 HG11 ' HE2' ' B' ' 116' ' ' LYS . 82.7 t -149.81 147.12 16.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 119.001 0.818 . . . . 0.0 109.095 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D 1104 ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -102.19 103.61 14.14 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.775 0.83 . . . . 0.0 111.598 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1105 ' ' GLY . . . . . . . . . . . . . . . -143.82 117.34 1.06 Allowed Glycine 0 N--CA 1.464 0.52 0 CA-C-O 115.994 -2.559 . . . . 0.0 108.125 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1106 ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -67.48 -57.07 7.19 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 122.827 3.314 . . . . 0.0 111.452 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1107 ' ' LYS . . . . . . . . . . . . . 30.7 mttp -68.44 -44.8 74.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1108 ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -51.76 -50.88 59.8 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.025 1.33 . . . . 0.0 110.265 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1109 ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.68 -45.91 77.36 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.88 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1110 ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -58.42 -48.37 80.91 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.881 1.219 . . . . 0.0 109.931 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1111 ' ' ILE . . . . . . . . . . . . . 65.7 mt -56.34 -53.95 33.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 C-N-CA 124.858 1.263 . . . . 0.0 108.658 179.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1112 ' ' LEU . . . . . . . . . . . . . 37.5 mt -58.85 -39.44 81.32 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.927 -179.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1113 ' ' MET . . . . . . . . . . . . . 10.6 mtp -65.21 -49.54 69.31 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 120.607 1.548 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1114 ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -53.8 -46.6 71.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.88 0.848 . . . . 0.0 109.433 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1115 ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.8 -27.2 61.01 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.404 0.682 . . . . 0.0 112.215 -179.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1116 ' ' LYS . . . . . 0.485 ' HE2' HG11 ' B' ' 103' ' ' VAL . 0.1 OUTLIER -63.04 -60.01 4.03 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.555 1.07 . . . . 0.0 109.696 -179.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' D' D 1117 ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.12 -42.74 99.08 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1118 ' ' SER . . . . . . . . . . . . . 31.1 t -52.76 -52.36 56.88 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.69 0.677 . . . . 0.0 112.55 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1119 ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.21 -35.46 76.23 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.665 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1120 ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -64.37 -48.39 75.65 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.013 1.279 . . . . 0.0 109.183 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1121 ' ' LEU . . . . . 0.406 HD21 ' CD2' ' C' 1040 ' ' TYR . 59.3 mt -58.16 -52.34 65.95 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.078 1.351 . . . . 0.0 111.548 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D 1122 ' ' MET . . . . . . . . . . . . . 9.9 tpt -64.16 -26.34 68.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.146 0.979 . . . . 0.0 111.392 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1123 ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.86 -40.47 28.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.179 0.9 . . . . 0.0 109.85 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1124 ' ' LEU . . . . . . . . . . . . 0.32 2.0 pp -73.71 -32.42 63.89 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D 1125 ' ' VAL . . . . . . . . . . . . . 1.2 t -94.31 148.39 34.97 Favored Pre-proline 0 CA--C 1.537 0.455 0 CA-C-N 119.068 0.849 . . . . 0.0 108.81 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1126 ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -67.17 -164.21 0.09 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 123.715 2.944 . . . . 0.0 110.747 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1127 ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -116.14 66.2 3.0 Favored Pre-proline 0 CA--C 1.547 0.851 0 O-C-N 120.183 -1.573 . . . . 0.0 113.737 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1128 ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -79.96 -85.62 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 121.813 1.675 . . . . 0.0 112.662 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1129 ' ' LEU . . . . . 0.554 HD22 HD11 ' C' 1032 ' ' LEU . 7.9 tt -64.86 -38.12 89.93 Favored 'General case' 0 C--N 1.347 0.497 0 O-C-N 121.095 -1.003 . . . . 0.0 109.721 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D 1130 ' ' VAL . . . . . . . . . . . . . 3.5 m -54.71 -36.06 35.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.542 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1131 ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.39 -41.95 38.22 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 119.06 0.845 . . . . 0.0 109.433 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1132 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.95 -47.64 82.33 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D 1133 ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.08 -51.38 68.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.985 0.914 . . . . 0.0 108.561 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1134 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -43.55 67.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 123.651 0.78 . . . . 0.0 110.447 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D 1135 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -62.84 -54.06 44.69 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 118.493 0.588 . . . . 0.0 110.031 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1136 ' ' GLN . . . . . . . . . . . . . 10.0 tp60 -59.63 -37.28 78.2 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1137 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -40.82 43.94 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.082 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' D' D 1138 ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -58.91 -39.49 81.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.344 1.429 . . . . 0.0 107.397 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1139 ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.03 -15.23 55.77 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.187 -0.946 . . . . 0.0 112.75 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1140 ' ' LEU . . . . . . . . . . . . . 15.5 tp -83.52 -19.59 35.43 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.094 1.358 . . . . 0.0 110.855 179.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1141 ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -140.2 96.81 3.11 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.637 1.575 . . . . 0.0 107.962 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D 1142 ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? . . . . . 0 C--O 1.256 1.395 0 CA-C-O 114.888 -2.482 . . . . 0.0 104.405 -177.961 . . . . . . . . 0 0 . 1 stop_ save_