data_5kzo_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 5kzo _Structure_validation_residue.Date_analyzed 2017-05-05 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 full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 123.338 1.542 . . . . 0.0 112.245 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -82.71 137.08 34.55 Favored 'General case' 0 C--N 1.386 2.156 0 C-N-CA 126.681 1.993 . . . . 0.0 109.885 -162.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 52.9 p -53.11 -13.12 0.43 Allowed 'General case' 0 N--CA 1.523 3.216 0 O-C-N 118.163 -2.836 . . . . 0.0 117.861 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.99 -16.76 57.86 Favored 'General case' 0 C--N 1.391 2.39 0 O-C-N 116.57 -3.831 . . . . 0.0 113.891 175.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.417 5.1 t -133.9 -5.9 2.77 Favored 'General case' 0 C--O 1.274 2.372 0 C-N-CA 127.025 2.13 . . . . 0.0 112.252 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.06 -17.45 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.999 0 CA-C-N 121.973 2.169 . . . . 0.0 116.261 169.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -132.83 146.62 62.1 Favored Pre-proline 0 CA--C 1.609 3.228 0 CA-C-N 124.028 3.104 . . . . 0.0 111.714 167.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -87.78 149.19 7.23 Favored 'Trans proline' 0 N--CA 1.437 -1.798 0 CA-C-O 122.862 1.109 . . . . 0.0 114.683 152.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -59.53 165.85 8.86 Favored 'Trans proline' 0 CA--C 1.585 3.05 0 C-N-CA 125.299 4.0 . . . . 0.0 112.48 161.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -73.31 160.68 44.45 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 116.869 -1.621 . . . . 0.0 110.36 -171.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -62.13 110.57 1.04 Allowed 'Trans proline' 0 C--O 1.281 2.663 0 C-N-CA 122.164 1.91 . . . . 0.0 109.369 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . 0.326 . . -68.72 -7.39 33.17 Favored 'General case' 0 CA--C 1.584 2.261 1 O-C-N 114.515 -5.116 . . . . 0.0 111.567 172.542 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -63.43 -42.1 98.68 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-N 119.448 1.022 . . . . 0.0 112.798 165.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 8.2 mp -89.67 -52.45 5.0 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 -172.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.27 -43.93 79.27 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 117.797 2.517 . . . . 0.0 117.797 -176.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . 0.263 21.1 t80 -78.95 -35.49 43.16 Favored 'General case' 0 C--O 1.271 2.224 0 N-CA-C 104.594 -2.373 . . . . 0.0 104.594 -177.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 20.6 ttp -67.66 -29.21 68.44 Favored 'General case' 0 C--N 1.385 2.124 0 CA-C-N 120.642 1.565 . . . . 0.0 112.797 174.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.349 9.0 m-85 -56.62 -46.1 81.12 Favored 'General case' 0 N--CA 1.407 -2.593 0 CA-C-O 116.241 -1.838 . . . . 0.0 112.776 170.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 4.5 t -63.48 -41.11 91.53 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.66 0 CA-C-O 124.14 1.924 . . . . 0.0 112.927 176.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -63.23 -55.12 27.56 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 118.289 -2.757 . . . . 0.0 112.575 175.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -69.99 -48.12 59.46 Favored 'General case' 0 N--CA 1.413 -2.291 1 O-C-N 113.93 -5.482 . . . . 0.0 109.215 -174.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -51.76 -46.19 64.02 Favored 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 120.034 -1.666 . . . . 0.0 112.295 169.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -70.33 -32.77 70.64 Favored 'General case' 0 C--N 1.363 1.192 0 C-N-CA 116.263 -2.175 . . . . 0.0 110.184 -176.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 69.5 t80 -72.79 -40.56 65.79 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-O 124.281 1.991 . . . . 0.0 112.021 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 94.4 t -73.6 -40.5 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.732 0 CA-C-O 115.936 -1.983 . . . . 0.0 107.79 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 61.2 tp -63.01 -50.7 69.66 Favored 'General case' 0 N--CA 1.522 3.131 1 O-C-N 129.419 4.199 . . . . 0.0 106.17 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 13.6 tp -68.19 -35.0 77.32 Favored 'General case' 0 CA--C 1.573 1.857 0 C-N-CA 127.051 2.14 . . . . 0.0 108.212 -165.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.434 74.3 t80 -65.19 -52.57 54.03 Favored 'General case' 0 C--O 1.182 -2.448 0 CA-C-O 115.767 -2.064 . . . . 0.0 115.032 161.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . . 3.8 t80 -69.12 -22.51 63.96 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 115.59 -2.444 . . . . 0.0 115.489 -175.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 53.7 t -89.31 -44.48 15.24 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 O-C-N 116.484 -3.885 . . . . 0.0 109.393 176.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -64.22 -44.05 96.15 Favored Glycine 0 CA--C 1.57 3.521 0 CA-C-O 127.272 3.706 . . . . 0.0 112.004 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 9.1 t -71.77 -40.2 69.46 Favored 'General case' 0 CA--C 1.563 1.459 0 O-C-N 118.376 -2.838 . . . . 0.0 107.551 172.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -69.37 -26.45 74.56 Favored Glycine 0 C--O 1.216 -1.031 0 CA-C-O 122.517 1.065 . . . . 0.0 112.024 -171.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . 0.371 4.5 p -72.42 -48.81 45.95 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.843 0 O-C-N 120.155 -1.791 . . . . 0.0 108.802 -173.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 3.1 pp -76.11 -41.46 50.13 Favored 'General case' 0 CA--C 1.494 -1.188 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.697 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 16.4 mt -60.61 -20.16 59.87 Favored 'General case' 0 CA--C 1.501 -0.925 0 O-C-N 119.969 -1.707 . . . . 0.0 113.91 175.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 71.4 m -68.26 -11.3 59.17 Favored 'General case' 0 C--O 1.258 1.521 0 N-CA-C 117.401 2.371 . . . . 0.0 117.401 175.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -77.83 -63.62 1.34 Allowed 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 170.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1759 ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' 1760 ' ' ARG 0.355 38.0 pttt -158.35 -102.47 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.581 0 C-N-CA 126.043 1.737 . . . . 0.0 109.765 171.844 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1760 ' ' ARG . . . . . 0.408 ' H ' ' HG3' ' A' 1759 ' ' LYS 0.263 11.7 tpp85 53.23 -51.44 0.01 OUTLIER 'General case' 0 C--O 1.189 -2.1 0 C-N-CA 131.219 3.808 . . . . 0.0 117.346 -177.208 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1761 ' ' ARG . . . . . . . . . . . . 0.256 0.0 OUTLIER -67.4 56.88 0.05 Allowed 'General case' 0 N--CA 1.521 3.076 0 C-N-CA 127.539 2.336 . . . . 0.0 115.614 -169.197 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -64.7 -42.66 95.12 Favored 'General case' 0 CA--C 1.571 1.761 0 O-C-N 119.284 -2.135 . . . . 0.0 114.424 170.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 6.4 tm0? 53.91 -156.42 0.2 Allowed 'General case' 0 N--CA 1.522 3.173 0 O-C-N 125.515 1.759 . . . . 0.0 108.303 -166.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.26 52.9 t-80 36.03 -93.99 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.022 0 CA-C-O 117.725 -1.131 . . . . 0.0 113.017 -176.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -67.95 18.44 0.36 Allowed Glycine 0 CA--C 1.557 2.677 0 CA-C-O 124.652 2.251 . . . . 0.0 115.638 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -150.7 5.15 0.51 Allowed 'General case' 0 C--N 1.301 -1.53 0 O-C-N 117.253 -3.498 . . . . 0.0 108.319 -175.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 23.2 tp -73.78 73.81 1.57 Allowed 'General case' 0 CA--C 1.568 1.671 0 C-N-CA 130.948 3.699 . . . . 0.0 114.319 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 25.6 t-105 72.69 -65.42 0.36 Allowed 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 112.885 -1.961 . . . . 0.0 111.432 -178.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -70.93 135.94 85.22 Favored Pre-proline 0 C--N 1.378 1.81 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 152.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -81.2 102.95 1.39 Allowed 'Trans proline' 1 CA--C 1.625 5.069 0 O-C-N 126.819 3.01 . . . . 0.0 105.731 164.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 36.7 tp10 . . . . . 0 C--N 1.296 -1.724 1 CA-C-O 111.35 -4.166 . . . . 0.0 118.238 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.514 -0.41 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -109.18 -81.89 0.57 Allowed 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 115.253 -2.308 . . . . 0.0 110.7 -175.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 41.9 t -166.23 115.0 0.93 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 128.717 2.807 . . . . 0.0 109.541 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . 0.314 91.2 mt-10 65.71 -0.67 1.21 Allowed 'General case' 0 C--N 1.278 -2.529 0 CA-C-O 124.901 2.286 . . . . 0.0 116.652 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 11.3 p -81.84 -16.27 51.34 Favored 'General case' 0 C--N 1.289 -2.054 0 O-C-N 118.888 -2.383 . . . . 0.0 111.946 -167.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -140.28 11.38 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.583 2.216 0 CA-C-O 122.802 1.286 . . . . 0.0 112.824 -170.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -154.21 132.82 6.88 Favored Pre-proline 0 N--CA 1.485 1.321 0 C-N-CA 125.102 1.361 . . . . 0.0 108.419 175.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -60.15 143.21 99.55 Favored 'Trans proline' 0 C--O 1.28 2.576 0 C-N-CA 123.203 2.602 . . . . 0.0 114.723 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . 0.255 26.2 Cg_exo -46.71 156.84 0.57 Allowed 'Trans proline' 0 CA--C 1.551 1.334 0 C-N-CA 124.297 3.332 . . . . 0.0 113.101 157.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -58.13 152.32 53.02 Favored 'Trans proline' 0 N--CA 1.444 -1.405 1 C-N-CA 126.045 4.496 . . . . 0.0 111.419 176.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -64.33 158.59 48.1 Favored 'Trans proline' 0 CA--C 1.575 2.562 0 O-C-N 123.24 1.126 . . . . 0.0 114.385 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -62.21 -25.01 67.56 Favored 'General case' 0 C--O 1.183 -2.413 0 O-C-N 118.801 -2.437 . . . . 0.0 114.97 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -56.08 -24.79 42.34 Favored 'General case' 0 CA--C 1.562 1.435 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.28 -60.41 3.44 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 124.745 2.212 . . . . 0.0 105.721 169.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 58.9 m80 -67.56 -45.0 76.88 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 116.747 -3.721 . . . . 0.0 112.12 -173.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 27.2 t80 -70.51 -29.37 65.86 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-O 128.2 3.857 . . . . 0.0 113.341 -177.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 36.9 ttm -68.51 -49.4 59.97 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 118.064 -2.897 . . . . 0.0 112.171 164.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -54.02 -11.83 0.5 Allowed 'General case' 0 C--N 1.369 1.433 0 O-C-N 117.08 -3.513 . . . . 0.0 118.037 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 3.1 t -99.24 -63.31 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.184 -2.361 0 O-C-N 119.646 -1.909 . . . . 0.0 107.167 173.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -52.47 -50.35 62.85 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 117.975 2.583 . . . . 0.0 117.975 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -88.08 -24.67 23.36 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 114.742 -2.551 . . . . 0.0 106.56 -170.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . 0.287 . . -68.48 -47.18 67.74 Favored 'General case' 0 N--CA 1.413 -2.288 0 O-C-N 125.583 1.802 . . . . 0.0 109.903 172.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.87 77.81 Favored 'General case' 0 CA--C 1.454 -2.727 0 O-C-N 125.521 1.763 . . . . 0.0 115.168 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 26.7 t80 -63.13 -49.85 72.78 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-O 113.894 -2.955 . . . . 0.0 111.334 174.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 41.8 t -60.18 -42.86 91.71 Favored 'Isoleucine or valine' 0 C--N 1.375 1.69 1 O-C-N 129.591 4.307 . . . . 0.0 111.116 176.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 10.5 tp -73.27 -44.77 58.68 Favored 'General case' 0 C--N 1.355 0.836 1 O-C-N 115.957 -4.214 . . . . 0.0 110.552 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . 0.304 65.9 tp -64.48 -37.88 89.07 Favored 'General case' 0 CA--C 1.575 1.909 0 CA-C-N 122.195 2.271 . . . . 0.0 110.873 -178.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.329 29.1 t80 -66.44 -41.49 89.07 Favored 'General case' 0 C--O 1.252 1.212 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 167.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.425 87.0 t80 -70.88 -29.41 65.5 Favored 'General case' 0 C--O 1.21 -0.985 0 C-N-CA 116.297 -2.161 . . . . 0.0 114.037 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 8.0 t -83.26 -50.82 15.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.636 176.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -58.85 -56.27 26.25 Favored Glycine 0 N--CA 1.414 -2.779 0 CA-C-O 125.088 2.493 . . . . 0.0 113.574 -168.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 52.6 t -80.9 -38.78 27.39 Favored 'General case' 0 C--N 1.378 1.824 0 CA-C-N 109.947 -3.126 . . . . 0.0 110.083 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -76.03 -17.65 79.91 Favored Glycine 0 N--CA 1.511 3.691 0 CA-C-O 115.452 -2.86 . . . . 0.0 108.393 -169.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 7.1 t -75.99 -52.61 17.43 Favored 'Isoleucine or valine' 0 C--N 1.353 0.719 0 CA-C-N 121.599 2.7 . . . . 0.0 106.517 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1755 ' ' LEU . . . . . 0.409 ' H ' ' HG ' ' A' 1755 ' ' LEU 0.276 2.4 pp -71.7 -27.33 62.95 Favored 'General case' 0 C--O 1.242 0.693 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 179.17 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 4.4 tt -76.99 -22.84 52.54 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 117.81 -1.09 . . . . 0.0 111.851 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 72.7 m -72.81 -36.93 67.65 Favored 'General case' 0 C--O 1.258 1.511 0 O-C-N 124.64 1.213 . . . . 0.0 111.197 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 21.6 ttt-85 -68.16 -52.33 35.81 Favored 'General case' 0 CA--C 1.506 -0.736 1 O-C-N 129.141 4.026 . . . . 0.0 108.544 -175.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 16.4 ptpt 162.13 125.05 0.0 OUTLIER 'General case' 0 N--CA 1.533 3.722 0 CA-C-N 112.787 -2.006 . . . . 0.0 110.087 158.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -170.33 -6.32 0.02 OUTLIER 'General case' 0 N--CA 1.524 3.275 0 N-CA-C 118.977 2.954 . . . . 0.0 118.977 -170.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 50.0 mtp85 -46.69 -59.02 3.29 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 119.534 -1.979 . . . . 0.0 108.047 -172.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1762 ' ' ARG . . . . . . . . . . . . 0.325 33.6 mmm-85 55.24 -103.93 0.2 Allowed 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 121.83 2.105 . . . . 0.0 115.694 170.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 62.89 -27.71 0.07 Allowed 'General case' 0 C--O 1.174 -2.894 1 C-N-CA 133.157 4.583 . . . . 0.0 115.286 174.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -78.07 -98.43 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.986 0 C-N-CA 128.782 2.833 . . . . 0.0 107.407 173.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -80.71 45.67 3.17 Favored Glycine 0 CA--C 1.469 -2.83 0 O-C-N 117.52 -3.237 . . . . 0.0 115.486 -171.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -160.09 -3.69 0.06 Allowed 'General case' 1 N--CA 1.543 4.189 0 O-C-N 118.689 -2.654 . . . . 0.0 112.436 -177.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.88 99.24 12.24 Favored 'General case' 0 CA--C 1.585 2.31 0 CA-C-O 123.989 1.852 . . . . 0.0 110.147 -168.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 20.3 t90 55.76 -54.52 0.02 OUTLIER 'General case' 0 N--CA 1.53 3.565 0 CA-C-O 116.198 -1.858 . . . . 0.0 115.907 -165.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -108.72 131.99 21.43 Favored Pre-proline 0 C--N 1.288 -2.098 0 C-N-CA 124.583 1.153 . . . . 0.0 111.599 165.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -85.09 60.74 5.71 Favored 'Trans proline' 0 N--CA 1.436 -1.905 0 C-N-CA 121.924 1.749 . . . . 0.0 116.01 -168.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 15.2 tp10 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 126.009 2.814 . . . . 0.0 113.028 -166.137 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.4 1.5 p . . . . . 0 CA--C 1.547 0.853 0 CA-C-O 124.217 1.961 . . . . 0.0 111.527 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.79 156.11 46.24 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 125.79 1.636 . . . . 0.0 110.768 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 64.4 m -54.7 143.93 23.59 Favored 'General case' 0 CA--C 1.582 2.204 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 162.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 61.6 tt0 61.7 -35.86 0.11 Allowed 'General case' 0 C--O 1.262 1.745 0 N-CA-C 118.25 2.685 . . . . 0.0 118.25 -169.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 1.3 p -70.59 -16.44 62.85 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-O 125.242 2.448 . . . . 0.0 115.8 171.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.302 0.5 OUTLIER -123.9 -36.86 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.401 2.833 0 O-C-N 118.685 -2.51 . . . . 0.0 116.316 176.276 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -107.22 100.85 35.39 Favored Pre-proline 0 C--O 1.27 2.137 0 N-CA-C 105.688 -1.968 . . . . 0.0 105.688 -170.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -89.71 153.16 5.13 Favored 'Trans proline' 0 C--O 1.248 1.009 0 C-N-CA 123.126 2.551 . . . . 0.0 112.922 -169.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -63.15 161.56 29.76 Favored 'Trans proline' 0 N--CA 1.438 -1.762 0 CA-C-O 113.82 -2.658 . . . . 0.0 117.248 174.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -70.63 160.06 50.7 Favored 'Trans proline' 0 C--O 1.284 2.803 1 C-N-CA 125.681 4.254 . . . . 0.0 112.411 171.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -76.63 128.12 10.02 Favored 'Trans proline' 0 CA--C 1.566 2.105 0 C-N-CA 121.928 1.752 . . . . 0.0 111.944 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -50.56 -26.24 5.04 Favored 'General case' 0 C--O 1.199 -1.584 0 CA-C-N 114.45 -1.25 . . . . 0.0 113.556 173.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -53.47 -23.79 11.18 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.183 1.393 . . . . 0.0 110.315 177.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 94.3 mt -79.12 -65.67 0.97 Allowed 'General case' 0 C--O 1.19 -2.049 0 CA-C-O 123.835 1.779 . . . . 0.0 113.735 173.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 72.2 t60 -70.35 -29.47 66.17 Favored 'General case' 0 CA--C 1.561 1.366 1 O-C-N 114.718 -4.989 . . . . 0.0 116.538 -176.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 2.7 t80 -75.47 -43.02 51.61 Favored 'General case' 0 CA--C 1.57 1.715 0 N-CA-C 103.465 -2.791 . . . . 0.0 103.465 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 43.0 ttm -70.13 -32.82 71.01 Favored 'General case' 0 C--O 1.186 -2.242 0 C-N-CA 116.054 -2.258 . . . . 0.0 114.771 169.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 11.5 t80 -49.61 -46.74 49.64 Favored 'General case' 0 CA--C 1.622 3.734 1 N-CA-C 122.228 4.159 . . . . 0.0 122.228 167.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 2.9 t -69.94 -39.65 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 CA-C-N 113.289 -1.778 . . . . 0.0 107.937 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -59.29 -48.92 79.8 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 127.515 3.531 . . . . 0.0 118.68 177.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . 0.276 . . -83.11 -40.15 20.19 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 112.093 -2.321 . . . . 0.0 113.85 -177.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -63.89 -33.21 75.18 Favored 'General case' 0 N--CA 1.403 -2.815 0 C-N-CA 116.688 -2.005 . . . . 0.0 112.491 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -74.88 -31.51 61.61 Favored 'General case' 0 C--N 1.384 2.076 0 O-C-N 117.916 -2.99 . . . . 0.0 106.281 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 9.3 t80 -75.22 -46.08 36.25 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 131.498 3.919 . . . . 0.0 111.667 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 88.4 t -64.18 -32.42 57.34 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-O 123.138 1.447 . . . . 0.0 110.026 170.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 36.4 tp -81.72 -37.6 27.05 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 118.377 -2.702 . . . . 0.0 106.557 -166.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 9.1 tt -85.13 -23.74 28.3 Favored 'General case' 0 C--O 1.249 1.047 0 O-C-N 118.594 -2.566 . . . . 0.0 108.078 -170.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.02 -43.43 62.1 Favored 'General case' 0 CA--C 1.477 -1.856 0 N-CA-C 117.011 2.226 . . . . 0.0 117.011 155.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.288 1.2 t80 -65.86 -28.9 69.31 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 -178.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 90.1 t -89.99 -45.77 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 116.985 -1.483 . . . . 0.0 114.062 170.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -59.26 -49.53 77.53 Favored Glycine 0 C--O 1.255 1.451 0 CA-C-O 123.511 1.617 . . . . 0.0 113.411 -175.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 7.6 t -67.03 -49.06 66.43 Favored 'General case' 0 C--O 1.187 -2.189 0 C-N-CA 131.558 3.943 . . . . 0.0 111.244 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -75.26 -26.45 66.06 Favored Glycine 0 CA--C 1.472 -2.596 0 CA-C-O 115.768 -2.685 . . . . 0.0 111.886 -173.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . 0.415 0.3 OUTLIER -61.89 -45.37 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 CA-C-N 119.869 1.835 . . . . 0.0 112.327 171.635 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1755 ' ' LEU . . . . . 0.402 ' H ' ' HG ' ' A' 1755 ' ' LEU . 16.2 mt -73.32 -37.41 66.18 Favored 'General case' 0 C--O 1.245 0.819 0 O-C-N 118.468 -2.645 . . . . 0.0 105.307 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 19.4 tp -64.64 -21.54 66.75 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-O 123.933 1.825 . . . . 0.0 111.899 -177.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 9.1 t -54.27 -33.77 59.33 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 117.278 2.325 . . . . 0.0 117.278 -167.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -69.21 -6.67 30.48 Favored 'General case' 0 C--O 1.262 1.756 0 CA-C-O 127.637 3.589 . . . . 0.0 118.34 170.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 50.4 mttp -119.38 -23.41 6.69 Favored 'General case' 0 C--N 1.369 1.418 0 O-C-N 116.932 -3.605 . . . . 0.0 110.133 -176.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -47.06 -34.96 6.31 Favored 'General case' 0 N--CA 1.512 2.634 0 C-N-CA 129.117 2.967 . . . . 0.0 114.647 -173.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1761 ' ' ARG . . . . . . . . . . . . 0.379 75.4 ttt180 -50.66 -22.8 2.22 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 124.428 2.061 . . . . 0.0 116.069 178.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -63.5 -54.83 30.11 Favored 'General case' 0 CA--C 1.477 -1.843 0 O-C-N 118.419 -2.676 . . . . 0.0 111.249 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 66.91 149.36 0.05 Allowed 'General case' 0 C--O 1.253 1.25 0 CA-C-N 122.462 2.392 . . . . 0.0 113.017 171.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 11.7 m170 63.1 -63.33 0.12 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 127.763 2.425 . . . . 0.0 114.36 -174.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -76.51 44.88 2.03 Favored Glycine 0 N--CA 1.462 0.371 0 O-C-N 119.119 -2.238 . . . . 0.0 114.728 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -149.15 -7.91 0.35 Allowed 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 125.865 1.666 . . . . 0.0 108.371 173.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . 0.258 23.9 tp -81.95 73.05 9.0 Favored 'General case' 0 N--CA 1.381 -3.886 0 C-N-CA 128.627 2.771 . . . . 0.0 112.394 -171.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.447 16.1 t90 71.51 -64.28 0.39 Allowed 'General case' 0 C--N 1.291 -1.957 0 CA-C-N 112.469 -2.15 . . . . 0.0 108.336 -163.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . 0.257 6.6 m-85 -86.92 139.25 32.76 Favored Pre-proline 0 N--CA 1.431 -1.418 0 C-N-CA 127.267 2.227 . . . . 0.0 113.593 -175.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -95.15 99.51 0.11 Allowed 'Trans proline' 1 N--CA 1.399 -4.079 0 N-CA-C 105.541 -2.523 . . . . 0.0 105.541 176.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 40.3 tp10 . . . . . 0 N--CA 1.495 1.805 0 O-C-N 120.998 -1.064 . . . . 0.0 112.714 -175.005 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.264 8.5 p . . . . . 0 N--CA 1.499 2.022 0 CA-C-O 119.166 -0.445 . . . . 0.0 111.983 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . 0.426 12.3 mp0 -75.0 7.85 2.94 Favored 'General case' 0 C--O 1.195 -1.798 0 CA-C-O 127.095 3.331 . . . . 0.0 117.94 -159.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 60.31 6.36 1.02 Allowed 'General case' 0 N--CA 1.508 2.44 0 O-C-N 117.774 -3.079 . . . . 0.0 116.156 -174.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -80.82 18.67 0.95 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 118.148 -2.845 . . . . 0.0 115.999 171.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.396 1.7 m 52.49 28.48 5.99 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 174.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.533 0.2 OUTLIER 69.08 22.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 118.015 -2.928 . . . . 0.0 118.13 -176.439 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -89.69 136.04 29.96 Favored Pre-proline 0 C--O 1.299 3.705 0 O-C-N 121.844 -0.535 . . . . 0.0 111.638 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -90.63 154.33 4.26 Favored 'Trans proline' 0 N--CA 1.52 3.034 0 C-N-CA 123.421 2.747 . . . . 0.0 107.618 176.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . 0.254 33.8 Cg_exo -70.52 146.56 55.85 Favored 'Trans proline' 0 CA--C 1.554 1.51 0 C-N-CA 121.555 1.504 . . . . 0.0 115.687 168.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -65.13 159.5 46.53 Favored 'Trans proline' 0 C--O 1.269 2.05 1 C-N-CA 125.756 4.304 . . . . 0.0 113.378 -176.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.85 158.85 52.04 Favored 'Trans proline' 0 N--CA 1.481 0.794 1 C-N-CA 126.867 5.044 . . . . 0.0 110.324 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.56 68.67 Favored 'General case' 0 CA--C 1.461 -2.447 0 O-C-N 119.872 -1.767 . . . . 0.0 114.615 168.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -41.45 -30.08 0.18 Allowed 'General case' 0 C--O 1.173 -2.956 0 CA-C-O 114.417 -2.706 . . . . 0.0 118.174 168.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 13.6 mt -75.9 -71.7 0.36 Allowed 'General case' 0 C--O 1.27 2.184 0 O-C-N 125.86 1.975 . . . . 0.0 110.715 165.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 25.0 m80 -66.9 -48.61 68.16 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 127.347 2.259 . . . . 0.0 116.011 -170.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 30.8 t80 -76.92 -30.06 55.95 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 -175.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 8.8 ttp -74.5 -34.17 62.99 Favored 'General case' 0 C--O 1.275 2.424 0 C-N-CA 111.967 -3.893 . . . . 0.0 107.371 175.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.329 9.0 m-85 -55.4 -47.2 76.27 Favored 'General case' 0 CA--C 1.601 2.917 0 CA-C-N 119.065 0.848 . . . . 0.0 113.281 176.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 2.0 t -69.48 -35.17 65.44 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.562 0 CA-C-O 123.09 1.424 . . . . 0.0 112.114 178.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -69.12 -45.64 69.66 Favored 'General case' 0 CA--C 1.579 2.085 0 O-C-N 118.866 -2.396 . . . . 0.0 112.122 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -68.34 -51.32 45.83 Favored 'General case' 0 N--CA 1.53 3.525 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . 0.26 . . -59.01 -40.11 83.92 Favored 'General case' 0 C--O 1.271 2.191 0 CA-C-N 122.04 2.2 . . . . 0.0 115.258 176.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.7 95.1 Favored 'General case' 0 C--O 1.175 -2.836 0 CA-C-O 122.249 1.023 . . . . 0.0 111.562 -177.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 59.5 t80 -66.43 -44.62 82.39 Favored 'General case' 0 C--N 1.355 0.841 0 C-N-CA 131.355 3.862 . . . . 0.0 111.089 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 40.9 t -85.8 -26.92 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.643 0 CA-C-O 114.677 -2.582 . . . . 0.0 109.537 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 56.2 tp -71.72 -37.88 70.56 Favored 'General case' 0 C--O 1.261 1.667 0 C-N-CA 115.887 -2.325 . . . . 0.0 115.139 171.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 13.1 tp -74.64 -32.95 62.44 Favored 'General case' 0 C--O 1.239 0.535 0 O-C-N 120.473 -1.392 . . . . 0.0 113.626 -178.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.426 51.5 t80 -65.58 -50.22 65.93 Favored 'General case' 0 C--O 1.257 1.481 0 N-CA-C 118.01 2.596 . . . . 0.0 118.01 162.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.353 57.0 m-85 -77.58 -24.87 49.66 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -177.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 63.2 t -81.54 -51.77 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.867 0 CA-C-O 114.96 -2.447 . . . . 0.0 108.907 172.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -62.04 -41.69 99.69 Favored Glycine 1 CA--C 1.595 5.064 0 CA-C-N 124.637 3.381 . . . . 0.0 114.519 -174.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . 0.327 9.0 t -68.56 -30.7 69.53 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 171.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -72.93 -25.4 73.87 Favored Glycine 0 CA--C 1.543 1.817 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -173.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 69.3 t -67.46 -44.19 86.95 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.427 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.92 -23.27 18.81 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 116.776 2.139 . . . . 0.0 116.776 -172.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 26.7 tp -74.06 -27.72 61.05 Favored 'General case' 0 CA--C 1.59 2.499 0 CA-C-N 113.839 -1.528 . . . . 0.0 112.673 168.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 1.1 t -62.82 -38.04 89.16 Favored 'General case' 0 C--O 1.278 2.57 0 CA-C-N 112.689 -2.051 . . . . 0.0 109.562 171.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 11.0 mtt85 -74.48 -66.7 0.7 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 119.027 -2.296 . . . . 0.0 113.267 164.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1759 ' ' LYS . . . . . . . . . . . . 0.324 16.2 pttm -150.93 -99.41 0.06 Allowed 'General case' 0 CA--C 1.47 -2.114 0 C-N-CA 127.688 2.395 . . . . 0.0 114.289 -170.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1760 ' ' ARG . . . . . . . . . . . . 0.364 14.0 ttm180 58.44 -45.65 0.06 Allowed 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -173.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1761 ' ' ARG . . . . . . . . . . . . 0.274 19.5 ttm-85 -142.45 -73.89 0.3 Allowed 'General case' 0 CA--C 1.565 1.556 0 O-C-N 125.827 1.955 . . . . 0.0 113.365 169.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1762 ' ' ARG . . . . . . . . . . . . 0.263 55.9 mtp85 52.26 65.65 1.44 Allowed 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 124.764 1.225 . . . . 0.0 112.904 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -128.93 38.86 3.88 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 125.406 1.482 . . . . 0.0 114.607 -176.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.346 10.8 m-70 64.99 -49.72 0.34 Allowed 'General case' 0 C--N 1.357 0.93 0 C-N-CA 126.654 1.982 . . . . 0.0 113.837 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -67.25 30.74 0.2 Allowed Glycine 0 CA--C 1.474 -2.521 0 O-C-N 116.68 -3.762 . . . . 0.0 117.689 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -166.12 4.8 0.03 OUTLIER 'General case' 0 C--N 1.359 0.986 0 C-N-CA 126.687 1.995 . . . . 0.0 109.176 -174.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 11.3 tp -82.84 67.87 9.09 Favored 'General case' 0 C--O 1.188 -2.159 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.862 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 75.6 m95 59.31 -48.88 0.07 Allowed 'General case' 0 CA--C 1.597 2.781 0 C-N-CA 130.328 3.451 . . . . 0.0 115.646 -165.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -84.1 125.81 71.59 Favored Pre-proline 0 C--N 1.297 -1.696 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -87.94 43.09 0.8 Allowed 'Trans proline' 0 N--CA 1.487 1.121 0 CA-C-N 121.656 1.627 . . . . 0.0 113.317 -169.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 . . . . . 0 N--CA 1.529 3.502 0 CA-C-O 116.267 -1.825 . . . . 0.0 113.593 -163.478 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.291 3.26 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -150.5 157.37 42.94 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.941 2.097 . . . . 0.0 111.511 -158.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 75.0 p -69.24 -0.29 5.9 Favored 'General case' 0 N--CA 1.507 2.396 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -76.76 -18.12 58.64 Favored 'General case' 0 C--N 1.29 -1.982 0 O-C-N 119.759 -1.838 . . . . 0.0 112.744 -175.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.339 1.4 m 61.46 32.01 18.95 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.616 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.383 0.3 OUTLIER 73.16 14.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.494 -1.192 0 CA-C-O 122.443 1.116 . . . . 0.0 113.89 -174.872 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -71.95 131.69 85.4 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 117.722 -3.111 . . . . 0.0 109.947 170.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.19 147.96 49.04 Favored 'Trans proline' 0 N--CA 1.526 3.409 0 C-N-CA 122.901 2.401 . . . . 0.0 116.145 170.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -43.09 140.84 3.15 Favored 'Trans proline' 0 N--CA 1.499 1.806 1 C-N-CA 126.828 5.018 . . . . 0.0 111.576 -178.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -56.85 145.09 85.82 Favored 'Trans proline' 0 CA--C 1.592 3.423 0 CA-C-N 124.605 2.68 . . . . 0.0 118.016 176.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.34 160.66 15.9 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 123.828 3.018 . . . . 0.0 111.649 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -63.34 -18.72 63.95 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.254 1.821 . . . . 0.0 113.555 171.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -49.83 -22.54 1.49 Allowed 'General case' 0 C--O 1.21 -0.997 1 O-C-N 116.237 -4.04 . . . . 0.0 116.179 160.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 12.7 tp -80.99 -77.29 0.21 Allowed 'General case' 0 C--N 1.397 2.663 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 170.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 31.7 m80 -71.29 -57.45 4.46 Favored 'General case' 0 CA--C 1.597 2.775 0 C-N-CA 130.026 3.33 . . . . 0.0 111.375 -165.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 2.9 t80 -57.93 -40.45 80.49 Favored 'General case' 0 CA--C 1.491 -1.321 0 CA-C-O 116.001 -1.952 . . . . 0.0 111.507 173.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . 0.269 16.5 ttp -65.24 -39.52 92.8 Favored 'General case' 0 N--CA 1.527 3.386 0 C-N-CA 116.727 -1.989 . . . . 0.0 113.068 174.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 67.6 t80 -55.29 -46.3 76.21 Favored 'General case' 0 C--N 1.364 1.201 0 N-CA-C 117.22 2.304 . . . . 0.0 117.22 176.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 83.5 t -59.12 -54.34 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 O-C-N 118.241 -2.787 . . . . 0.0 106.911 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -57.3 -51.4 69.54 Favored 'General case' 0 C--O 1.26 1.617 0 O-C-N 125.702 1.876 . . . . 0.0 114.857 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -70.1 -49.22 53.12 Favored 'General case' 0 C--O 1.186 -2.275 0 O-C-N 119.499 -2.001 . . . . 0.0 108.498 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -61.06 -32.95 72.58 Favored 'General case' 0 C--O 1.195 -1.768 1 O-C-N 116.205 -4.06 . . . . 0.0 114.397 171.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -71.16 -37.02 72.24 Favored 'General case' 0 CA--C 1.478 -1.817 0 O-C-N 124.779 1.299 . . . . 0.0 110.983 -176.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 2.4 t80 -70.33 -44.88 67.31 Favored 'General case' 0 CA--C 1.477 -1.842 0 C-N-CA 129.608 3.163 . . . . 0.0 111.673 175.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 7.9 t -62.25 -45.98 97.5 Favored 'Isoleucine or valine' 0 C--O 1.246 0.892 0 N-CA-C 105.399 -2.074 . . . . 0.0 105.399 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 20.1 tp -57.1 -53.64 55.79 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 117.14 2.274 . . . . 0.0 117.14 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 28.2 tp -64.02 -39.28 93.75 Favored 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 129.255 3.022 . . . . 0.0 110.2 -173.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.479 60.7 t80 -71.25 -35.68 71.5 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 117.706 2.484 . . . . 0.0 117.706 167.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.585 16.0 t80 -64.52 -44.54 90.55 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 175.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 53.9 t -86.4 -36.03 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.427 0 O-C-N 127.672 3.107 . . . . 0.0 110.396 -168.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -76.06 -39.07 33.48 Favored Glycine 0 CA--C 1.575 3.799 0 C-N-CA 114.405 -3.76 . . . . 0.0 111.219 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 50.8 t -62.56 -45.0 94.95 Favored 'General case' 0 CA--C 1.601 2.918 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 167.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -57.27 -16.88 22.2 Favored Glycine 1 CA--C 1.604 5.624 0 C-N-CA 125.232 1.396 . . . . 0.0 112.725 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 37.1 t -59.99 -52.96 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.41 0 O-C-N 119.135 -2.391 . . . . 0.0 109.639 172.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 3.8 pp -95.97 -35.85 11.27 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 112.873 -1.967 . . . . 0.0 115.003 -175.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.19 -22.61 67.01 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 170.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 12.3 t -46.95 -40.72 14.85 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 167.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . 0.276 7.2 tpt180 -74.29 -67.28 0.63 Allowed 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 112.817 -3.468 . . . . 0.0 107.867 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 2.6 ptpt -177.71 -69.42 0.01 OUTLIER 'General case' 0 C--N 1.376 1.735 0 O-C-N 128.606 3.691 . . . . 0.0 110.961 168.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1760 ' ' ARG . . . . . . . . . . . . 0.25 43.5 ttt85 50.59 -42.23 0.01 OUTLIER 'General case' 0 C--N 1.391 2.38 0 N-CA-C 118.486 2.772 . . . . 0.0 118.486 -171.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.6 -100.43 0.37 Allowed 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 177.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 55.18 31.51 16.57 Favored 'General case' 0 C--O 1.273 2.329 1 O-C-N 114.923 -4.861 . . . . 0.0 114.462 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 11.4 pm0 -81.09 49.79 1.3 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 117.115 -3.49 . . . . 0.0 110.408 176.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.39 36.7 m80 64.21 -176.32 0.16 Allowed 'General case' 0 N--CA 1.483 1.203 0 O-C-N 119.13 -2.231 . . . . 0.0 110.009 -164.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . 67.32 -10.96 0.83 Allowed Glycine 1 N--CA 1.536 5.361 0 O-C-N 116.863 -3.648 . . . . 0.0 113.314 -177.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -150.17 15.76 0.82 Allowed 'General case' 0 C--O 1.193 -1.887 0 C-N-CA 127.269 2.228 . . . . 0.0 107.127 -154.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . 0.26 25.9 tp -101.18 66.05 1.11 Allowed 'General case' 0 CA--C 1.601 2.925 0 CA-C-O 127.826 3.679 . . . . 0.0 106.046 -165.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.409 47.0 t-105 76.8 -63.51 0.37 Allowed 'General case' 0 N--CA 1.419 -1.976 0 C-N-CA 128.617 2.767 . . . . 0.0 111.581 -176.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . 0.411 20.2 m-85 -74.22 147.03 85.2 Favored Pre-proline 0 C--O 1.268 2.034 0 CA-C-N 112.879 -1.964 . . . . 0.0 112.042 158.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.58 112.88 3.62 Favored 'Trans proline' 0 CA--C 1.572 2.38 0 C-N-CA 124.896 3.731 . . . . 0.0 106.883 152.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . 0.337 9.0 tm-20 . . . . . 0 C--O 1.267 1.988 1 O-C-N 130.124 4.64 . . . . 0.0 115.773 173.552 . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.35 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -142.45 -5.14 0.96 Allowed 'General case' 0 CA--C 1.564 1.515 0 C-N-CA 126.664 1.985 . . . . 0.0 112.748 169.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 9.5 t -79.05 109.26 13.19 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 -174.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . 0.282 89.2 mt-10 52.62 4.11 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 -177.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 7.3 t -94.85 -29.65 14.6 Favored 'General case' 0 N--CA 1.423 -1.804 0 O-C-N 118.118 -2.864 . . . . 0.0 113.667 172.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 68.9 t -143.34 104.72 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.325 0 C-N-CA 128.818 2.847 . . . . 0.0 110.395 171.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -154.46 94.51 2.77 Favored Pre-proline 0 CA--C 1.589 2.456 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -61.32 162.02 21.6 Favored 'Trans proline' 0 CA--C 1.582 2.888 0 O-C-N 116.481 -2.431 . . . . 0.0 113.563 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -68.35 162.43 40.56 Favored 'Trans proline' 0 N--CA 1.426 -2.455 0 C-N-CA 124.488 3.459 . . . . 0.0 113.696 170.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -68.73 162.02 42.97 Favored 'Trans proline' 0 C--O 1.259 1.574 0 C-N-CA 122.17 1.913 . . . . 0.0 113.204 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -60.58 141.42 95.21 Favored 'Trans proline' 0 C--O 1.257 1.451 0 C-N-CA 123.921 3.081 . . . . 0.0 114.032 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -59.13 -17.38 26.31 Favored 'General case' 0 C--O 1.243 0.719 0 O-C-N 118.826 -2.422 . . . . 0.0 112.837 163.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -51.97 -30.8 26.5 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 123.726 2.966 . . . . 0.0 116.096 164.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 3.4 tt -74.26 -61.02 2.0 Favored 'General case' 0 C--O 1.195 -1.793 0 O-C-N 125.516 1.76 . . . . 0.0 110.659 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 53.7 m80 -73.99 -57.68 3.81 Favored 'General case' 0 C--O 1.277 2.517 0 C-N-CA 128.912 2.885 . . . . 0.0 110.246 -169.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 2.1 t80 -63.89 -32.04 73.43 Favored 'General case' 0 CA--C 1.575 1.939 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 36.2 ttm -77.1 -36.63 55.46 Favored 'General case' 0 C--N 1.381 1.938 0 O-C-N 118.035 -2.916 . . . . 0.0 113.218 174.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 24.6 t80 -55.28 -42.03 73.04 Favored 'General case' 0 CA--C 1.475 -1.918 0 O-C-N 119.259 -2.151 . . . . 0.0 112.231 174.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 25.2 t -69.76 -41.09 79.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 CA-C-N 124.098 3.136 . . . . 0.0 109.748 175.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -69.06 -34.06 74.57 Favored 'General case' 0 CA--C 1.625 3.845 0 O-C-N 117.525 -3.234 . . . . 0.0 111.318 -176.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -81.85 -47.44 12.81 Favored 'General case' 0 C--N 1.291 -1.952 0 C-N-CA 129.129 2.972 . . . . 0.0 109.204 175.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -78.03 -27.16 48.74 Favored 'General case' 0 C--O 1.198 -1.608 0 CA-C-N 122.068 2.213 . . . . 0.0 109.226 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -77.4 -36.47 53.35 Favored 'General case' 0 C--O 1.202 -1.434 0 O-C-N 116.595 -3.816 . . . . 0.0 110.049 172.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 8.7 t80 -72.54 -34.0 67.24 Favored 'General case' 0 C--N 1.291 -1.977 0 O-C-N 119.901 -1.75 . . . . 0.0 107.989 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 2.6 t -83.14 -29.63 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 N-CA-C 104.339 -2.467 . . . . 0.0 104.339 -171.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 14.7 tp -81.64 -56.72 3.83 Favored 'General case' 0 C--O 1.26 1.61 0 CA-C-N 118.958 0.799 . . . . 0.0 109.792 175.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 22.3 tp -63.64 -22.66 67.02 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 118.419 -2.676 . . . . 0.0 110.43 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . . 35.3 t80 -81.98 -45.57 15.17 Favored 'General case' 0 C--O 1.193 -1.902 0 O-C-N 118.294 -2.754 . . . . 0.0 115.35 166.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.402 46.5 t80 -66.7 -13.32 61.15 Favored 'General case' 0 C--N 1.265 -3.088 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 177.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 93.9 t -102.37 -42.6 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.442 -3.205 0 CA-C-O 113.72 -3.038 . . . . 0.0 109.162 167.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -62.88 -49.2 74.56 Favored Glycine 1 N--CA 1.526 4.665 1 CA-C-N 126.433 4.197 . . . . 0.0 110.609 -176.809 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 46.3 t -79.76 -31.0 40.89 Favored 'General case' 0 C--O 1.197 -1.684 0 CA-C-O 114.753 -2.546 . . . . 0.0 108.066 173.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -68.32 -21.82 74.32 Favored Glycine 0 C--O 1.202 -1.889 0 CA-C-N 122.662 2.483 . . . . 0.0 116.946 176.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 3.8 t -84.83 -38.22 13.16 Favored 'Isoleucine or valine' 0 C--O 1.266 1.954 0 O-C-N 128.453 3.09 . . . . 0.0 107.342 -175.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.57 -27.67 25.37 Favored 'General case' 0 CA--C 1.494 -1.193 1 O-C-N 116.219 -4.05 . . . . 0.0 116.359 167.471 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . 0.32 1.4 tt -80.96 -11.67 59.53 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 122.214 2.279 . . . . 0.0 113.057 173.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 56.5 p -49.94 -38.96 38.74 Favored 'General case' 0 N--CA 1.533 3.707 0 O-C-N 119.025 -2.297 . . . . 0.0 109.321 173.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -46.92 -61.81 1.69 Allowed 'General case' 0 N--CA 1.485 1.305 0 O-C-N 125.412 1.695 . . . . 0.0 111.148 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1759 ' ' LYS . . . . . . . . . . . . 0.31 34.6 pttt -176.88 -108.99 0.0 OUTLIER 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 116.33 -1.795 . . . . 0.0 108.091 -171.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.07 -12.08 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 131.088 3.755 . . . . 0.0 113.624 -178.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 63.54 89.27 0.09 Allowed 'General case' 0 N--CA 1.52 3.047 0 CA-C-O 124.636 2.16 . . . . 0.0 106.456 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.26 141.72 8.19 Favored 'General case' 0 CA--C 1.473 -1.985 0 N-CA-C 118.0 2.593 . . . . 0.0 118.0 169.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1763 ' ' GLN . . . . . . . . . . . . 0.354 8.2 tp60 67.51 156.31 0.11 Allowed 'General case' 0 N--CA 1.424 -1.774 0 O-C-N 120.257 -1.527 . . . . 0.0 110.676 -169.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 28.5 m170 58.75 -17.77 0.02 OUTLIER 'General case' 0 C--N 1.377 1.764 0 N-CA-C 121.689 3.959 . . . . 0.0 121.689 -170.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -117.62 23.97 9.29 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 127.238 2.352 . . . . 0.0 115.429 168.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -147.56 6.11 0.82 Allowed 'General case' 0 N--CA 1.514 2.749 0 CA-C-O 116.173 -1.87 . . . . 0.0 113.511 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 27.4 tp -107.64 66.03 0.65 Allowed 'General case' 0 CA--C 1.455 -2.711 0 O-C-N 126.218 2.199 . . . . 0.0 111.912 -165.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 47.2 m95 71.93 -49.98 0.69 Allowed 'General case' 0 CA--C 1.452 -2.813 1 C-N-CA 134.732 5.213 . . . . 0.0 111.891 -175.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -99.2 96.59 4.37 Favored Pre-proline 0 C--O 1.285 2.93 0 CA-C-O 116.388 -1.768 . . . . 0.0 114.037 165.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . 0.288 68.2 Cg_endo -64.2 92.55 0.18 Allowed 'Trans proline' 0 C--N 1.378 2.131 1 C-N-CA 126.971 5.114 . . . . 0.0 112.349 -178.003 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 8.3 tp10 . . . . . 0 C--N 1.368 1.381 0 O-C-N 127.524 3.015 . . . . 0.0 110.72 -172.951 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -125.8 179.95 4.95 Favored 'General case' 0 CA--C 1.588 2.434 0 CA-C-O 123.315 1.531 . . . . 0.0 107.127 -175.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1723 ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' 1725 ' ' THR . 22.2 t -106.29 140.32 39.41 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-O 115.365 -2.255 . . . . 0.0 115.416 174.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 8.5 tp10 62.46 -28.44 0.07 Allowed 'General case' 0 N--CA 1.483 1.212 1 O-C-N 129.546 4.279 . . . . 0.0 114.997 -163.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1725 ' ' THR . . . . . 0.418 ' H ' ' C ' ' A' 1723 ' ' SER 0.261 0.3 OUTLIER -67.91 13.27 0.08 Allowed 'General case' 0 CA--C 1.596 2.731 0 C-N-CA 127.81 2.444 . . . . 0.0 117.401 175.858 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.448 1.4 t -64.02 -101.86 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.577 2.007 0 C-N-CA 128.738 2.815 . . . . 0.0 113.966 164.192 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . 0.259 13.7 tt0 -151.74 111.5 2.94 Favored Pre-proline 0 N--CA 1.489 1.51 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 164.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -63.6 149.19 91.54 Favored 'Trans proline' 0 N--CA 1.43 -2.263 0 C-N-CA 125.066 3.844 . . . . 0.0 113.442 173.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -73.37 157.92 48.94 Favored 'Trans proline' 0 CA--C 1.578 2.708 0 C-N-CA 124.031 3.154 . . . . 0.0 110.59 170.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.32 155.1 5.17 Favored 'Trans proline' 0 N--CA 1.452 -0.961 1 C-N-CA 128.452 6.102 . . . . 0.0 108.68 168.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . 0.281 91.6 Cg_endo -73.29 99.37 1.11 Allowed 'Trans proline' 0 C--N 1.405 3.52 1 C-N-CA 129.558 6.839 . . . . 0.0 113.015 -176.183 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -53.84 -24.7 16.55 Favored 'General case' 0 N--CA 1.418 -2.052 0 C-N-CA 128.395 2.678 . . . . 0.0 111.876 177.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -39.94 -49.68 2.47 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.781 2.882 . . . . 0.0 118.781 160.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . 0.266 34.4 mt -62.36 -48.94 77.55 Favored 'General case' 0 C--N 1.275 -2.666 0 C-N-CA 126.962 2.105 . . . . 0.0 112.902 -172.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . 0.309 36.0 m80 -64.35 -44.22 92.16 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 113.194 -1.821 . . . . 0.0 113.525 169.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 24.7 t80 -62.66 -54.59 37.18 Favored 'General case' 0 C--O 1.193 -1.897 0 C-N-CA 128.618 2.767 . . . . 0.0 112.618 -174.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 54.4 ttm -74.15 -27.56 60.9 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-N 110.661 -2.972 . . . . 0.0 113.991 176.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.283 43.9 t80 -55.2 -51.7 65.72 Favored 'General case' 0 N--CA 1.51 2.531 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 160.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 32.5 t -60.81 -46.68 95.75 Favored 'Isoleucine or valine' 0 C--N 1.357 0.9 0 O-C-N 120.422 -1.424 . . . . 0.0 111.663 172.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -67.53 -39.56 85.04 Favored 'General case' 0 C--N 1.279 -2.495 0 CA-C-O 115.777 -2.059 . . . . 0.0 112.724 -173.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -75.18 -45.68 39.08 Favored 'General case' 0 C--N 1.378 1.828 0 CA-C-O 114.455 -2.688 . . . . 0.0 107.744 175.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -58.14 -42.46 85.92 Favored 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 122.227 2.285 . . . . 0.0 112.87 175.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -69.0 -29.34 67.52 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 175.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 42.5 t80 -83.67 -35.56 24.45 Favored 'General case' 0 C--O 1.271 2.221 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 70.3 t -71.53 -40.9 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.386 -3.674 0 C-N-CA 126.88 2.072 . . . . 0.0 116.587 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.39 -46.24 67.38 Favored 'General case' 0 C--O 1.207 -1.168 0 CA-C-N 114.719 -1.128 . . . . 0.0 112.385 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 8.3 tt -69.22 -34.44 74.86 Favored 'General case' 0 N--CA 1.425 -1.694 0 CA-C-O 124.296 1.998 . . . . 0.0 110.894 -175.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.391 20.3 t80 -66.94 -63.79 0.99 Allowed 'General case' 0 CA--C 1.478 -1.79 0 CA-C-O 113.916 -2.945 . . . . 0.0 111.646 169.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.259 4.4 t80 -77.17 -2.95 37.08 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 127.349 2.906 . . . . 0.0 114.226 -169.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 91.8 t -92.53 -35.55 6.86 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.367 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 164.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -75.45 -45.38 18.67 Favored Glycine 0 N--CA 1.498 2.826 1 CA-C-O 128.741 4.523 . . . . 0.0 110.672 -176.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 47.8 t -67.55 -33.5 75.17 Favored 'General case' 0 CA--C 1.574 1.898 1 C-N-CA 133.826 4.85 . . . . 0.0 106.024 170.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -76.0 -22.34 74.35 Favored Glycine 0 CA--C 1.559 2.836 0 O-C-N 116.993 -3.567 . . . . 0.0 114.276 175.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 1.6 t -72.26 -46.93 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 118.457 -2.79 . . . . 0.0 112.822 176.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.54 -31.01 63.43 Favored 'General case' 0 CA--C 1.572 1.794 0 CA-C-N 112.838 -1.983 . . . . 0.0 110.9 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 22.5 mt -80.32 -31.73 38.04 Favored 'General case' 0 C--O 1.256 1.437 0 CA-C-O 124.239 1.971 . . . . 0.0 112.195 178.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 28.6 t -60.85 -30.29 70.03 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.292 -1.322 . . . . 0.0 114.077 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -82.99 -61.57 1.83 Allowed 'General case' 0 N--CA 1.528 3.453 0 CA-C-O 116.688 -1.625 . . . . 0.0 107.678 168.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 3.2 pttt -172.37 -56.01 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 120.909 1.686 . . . . 0.0 107.993 166.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 57.52 -55.31 0.03 OUTLIER 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 113.72 -3.038 . . . . 0.0 110.64 -154.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 5.6 tpp180 58.86 60.35 2.51 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 128.002 2.521 . . . . 0.0 111.545 -177.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -84.65 139.42 32.06 Favored 'General case' 0 N--CA 1.419 -1.984 0 O-C-N 119.065 -2.272 . . . . 0.0 116.742 162.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -177.92 95.37 0.04 OUTLIER 'General case' 0 CA--C 1.597 2.761 0 C-N-CA 127.529 2.332 . . . . 0.0 109.153 167.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 72.3 m-70 58.97 -48.3 0.06 Allowed 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 127.786 2.434 . . . . 0.0 112.983 175.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -61.78 8.76 0.12 Allowed Glycine 0 C--O 1.223 -0.551 0 N-CA-C 122.095 3.598 . . . . 0.0 122.095 175.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -151.29 2.35 0.41 Allowed 'General case' 0 N--CA 1.491 1.61 1 C-N-CA 132.626 4.37 . . . . 0.0 115.869 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 6.7 tp -89.05 83.21 6.56 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-O 125.178 2.418 . . . . 0.0 113.521 -173.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 50.4 t-105 66.74 -57.05 0.41 Allowed 'General case' 0 C--N 1.372 1.56 1 C-N-CA 135.043 5.337 . . . . 0.0 109.524 -177.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -83.83 133.93 45.27 Favored Pre-proline 0 C--N 1.376 1.744 0 O-C-N 118.946 -2.346 . . . . 0.0 109.183 157.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -84.63 61.19 6.16 Favored 'Trans proline' 0 N--CA 1.425 -2.506 1 C-N-CA 128.773 6.315 . . . . 0.0 107.568 178.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . 0.306 73.7 mm-40 . . . . . 0 C--O 1.265 1.91 0 N-CA-C 118.098 2.629 . . . . 0.0 118.098 -170.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.389 0.2 OUTLIER . . . . . 0 N--CA 1.52 3.052 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -156.39 158.27 37.05 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 104.481 -2.414 . . . . 0.0 104.481 -166.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 60.5 p -61.85 -24.04 66.65 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 117.695 -1.602 . . . . 0.0 113.423 -167.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . 0.262 23.6 pt-20 -78.58 -15.73 58.22 Favored 'General case' 0 C--N 1.371 1.533 0 CA-C-N 121.583 1.992 . . . . 0.0 115.202 178.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.41 0.1 OUTLIER -76.14 -10.72 59.64 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 121.338 3.829 . . . . 0.0 121.338 166.188 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 10.1 m -127.14 -1.97 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.93 0 O-C-N 120.917 -1.115 . . . . 0.0 111.686 -164.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -66.98 129.83 93.98 Favored Pre-proline 0 CA--C 1.564 1.489 0 CA-C-N 122.36 2.346 . . . . 0.0 116.135 177.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -62.12 149.81 89.06 Favored 'Trans proline' 0 CA--C 1.49 -1.716 0 C-N-CA 121.366 1.377 . . . . 0.0 108.64 168.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . 0.266 52.2 Cg_exo -50.26 147.6 15.76 Favored 'Trans proline' 0 C--O 1.26 1.604 0 CA-C-O 113.928 -2.613 . . . . 0.0 115.581 172.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -59.62 147.24 92.71 Favored 'Trans proline' 0 C--N 1.386 2.541 0 N-CA-C 105.986 -2.352 . . . . 0.0 105.986 176.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -64.77 114.22 2.67 Favored 'Trans proline' 0 CA--C 1.577 2.657 0 C-N-CA 122.688 2.259 . . . . 0.0 112.319 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -66.62 -9.94 40.71 Favored 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 113.92 -1.491 . . . . 0.0 114.286 -177.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 30.3 tp60 -50.47 -35.94 31.24 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 167.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 25.7 tp -60.16 -58.38 8.76 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 128.656 2.782 . . . . 0.0 111.85 173.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 21.6 m80 -60.48 -51.42 69.54 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.542 1.137 . . . . 0.0 114.027 177.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 13.4 t80 -54.98 -48.59 73.07 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 111.327 -2.669 . . . . 0.0 116.655 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . 0.27 61.0 ttp -75.66 -37.49 59.57 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 128.434 2.693 . . . . 0.0 112.634 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.519 83.5 t80 -44.57 -58.84 2.77 Favored 'General case' 0 N--CA 1.437 -1.094 1 N-CA-C 122.521 4.267 . . . . 0.0 122.521 157.218 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 61.8 t -79.1 -36.77 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-N 113.005 -1.907 . . . . 0.0 108.298 -172.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -56.76 -47.69 79.52 Favored 'General case' 0 CA--C 1.578 2.049 0 O-C-N 121.257 -0.902 . . . . 0.0 111.904 176.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -76.38 -39.29 54.16 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 116.012 -1.947 . . . . 0.0 106.395 -179.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -56.71 -40.45 75.69 Favored 'General case' 0 C--O 1.264 1.864 0 CA-C-N 121.448 1.931 . . . . 0.0 112.091 172.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -74.39 -39.49 62.66 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.957 0.903 . . . . 0.0 109.431 -174.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 1.6 t80 -70.32 -37.75 74.8 Favored 'General case' 0 C--N 1.349 0.574 0 O-C-N 118.135 -2.853 . . . . 0.0 115.299 174.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 85.8 t -78.57 -41.58 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.93 0 O-C-N 127.734 3.147 . . . . 0.0 108.933 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.46 -37.53 87.12 Favored 'General case' 0 CA--C 1.581 2.17 0 CA-C-O 116.353 -1.784 . . . . 0.0 109.132 -175.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 26.1 tp -81.9 -46.77 13.62 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 103.864 -2.643 . . . . 0.0 103.864 -167.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . . 85.0 t80 -60.33 -45.8 92.15 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 118.582 2.808 . . . . 0.0 118.582 163.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.336 44.0 t80 -63.04 -31.85 73.09 Favored 'General case' 0 C--O 1.196 -1.758 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 174.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 7.5 t -78.62 -39.26 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 -176.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -73.0 -35.46 57.83 Favored Glycine 0 C--O 1.25 1.101 0 N-CA-C 108.958 -1.657 . . . . 0.0 108.958 -176.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 41.8 t -65.18 -45.62 84.14 Favored 'General case' 0 N--CA 1.487 1.42 1 C-N-CA 131.843 4.057 . . . . 0.0 106.975 172.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -79.38 -27.86 54.07 Favored Glycine 1 N--CA 1.392 -4.255 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 -165.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . 0.31 2.1 p -76.4 -30.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.784 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -179.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 1.3 pp -94.94 -16.7 22.61 Favored 'General case' 0 C--N 1.386 2.196 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 173.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 86.1 mt -77.19 -23.89 51.44 Favored 'General case' 0 C--N 1.384 2.068 0 CA-C-O 114.404 -2.713 . . . . 0.0 110.829 158.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 9.1 t -38.67 -50.12 1.61 Allowed 'General case' 0 C--O 1.273 2.3 0 CA-C-N 123.536 2.88 . . . . 0.0 116.358 -174.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 19.1 ttt-85 -79.02 -66.46 0.86 Allowed 'General case' 0 CA--C 1.553 1.071 0 O-C-N 125.929 2.018 . . . . 0.0 110.646 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1759 ' ' LYS . . . . . 0.614 ' HG3' ' H ' ' A' 1760 ' ' ARG . 15.9 pttt -167.23 -60.21 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.017 1 C-N-CA 132.01 4.124 . . . . 0.0 117.202 166.167 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1760 ' ' ARG . . . . . 0.614 ' H ' ' HG3' ' A' 1759 ' ' LYS . 34.9 ttt85 56.13 -14.83 0.01 OUTLIER 'General case' 0 C--N 1.379 1.872 0 N-CA-C 119.679 3.214 . . . . 0.0 119.679 -174.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 62.58 78.73 0.28 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.655 1.982 . . . . 0.0 115.191 162.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1762 ' ' ARG . . . . . 0.474 ' HA ' ' HB3' ' A' 1766 ' ' GLN . 29.8 mtp180 -119.7 56.7 0.93 Allowed 'General case' 0 N--CA 1.414 -2.263 0 C-N-CA 131.271 3.828 . . . . 0.0 112.997 169.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -140.03 149.49 43.24 Favored 'General case' 0 C--O 1.184 -2.351 0 CA-C-N 112.367 -2.197 . . . . 0.0 107.437 165.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.255 8.9 m80 56.85 -81.25 0.01 OUTLIER 'General case' 0 CA--C 1.574 1.878 0 O-C-N 126.693 2.495 . . . . 0.0 114.542 -176.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -63.74 -3.02 6.92 Favored Glycine 0 C--N 1.388 3.471 0 O-C-N 118.092 -2.88 . . . . 0.0 117.679 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1766 ' ' GLN . . . . . 0.474 ' HB3' ' HA ' ' A' 1762 ' ' ARG . 2.4 tp60 -144.26 31.21 1.24 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 128.025 2.53 . . . . 0.0 109.136 172.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 12.1 tp -74.9 51.75 0.51 Allowed 'General case' 0 CA--C 1.578 2.055 0 O-C-N 118.102 -2.874 . . . . 0.0 112.694 -171.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.431 2.7 t90 64.24 -39.37 0.23 Allowed 'General case' 0 C--O 1.262 1.743 1 O-C-N 115.458 -4.526 . . . . 0.0 116.775 -158.183 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 78.4 t80 -109.38 109.56 60.23 Favored Pre-proline 0 N--CA 1.433 -1.322 0 C-N-CA 128.902 2.881 . . . . 0.0 106.129 173.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -80.49 130.5 7.96 Favored 'Trans proline' 0 N--CA 1.443 -1.475 0 CA-C-O 121.351 0.48 . . . . 0.0 112.093 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 53.9 tt0 . . . . . 0 C--O 1.295 3.482 0 CA-C-O 113.753 -3.022 . . . . 0.0 112.026 -174.789 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.273 2.34 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 28.8 mp0 -146.84 -33.08 0.3 Allowed 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 116.653 -1.641 . . . . 0.0 114.673 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 27.7 t -80.9 118.64 22.58 Favored 'General case' 0 N--CA 1.427 -1.601 0 O-C-N 126.89 2.619 . . . . 0.0 111.181 175.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -49.62 -35.13 20.01 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.679 -1.263 . . . . 0.0 110.488 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 8.3 m -62.0 -13.21 23.55 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -176.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 1.9 m -140.0 32.75 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.259 1.59 0 O-C-N 119.106 -2.246 . . . . 0.0 109.188 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -80.41 114.13 44.92 Favored Pre-proline 0 CA--C 1.607 3.16 0 O-C-N 118.752 -2.467 . . . . 0.0 115.135 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . 0.321 4.9 Cg_exo -72.2 159.64 49.23 Favored 'Trans proline' 0 C--O 1.279 2.537 0 C-N-CA 121.702 1.602 . . . . 0.0 112.371 -175.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -65.63 163.47 30.09 Favored 'Trans proline' 0 CA--C 1.567 2.138 0 C-N-CA 122.059 1.839 . . . . 0.0 109.093 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -73.68 160.76 43.33 Favored 'Trans proline' 0 CA--C 1.556 1.605 0 C-N-CA 123.816 3.01 . . . . 0.0 112.77 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -81.34 152.23 17.98 Favored 'Trans proline' 0 N--CA 1.521 3.137 0 C-N-CA 124.687 3.591 . . . . 0.0 110.865 -172.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -61.48 -14.46 29.05 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 116.465 2.024 . . . . 0.0 116.465 177.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -58.17 -27.9 64.25 Favored 'General case' 0 CA--C 1.615 3.462 0 C-N-CA 128.336 2.655 . . . . 0.0 106.135 177.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 6.4 mt -81.46 -81.25 0.14 Allowed 'General case' 0 C--N 1.36 1.03 0 CA-C-N 120.097 1.317 . . . . 0.0 109.34 171.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 63.4 m80 -55.12 -58.45 7.6 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 116.452 -1.737 . . . . 0.0 109.678 -168.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . 0.356 52.8 t80 -60.5 -42.32 96.13 Favored 'General case' 0 CA--C 1.485 -1.528 0 O-C-N 125.964 2.04 . . . . 0.0 113.664 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 11.7 ttp -65.72 -38.03 88.05 Favored 'General case' 0 C--N 1.387 2.22 0 C-N-CA 113.673 -3.211 . . . . 0.0 113.578 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.525 12.2 t80 -47.73 -50.7 24.5 Favored 'General case' 0 C--O 1.25 1.123 0 N-CA-C 120.323 3.453 . . . . 0.0 120.323 169.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 96.8 t -73.83 -38.0 49.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 O-C-N 119.446 -2.034 . . . . 0.0 111.591 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -64.77 -42.85 94.8 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-O 122.849 1.309 . . . . 0.0 111.986 -178.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -71.51 -49.47 40.72 Favored 'General case' 0 N--CA 1.438 -1.036 0 C-N-CA 128.525 2.73 . . . . 0.0 109.425 178.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.48 81.04 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.576 -1.25 . . . . 0.0 112.627 176.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -70.39 -38.78 74.76 Favored 'General case' 0 N--CA 1.418 -2.069 0 O-C-N 117.246 -3.409 . . . . 0.0 111.612 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 35.2 t80 -65.69 -48.7 71.15 Favored 'General case' 0 C--N 1.376 1.744 0 C-N-CA 126.312 1.845 . . . . 0.0 110.826 173.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 63.0 t -72.56 -30.31 33.65 Favored 'Isoleucine or valine' 0 CA--C 1.446 -3.046 0 CA-C-N 119.639 1.109 . . . . 0.0 111.519 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 45.8 tp -69.56 -44.19 71.37 Favored 'General case' 0 C--N 1.296 -1.728 1 O-C-N 114.956 -4.84 . . . . 0.0 111.272 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 53.4 tp -74.32 -40.29 62.32 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 128.482 2.713 . . . . 0.0 108.024 -176.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.302 38.9 t80 -55.36 -52.17 64.41 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 117.272 2.323 . . . . 0.0 117.272 160.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.324 2.4 t80 -70.4 -28.33 64.99 Favored 'General case' 0 C--N 1.401 2.839 0 C-N-CA 117.139 -1.824 . . . . 0.0 113.381 -169.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 23.3 t -83.21 -46.72 18.62 Favored 'Isoleucine or valine' 0 C--O 1.172 -2.988 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.32 175.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -64.45 -52.67 41.35 Favored Glycine 0 CA--C 1.558 2.74 0 CA-C-N 121.441 1.928 . . . . 0.0 113.697 -176.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 42.6 t -70.0 -34.83 73.83 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-O 113.048 -3.358 . . . . 0.0 107.182 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -61.28 -34.83 89.63 Favored Glycine 0 C--O 1.265 2.037 0 O-C-N 125.575 1.797 . . . . 0.0 112.678 174.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -74.28 -33.12 33.38 Favored 'Isoleucine or valine' 0 C--O 1.266 1.962 0 CA-C-N 120.429 2.114 . . . . 0.0 108.036 -168.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 1.3 pp -93.95 -26.49 16.82 Favored 'General case' 0 N--CA 1.428 -1.541 0 O-C-N 119.94 -1.725 . . . . 0.0 114.599 172.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 9.8 tp -64.47 -31.67 72.97 Favored 'General case' 0 N--CA 1.524 3.241 0 CA-C-N 121.184 1.811 . . . . 0.0 109.424 171.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 59.9 p -65.46 -31.17 72.11 Favored 'General case' 0 C--O 1.2 -1.531 0 N-CA-C 117.864 2.542 . . . . 0.0 117.864 -170.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -61.41 -42.38 98.65 Favored 'General case' 0 C--O 1.257 1.482 1 O-C-N 115.265 -4.647 . . . . 0.0 110.426 -172.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 12.7 ptmt -169.55 -17.3 0.02 OUTLIER 'General case' 0 C--N 1.365 1.242 0 C-N-CA 128.998 2.919 . . . . 0.0 114.962 162.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -56.11 -10.55 0.86 Allowed 'General case' 0 N--CA 1.505 2.292 0 CA-C-N 124.412 3.278 . . . . 0.0 118.632 -165.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -51.84 135.35 30.03 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 118.839 -2.413 . . . . 0.0 107.913 167.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -134.64 -75.33 0.46 Allowed 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 114.669 -2.586 . . . . 0.0 108.896 169.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1763 ' ' GLN . . . . . 0.432 ' HB3' ' H ' ' A' 1764 ' ' HIS 0.28 17.0 mp0 61.49 -155.69 0.35 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 128.627 3.705 . . . . 0.0 113.915 168.376 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1764 ' ' HIS . . . . . 0.432 ' H ' ' HB3' ' A' 1763 ' ' GLN . 55.2 m80 36.91 -86.39 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 CA-C-O 114.17 -2.824 . . . . 0.0 113.324 169.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -67.51 5.0 3.41 Favored Glycine 0 C--O 1.198 -2.112 0 CA-C-N 122.815 2.552 . . . . 0.0 115.305 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -145.87 26.24 1.25 Allowed 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 128.179 2.591 . . . . 0.0 107.771 -171.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 40.9 tp -89.21 57.42 4.04 Favored 'General case' 0 C--O 1.19 -2.048 0 O-C-N 120.103 -1.623 . . . . 0.0 111.335 -170.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.433 6.5 p90 58.69 -44.52 0.06 Allowed 'General case' 0 C--N 1.372 1.572 0 C-N-CA 130.607 3.563 . . . . 0.0 115.349 -159.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -84.87 128.44 60.59 Favored Pre-proline 0 C--N 1.314 -0.96 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 169.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . 0.277 0.5 OUTLIER -80.56 55.01 5.49 Favored 'Trans proline' 0 CA--C 1.582 2.881 1 C-N-CA 126.737 4.958 . . . . 0.0 111.716 179.631 . . . . . . . . 4 3 . 1 . 009 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 47.9 tp10 . . . . . 0 N--CA 1.506 2.367 0 CA-C-N 120.157 1.344 . . . . 0.0 113.09 -168.469 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.474 2.3 t . . . . . 0 N--CA 1.502 2.164 0 CA-C-O 123.023 1.392 . . . . 0.0 112.89 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.77 159.2 42.71 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 112.191 -2.277 . . . . 0.0 106.657 -176.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 13.1 t -62.18 -29.05 70.1 Favored 'General case' 0 C--O 1.267 2.002 0 N-CA-C 119.245 3.054 . . . . 0.0 119.245 163.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.0 -5.32 43.36 Favored 'General case' 0 C--O 1.196 -1.741 0 CA-C-N 112.81 -1.996 . . . . 0.0 114.278 -176.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.476 0.2 OUTLIER -81.51 -49.12 10.96 Favored 'General case' 0 C--O 1.253 1.243 0 N-CA-C 117.3 2.333 . . . . 0.0 117.3 168.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 7.5 p -101.97 56.01 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.537 3.88 0 CA-C-O 124.446 2.07 . . . . 0.0 111.578 -176.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -130.04 127.1 22.63 Favored Pre-proline 0 CA--C 1.56 1.335 0 CA-C-O 114.128 -2.844 . . . . 0.0 108.587 174.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.11 157.47 50.6 Favored 'Trans proline' 0 CA--C 1.493 -1.569 0 O-C-N 127.261 3.242 . . . . 0.0 108.823 176.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.78 162.92 14.54 Favored 'Trans proline' 0 C--O 1.266 1.886 0 N-CA-C 115.441 1.285 . . . . 0.0 115.441 177.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1730 ' ' PRO . . . . . . . . . . . . 0.251 6.3 Cg_exo -64.21 164.86 21.27 Favored 'Trans proline' 0 CA--C 1.587 3.148 0 C-N-CA 121.451 1.434 . . . . 0.0 110.314 174.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -64.72 107.9 0.97 Allowed 'Trans proline' 0 N--CA 1.498 1.772 0 C-N-CA 124.336 3.357 . . . . 0.0 114.286 178.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -68.86 -9.13 49.76 Favored 'General case' 0 N--CA 1.399 -3.017 0 CA-C-N 121.496 1.953 . . . . 0.0 110.904 175.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -45.32 -32.41 2.01 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 127.482 2.313 . . . . 0.0 112.533 169.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 1.4 mt -78.23 -48.9 14.8 Favored 'General case' 0 C--O 1.27 2.151 0 O-C-N 121.192 -0.942 . . . . 0.0 108.499 -176.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 50.4 m80 -74.95 -52.15 11.9 Favored 'General case' 0 N--CA 1.496 1.871 0 C-N-CA 126.749 2.019 . . . . 0.0 112.581 -177.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 18.1 t80 -56.23 -39.38 72.44 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 175.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1737 ' ' MET . . . . . . . . . . . . 0.27 2.3 ttp -80.21 -40.43 27.14 Favored 'General case' 0 CA--C 1.571 1.773 0 CA-C-O 123.686 1.708 . . . . 0.0 113.716 175.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.258 3.6 t80 -54.97 -37.77 66.92 Favored 'General case' 0 N--CA 1.414 -2.263 0 O-C-N 118.999 -2.313 . . . . 0.0 113.668 168.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1739 ' ' VAL . . . . . . . . . . . . 0.251 94.0 t -62.32 -67.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 CA-C-N 120.988 1.722 . . . . 0.0 110.58 167.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -48.13 -47.17 34.86 Favored 'General case' 0 C--O 1.277 2.507 0 N-CA-C 116.295 1.961 . . . . 0.0 116.295 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -76.14 -38.43 56.78 Favored 'General case' 0 CA--C 1.581 2.147 0 C-N-CA 127.851 2.46 . . . . 0.0 109.613 -177.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -72.69 -38.91 67.4 Favored 'General case' 0 C--O 1.194 -1.849 0 O-C-N 118.077 -2.89 . . . . 0.0 111.45 177.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -71.06 -36.95 72.48 Favored 'General case' 0 C--O 1.169 -3.148 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 173.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 85.9 t80 -67.52 -38.83 84.83 Favored 'General case' 0 N--CA 1.428 -1.55 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 13.6 t -79.12 -38.13 20.04 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.899 0 C-N-CA 117.523 -1.671 . . . . 0.0 106.636 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 52.3 mt -92.75 -40.92 10.41 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 116.652 -3.78 . . . . 0.0 112.538 -168.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 4.2 tp -73.69 -18.48 61.01 Favored 'General case' 0 C--N 1.375 1.683 0 C-N-CA 125.135 1.374 . . . . 0.0 110.574 175.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.522 1.4 t80 -81.63 -41.02 22.08 Favored 'General case' 0 CA--C 1.463 -2.394 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 156.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.575 64.5 t80 -63.06 -32.55 73.95 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 119.765 -1.835 . . . . 0.0 113.56 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 55.4 t -92.9 -41.04 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 115.54 -2.172 . . . . 0.0 110.439 175.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -68.1 -44.11 78.38 Favored Glycine 0 C--N 1.37 2.436 0 CA-C-N 124.385 3.266 . . . . 0.0 111.561 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 42.4 t -79.11 -39.96 32.33 Favored 'General case' 0 C--O 1.204 -1.314 0 CA-C-N 112.1 -2.05 . . . . 0.0 107.76 -177.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -76.1 -19.23 78.81 Favored Glycine 0 N--CA 1.41 -3.05 0 N-CA-C 117.266 1.666 . . . . 0.0 117.266 173.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 11.3 p -76.44 -34.61 25.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 1 CA-C-O 111.594 -4.05 . . . . 0.0 108.617 175.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 4.2 pp -87.47 -31.54 19.94 Favored 'General case' 0 C--O 1.206 -1.195 1 O-C-N 132.8 6.312 . . . . 0.0 113.911 178.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 6.2 tt -70.73 -20.85 62.61 Favored 'General case' 0 C--O 1.193 -1.909 0 N-CA-C 106.827 -1.545 . . . . 0.0 106.827 167.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1757 ' ' SER . . . . . . . . . . . . 0.289 1.6 m -64.48 -19.27 65.46 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-N 124.198 3.181 . . . . 0.0 114.003 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -74.75 -75.47 0.16 Allowed 'General case' 0 C--O 1.266 1.93 0 O-C-N 118.862 -2.399 . . . . 0.0 111.036 174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -166.12 100.87 0.64 Allowed 'General case' 0 N--CA 1.522 3.134 0 C-N-CA 126.529 1.932 . . . . 0.0 110.052 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 16.1 ttt85 -142.26 -0.02 1.3 Allowed 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 116.539 2.052 . . . . 0.0 116.539 173.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1761 ' ' ARG . . . . . 0.403 ' NH2' ' HA3' ' A' 1765 ' ' GLY . 0.1 OUTLIER 62.94 148.18 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 C-N-CA 129.001 2.92 . . . . 0.0 115.671 -179.018 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1762 ' ' ARG . . . . . . . . . . . . 0.262 8.3 ptm180 -141.91 14.35 2.09 Favored 'General case' 0 C--N 1.283 -2.298 0 C-N-CA 126.904 2.081 . . . . 0.0 113.442 -167.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -155.98 164.78 38.04 Favored 'General case' 0 CA--C 1.496 -1.132 0 C-N-CA 127.677 2.391 . . . . 0.0 107.156 -173.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 91.7 m-70 64.31 -81.98 0.03 OUTLIER 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 125.225 1.578 . . . . 0.0 110.073 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1765 ' ' GLY . . . . . 0.403 ' HA3' ' NH2' ' A' 1761 ' ' ARG . . . -72.83 19.63 1.18 Allowed Glycine 0 N--CA 1.483 1.826 0 C-N-CA 127.577 2.513 . . . . 0.0 117.241 176.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -160.57 2.75 0.07 Allowed 'General case' 0 C--N 1.362 1.152 0 C-N-CA 127.33 2.252 . . . . 0.0 111.284 -167.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.17 72.33 9.12 Favored 'General case' 0 N--CA 1.434 -1.273 0 CA-C-N 119.847 1.203 . . . . 0.0 113.112 -171.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 35.8 t-105 68.64 -36.08 0.31 Allowed 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 129.786 3.235 . . . . 0.0 115.043 -173.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -113.31 106.97 54.15 Favored Pre-proline 0 N--CA 1.415 -2.18 0 C-N-CA 128.876 2.87 . . . . 0.0 110.105 168.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -70.49 81.36 1.01 Allowed 'Trans proline' 0 N--CA 1.417 -2.989 0 C-N-CA 122.093 1.862 . . . . 0.0 115.597 -178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 87.8 tt0 . . . . . 0 CA--C 1.585 2.327 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -159.014 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 123.338 1.542 . . . . 0.0 112.245 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -82.71 137.08 34.55 Favored 'General case' 0 C--N 1.386 2.156 0 C-N-CA 126.681 1.993 . . . . 0.0 109.885 -162.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 52.9 p -53.11 -13.12 0.43 Allowed 'General case' 0 N--CA 1.523 3.216 0 O-C-N 118.163 -2.836 . . . . 0.0 117.861 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.99 -16.76 57.86 Favored 'General case' 0 C--N 1.391 2.39 0 O-C-N 116.57 -3.831 . . . . 0.0 113.891 175.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.417 5.1 t -133.9 -5.9 2.77 Favored 'General case' 0 C--O 1.274 2.372 0 C-N-CA 127.025 2.13 . . . . 0.0 112.252 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.06 -17.45 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.999 0 CA-C-N 121.973 2.169 . . . . 0.0 116.261 169.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -132.83 146.62 62.1 Favored Pre-proline 0 CA--C 1.609 3.228 0 CA-C-N 124.028 3.104 . . . . 0.0 111.714 167.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -87.78 149.19 7.23 Favored 'Trans proline' 0 N--CA 1.437 -1.798 0 CA-C-O 122.862 1.109 . . . . 0.0 114.683 152.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -59.53 165.85 8.86 Favored 'Trans proline' 0 CA--C 1.585 3.05 0 C-N-CA 125.299 4.0 . . . . 0.0 112.48 161.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -73.31 160.68 44.45 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 116.869 -1.621 . . . . 0.0 110.36 -171.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -62.13 110.57 1.04 Allowed 'Trans proline' 0 C--O 1.281 2.663 0 C-N-CA 122.164 1.91 . . . . 0.0 109.369 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . 0.326 . . -68.72 -7.39 33.17 Favored 'General case' 0 CA--C 1.584 2.261 1 O-C-N 114.515 -5.116 . . . . 0.0 111.567 172.542 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -63.43 -42.1 98.68 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-N 119.448 1.022 . . . . 0.0 112.798 165.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 8.2 mp -89.67 -52.45 5.0 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 -172.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.27 -43.93 79.27 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 117.797 2.517 . . . . 0.0 117.797 -176.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . 0.263 21.1 t80 -78.95 -35.49 43.16 Favored 'General case' 0 C--O 1.271 2.224 0 N-CA-C 104.594 -2.373 . . . . 0.0 104.594 -177.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 20.6 ttp -67.66 -29.21 68.44 Favored 'General case' 0 C--N 1.385 2.124 0 CA-C-N 120.642 1.565 . . . . 0.0 112.797 174.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.349 9.0 m-85 -56.62 -46.1 81.12 Favored 'General case' 0 N--CA 1.407 -2.593 0 CA-C-O 116.241 -1.838 . . . . 0.0 112.776 170.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 4.5 t -63.48 -41.11 91.53 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.66 0 CA-C-O 124.14 1.924 . . . . 0.0 112.927 176.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -63.23 -55.12 27.56 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 118.289 -2.757 . . . . 0.0 112.575 175.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -69.99 -48.12 59.46 Favored 'General case' 0 N--CA 1.413 -2.291 1 O-C-N 113.93 -5.482 . . . . 0.0 109.215 -174.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -51.76 -46.19 64.02 Favored 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 120.034 -1.666 . . . . 0.0 112.295 169.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -70.33 -32.77 70.64 Favored 'General case' 0 C--N 1.363 1.192 0 C-N-CA 116.263 -2.175 . . . . 0.0 110.184 -176.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 69.5 t80 -72.79 -40.56 65.79 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-O 124.281 1.991 . . . . 0.0 112.021 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 94.4 t -73.6 -40.5 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.732 0 CA-C-O 115.936 -1.983 . . . . 0.0 107.79 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 61.2 tp -63.01 -50.7 69.66 Favored 'General case' 0 N--CA 1.522 3.131 1 O-C-N 129.419 4.199 . . . . 0.0 106.17 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 13.6 tp -68.19 -35.0 77.32 Favored 'General case' 0 CA--C 1.573 1.857 0 C-N-CA 127.051 2.14 . . . . 0.0 108.212 -165.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.434 74.3 t80 -65.19 -52.57 54.03 Favored 'General case' 0 C--O 1.182 -2.448 0 CA-C-O 115.767 -2.064 . . . . 0.0 115.032 161.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . . 3.8 t80 -69.12 -22.51 63.96 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 115.59 -2.444 . . . . 0.0 115.489 -175.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 53.7 t -89.31 -44.48 15.24 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 O-C-N 116.484 -3.885 . . . . 0.0 109.393 176.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -64.22 -44.05 96.15 Favored Glycine 0 CA--C 1.57 3.521 0 CA-C-O 127.272 3.706 . . . . 0.0 112.004 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 9.1 t -71.77 -40.2 69.46 Favored 'General case' 0 CA--C 1.563 1.459 0 O-C-N 118.376 -2.838 . . . . 0.0 107.551 172.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -69.37 -26.45 74.56 Favored Glycine 0 C--O 1.216 -1.031 0 CA-C-O 122.517 1.065 . . . . 0.0 112.024 -171.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . 0.371 4.5 p -72.42 -48.81 45.95 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.843 0 O-C-N 120.155 -1.791 . . . . 0.0 108.802 -173.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 3.1 pp -76.11 -41.46 50.13 Favored 'General case' 0 CA--C 1.494 -1.188 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.697 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 16.4 mt -60.61 -20.16 59.87 Favored 'General case' 0 CA--C 1.501 -0.925 0 O-C-N 119.969 -1.707 . . . . 0.0 113.91 175.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 71.4 m -68.26 -11.3 59.17 Favored 'General case' 0 C--O 1.258 1.521 0 N-CA-C 117.401 2.371 . . . . 0.0 117.401 175.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -77.83 -63.62 1.34 Allowed 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 170.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1759 ' ' LYS . . . . . 0.415 ' HG3' ' H ' ' A' 1760 ' ' ARG 0.355 38.0 pttt -158.35 -102.47 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.581 0 C-N-CA 126.043 1.737 . . . . 0.0 109.765 171.844 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1760 ' ' ARG . . . . . 0.415 ' H ' ' HG3' ' A' 1759 ' ' LYS 0.263 11.7 tpp85 53.23 -51.44 0.01 OUTLIER 'General case' 0 C--O 1.189 -2.1 0 C-N-CA 131.219 3.808 . . . . 0.0 117.346 -177.208 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . 0.256 0.0 OUTLIER -67.4 56.88 0.05 Allowed 'General case' 0 N--CA 1.521 3.076 0 C-N-CA 127.539 2.336 . . . . 0.0 115.614 -169.197 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -64.7 -42.66 95.12 Favored 'General case' 0 CA--C 1.571 1.761 0 O-C-N 119.284 -2.135 . . . . 0.0 114.424 170.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 6.4 tm0? 53.91 -156.42 0.2 Allowed 'General case' 0 N--CA 1.522 3.173 0 O-C-N 125.515 1.759 . . . . 0.0 108.303 -166.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.26 52.9 t-80 36.03 -93.99 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.022 0 CA-C-O 117.725 -1.131 . . . . 0.0 113.017 -176.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -67.95 18.44 0.36 Allowed Glycine 0 CA--C 1.557 2.677 0 CA-C-O 124.652 2.251 . . . . 0.0 115.638 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -150.7 5.15 0.51 Allowed 'General case' 0 C--N 1.301 -1.53 0 O-C-N 117.253 -3.498 . . . . 0.0 108.319 -175.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 23.2 tp -73.78 73.81 1.57 Allowed 'General case' 0 CA--C 1.568 1.671 0 C-N-CA 130.948 3.699 . . . . 0.0 114.319 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 25.6 t-105 72.69 -65.42 0.36 Allowed 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 112.885 -1.961 . . . . 0.0 111.432 -178.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -70.93 135.94 85.22 Favored Pre-proline 0 C--N 1.378 1.81 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 152.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -81.2 102.95 1.39 Allowed 'Trans proline' 1 CA--C 1.625 5.069 0 O-C-N 126.819 3.01 . . . . 0.0 105.731 164.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 36.7 tp10 . . . . . 0 C--N 1.296 -1.724 1 CA-C-O 111.35 -4.166 . . . . 0.0 118.238 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.514 -0.41 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -109.18 -81.89 0.57 Allowed 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 115.253 -2.308 . . . . 0.0 110.7 -175.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 41.9 t -166.23 115.0 0.93 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 128.717 2.807 . . . . 0.0 109.541 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . 0.314 91.2 mt-10 65.71 -0.67 1.21 Allowed 'General case' 0 C--N 1.278 -2.529 0 CA-C-O 124.901 2.286 . . . . 0.0 116.652 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 11.3 p -81.84 -16.27 51.34 Favored 'General case' 0 C--N 1.289 -2.054 0 O-C-N 118.888 -2.383 . . . . 0.0 111.946 -167.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -140.28 11.38 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.583 2.216 0 CA-C-O 122.802 1.286 . . . . 0.0 112.824 -170.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -154.21 132.82 6.88 Favored Pre-proline 0 N--CA 1.485 1.321 0 C-N-CA 125.102 1.361 . . . . 0.0 108.419 175.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -60.15 143.21 99.55 Favored 'Trans proline' 0 C--O 1.28 2.576 0 C-N-CA 123.203 2.602 . . . . 0.0 114.723 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . 0.255 26.2 Cg_exo -46.71 156.84 0.57 Allowed 'Trans proline' 0 CA--C 1.551 1.334 0 C-N-CA 124.297 3.332 . . . . 0.0 113.101 157.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -58.13 152.32 53.02 Favored 'Trans proline' 0 N--CA 1.444 -1.405 1 C-N-CA 126.045 4.496 . . . . 0.0 111.419 176.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -64.33 158.59 48.1 Favored 'Trans proline' 0 CA--C 1.575 2.562 0 O-C-N 123.24 1.126 . . . . 0.0 114.385 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -62.21 -25.01 67.56 Favored 'General case' 0 C--O 1.183 -2.413 0 O-C-N 118.801 -2.437 . . . . 0.0 114.97 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -56.08 -24.79 42.34 Favored 'General case' 0 CA--C 1.562 1.435 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.28 -60.41 3.44 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 124.745 2.212 . . . . 0.0 105.721 169.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -67.56 -45.0 76.88 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 116.747 -3.721 . . . . 0.0 112.12 -173.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 27.2 t80 -70.51 -29.37 65.86 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-O 128.2 3.857 . . . . 0.0 113.341 -177.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 36.9 ttm -68.51 -49.4 59.97 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 118.064 -2.897 . . . . 0.0 112.171 164.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -54.02 -11.83 0.5 Allowed 'General case' 0 C--N 1.369 1.433 0 O-C-N 117.08 -3.513 . . . . 0.0 118.037 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 3.1 t -99.24 -63.31 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.184 -2.361 0 O-C-N 119.646 -1.909 . . . . 0.0 107.167 173.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -52.47 -50.35 62.85 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 117.975 2.583 . . . . 0.0 117.975 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -88.08 -24.67 23.36 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 114.742 -2.551 . . . . 0.0 106.56 -170.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . 0.287 . . -68.48 -47.18 67.74 Favored 'General case' 0 N--CA 1.413 -2.288 0 O-C-N 125.583 1.802 . . . . 0.0 109.903 172.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.87 77.81 Favored 'General case' 0 CA--C 1.454 -2.727 0 O-C-N 125.521 1.763 . . . . 0.0 115.168 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 26.7 t80 -63.13 -49.85 72.78 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-O 113.894 -2.955 . . . . 0.0 111.334 174.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 41.8 t -60.18 -42.86 91.71 Favored 'Isoleucine or valine' 0 C--N 1.375 1.69 1 O-C-N 129.591 4.307 . . . . 0.0 111.116 176.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 10.5 tp -73.27 -44.77 58.68 Favored 'General case' 0 C--N 1.355 0.836 1 O-C-N 115.957 -4.214 . . . . 0.0 110.552 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1747 ' ' LEU . . . . . . . . . . . . 0.304 65.9 tp -64.48 -37.88 89.07 Favored 'General case' 0 CA--C 1.575 1.909 0 CA-C-N 122.195 2.271 . . . . 0.0 110.873 -178.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.329 29.1 t80 -66.44 -41.49 89.07 Favored 'General case' 0 C--O 1.252 1.212 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 167.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.425 87.0 t80 -70.88 -29.41 65.5 Favored 'General case' 0 C--O 1.21 -0.985 0 C-N-CA 116.297 -2.161 . . . . 0.0 114.037 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 8.0 t -83.26 -50.82 15.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.636 176.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -58.85 -56.27 26.25 Favored Glycine 0 N--CA 1.414 -2.779 0 CA-C-O 125.088 2.493 . . . . 0.0 113.574 -168.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 52.6 t -80.9 -38.78 27.39 Favored 'General case' 0 C--N 1.378 1.824 0 CA-C-N 109.947 -3.126 . . . . 0.0 110.083 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -76.03 -17.65 79.91 Favored Glycine 0 N--CA 1.511 3.691 0 CA-C-O 115.452 -2.86 . . . . 0.0 108.393 -169.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 7.1 t -75.99 -52.61 17.43 Favored 'Isoleucine or valine' 0 C--N 1.353 0.719 0 CA-C-N 121.599 2.7 . . . . 0.0 106.517 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1755 ' ' LEU . . . . . . . . . . . . 0.276 2.4 pp -71.7 -27.33 62.95 Favored 'General case' 0 C--O 1.242 0.693 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 4.4 tt -76.99 -22.84 52.54 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 117.81 -1.09 . . . . 0.0 111.851 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 72.7 m -72.81 -36.93 67.65 Favored 'General case' 0 C--O 1.258 1.511 0 O-C-N 124.64 1.213 . . . . 0.0 111.197 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 21.6 ttt-85 -68.16 -52.33 35.81 Favored 'General case' 0 CA--C 1.506 -0.736 1 O-C-N 129.141 4.026 . . . . 0.0 108.544 -175.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 16.4 ptpt 162.13 125.05 0.0 OUTLIER 'General case' 0 N--CA 1.533 3.722 0 CA-C-N 112.787 -2.006 . . . . 0.0 110.087 158.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -170.33 -6.32 0.02 OUTLIER 'General case' 0 N--CA 1.524 3.275 0 N-CA-C 118.977 2.954 . . . . 0.0 118.977 -170.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 50.0 mtp85 -46.69 -59.02 3.29 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 119.534 -1.979 . . . . 0.0 108.047 -172.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1762 ' ' ARG . . . . . . . . . . . . 0.325 33.6 mmm-85 55.24 -103.93 0.2 Allowed 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 121.83 2.105 . . . . 0.0 115.694 170.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 62.89 -27.71 0.07 Allowed 'General case' 0 C--O 1.174 -2.894 1 C-N-CA 133.157 4.583 . . . . 0.0 115.286 174.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -78.07 -98.43 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.986 0 C-N-CA 128.782 2.833 . . . . 0.0 107.407 173.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -80.71 45.67 3.17 Favored Glycine 0 CA--C 1.469 -2.83 0 O-C-N 117.52 -3.237 . . . . 0.0 115.486 -171.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -160.09 -3.69 0.06 Allowed 'General case' 1 N--CA 1.543 4.189 0 O-C-N 118.689 -2.654 . . . . 0.0 112.436 -177.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.88 99.24 12.24 Favored 'General case' 0 CA--C 1.585 2.31 0 CA-C-O 123.989 1.852 . . . . 0.0 110.147 -168.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 20.3 t90 55.76 -54.52 0.02 OUTLIER 'General case' 0 N--CA 1.53 3.565 0 CA-C-O 116.198 -1.858 . . . . 0.0 115.907 -165.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -108.72 131.99 21.43 Favored Pre-proline 0 C--N 1.288 -2.098 0 C-N-CA 124.583 1.153 . . . . 0.0 111.599 165.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -85.09 60.74 5.71 Favored 'Trans proline' 0 N--CA 1.436 -1.905 0 C-N-CA 121.924 1.749 . . . . 0.0 116.01 -168.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 15.2 tp10 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 126.009 2.814 . . . . 0.0 113.028 -166.137 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.4 1.5 p . . . . . 0 CA--C 1.547 0.853 0 CA-C-O 124.217 1.961 . . . . 0.0 111.527 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.79 156.11 46.24 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 125.79 1.636 . . . . 0.0 110.768 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 64.4 m -54.7 143.93 23.59 Favored 'General case' 0 CA--C 1.582 2.204 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 162.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 61.6 tt0 61.7 -35.86 0.11 Allowed 'General case' 0 C--O 1.262 1.745 0 N-CA-C 118.25 2.685 . . . . 0.0 118.25 -169.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 1.3 p -70.59 -16.44 62.85 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-O 125.242 2.448 . . . . 0.0 115.8 171.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.302 0.5 OUTLIER -123.9 -36.86 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.401 2.833 0 O-C-N 118.685 -2.51 . . . . 0.0 116.316 176.276 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -107.22 100.85 35.39 Favored Pre-proline 0 C--O 1.27 2.137 0 N-CA-C 105.688 -1.968 . . . . 0.0 105.688 -170.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -89.71 153.16 5.13 Favored 'Trans proline' 0 C--O 1.248 1.009 0 C-N-CA 123.126 2.551 . . . . 0.0 112.922 -169.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -63.15 161.56 29.76 Favored 'Trans proline' 0 N--CA 1.438 -1.762 0 CA-C-O 113.82 -2.658 . . . . 0.0 117.248 174.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -70.63 160.06 50.7 Favored 'Trans proline' 0 C--O 1.284 2.803 1 C-N-CA 125.681 4.254 . . . . 0.0 112.411 171.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -76.63 128.12 10.02 Favored 'Trans proline' 0 CA--C 1.566 2.105 0 C-N-CA 121.928 1.752 . . . . 0.0 111.944 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -50.56 -26.24 5.04 Favored 'General case' 0 C--O 1.199 -1.584 0 CA-C-N 114.45 -1.25 . . . . 0.0 113.556 173.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -53.47 -23.79 11.18 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.183 1.393 . . . . 0.0 110.315 177.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 94.3 mt -79.12 -65.67 0.97 Allowed 'General case' 0 C--O 1.19 -2.049 0 CA-C-O 123.835 1.779 . . . . 0.0 113.735 173.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 72.2 t60 -70.35 -29.47 66.17 Favored 'General case' 0 CA--C 1.561 1.366 1 O-C-N 114.718 -4.989 . . . . 0.0 116.538 -176.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 2.7 t80 -75.47 -43.02 51.61 Favored 'General case' 0 CA--C 1.57 1.715 0 N-CA-C 103.465 -2.791 . . . . 0.0 103.465 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 43.0 ttm -70.13 -32.82 71.01 Favored 'General case' 0 C--O 1.186 -2.242 0 C-N-CA 116.054 -2.258 . . . . 0.0 114.771 169.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 11.5 t80 -49.61 -46.74 49.64 Favored 'General case' 0 CA--C 1.622 3.734 1 N-CA-C 122.228 4.159 . . . . 0.0 122.228 167.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 2.9 t -69.94 -39.65 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 CA-C-N 113.289 -1.778 . . . . 0.0 107.937 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -59.29 -48.92 79.8 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 127.515 3.531 . . . . 0.0 118.68 177.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . 0.276 . . -83.11 -40.15 20.19 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 112.093 -2.321 . . . . 0.0 113.85 -177.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -63.89 -33.21 75.18 Favored 'General case' 0 N--CA 1.403 -2.815 0 C-N-CA 116.688 -2.005 . . . . 0.0 112.491 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -74.88 -31.51 61.61 Favored 'General case' 0 C--N 1.384 2.076 0 O-C-N 117.916 -2.99 . . . . 0.0 106.281 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 9.3 t80 -75.22 -46.08 36.25 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 131.498 3.919 . . . . 0.0 111.667 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 88.4 t -64.18 -32.42 57.34 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-O 123.138 1.447 . . . . 0.0 110.026 170.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 36.4 tp -81.72 -37.6 27.05 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 118.377 -2.702 . . . . 0.0 106.557 -166.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 9.1 tt -85.13 -23.74 28.3 Favored 'General case' 0 C--O 1.249 1.047 0 O-C-N 118.594 -2.566 . . . . 0.0 108.078 -170.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1748 ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.02 -43.43 62.1 Favored 'General case' 0 CA--C 1.477 -1.856 0 N-CA-C 117.011 2.226 . . . . 0.0 117.011 155.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.288 1.2 t80 -65.86 -28.9 69.31 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 -178.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 90.1 t -89.99 -45.77 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 116.985 -1.483 . . . . 0.0 114.062 170.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -59.26 -49.53 77.53 Favored Glycine 0 C--O 1.255 1.451 0 CA-C-O 123.511 1.617 . . . . 0.0 113.411 -175.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 7.6 t -67.03 -49.06 66.43 Favored 'General case' 0 C--O 1.187 -2.189 0 C-N-CA 131.558 3.943 . . . . 0.0 111.244 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -75.26 -26.45 66.06 Favored Glycine 0 CA--C 1.472 -2.596 0 CA-C-O 115.768 -2.685 . . . . 0.0 111.886 -173.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . 0.415 0.3 OUTLIER -61.89 -45.37 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 CA-C-N 119.869 1.835 . . . . 0.0 112.327 171.635 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1755 ' ' LEU . . . . . 0.405 ' H ' ' HG ' ' A' 1755 ' ' LEU . 16.2 mt -73.32 -37.41 66.18 Favored 'General case' 0 C--O 1.245 0.819 0 O-C-N 118.468 -2.645 . . . . 0.0 105.307 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 19.4 tp -64.64 -21.54 66.75 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-O 123.933 1.825 . . . . 0.0 111.899 -177.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 9.1 t -54.27 -33.77 59.33 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 117.278 2.325 . . . . 0.0 117.278 -167.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -69.21 -6.67 30.48 Favored 'General case' 0 C--O 1.262 1.756 0 CA-C-O 127.637 3.589 . . . . 0.0 118.34 170.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 50.4 mttp -119.38 -23.41 6.69 Favored 'General case' 0 C--N 1.369 1.418 0 O-C-N 116.932 -3.605 . . . . 0.0 110.133 -176.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -47.06 -34.96 6.31 Favored 'General case' 0 N--CA 1.512 2.634 0 C-N-CA 129.117 2.967 . . . . 0.0 114.647 -173.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . 0.379 75.4 ttt180 -50.66 -22.8 2.22 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 124.428 2.061 . . . . 0.0 116.069 178.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -63.5 -54.83 30.11 Favored 'General case' 0 CA--C 1.477 -1.843 0 O-C-N 118.419 -2.676 . . . . 0.0 111.249 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 66.91 149.36 0.05 Allowed 'General case' 0 C--O 1.253 1.25 0 CA-C-N 122.462 2.392 . . . . 0.0 113.017 171.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 11.7 m170 63.1 -63.33 0.12 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 127.763 2.425 . . . . 0.0 114.36 -174.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1765 ' ' GLY . . . . . 0.526 ' HA2' ' H ' ' A' 1771 ' ' GLU . . . -76.51 44.88 2.03 Favored Glycine 0 N--CA 1.462 0.371 0 O-C-N 119.119 -2.238 . . . . 0.0 114.728 178.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -149.15 -7.91 0.35 Allowed 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 125.865 1.666 . . . . 0.0 108.371 173.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1767 ' ' LEU . . . . . . . . . . . . 0.258 23.9 tp -81.95 73.05 9.0 Favored 'General case' 0 N--CA 1.381 -3.886 0 C-N-CA 128.627 2.771 . . . . 0.0 112.394 -171.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.447 16.1 t90 71.51 -64.28 0.39 Allowed 'General case' 0 C--N 1.291 -1.957 0 CA-C-N 112.469 -2.15 . . . . 0.0 108.336 -163.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . 0.257 6.6 m-85 -86.92 139.25 32.76 Favored Pre-proline 0 N--CA 1.431 -1.418 0 C-N-CA 127.267 2.227 . . . . 0.0 113.593 -175.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -95.15 99.51 0.11 Allowed 'Trans proline' 1 N--CA 1.399 -4.079 0 N-CA-C 105.541 -2.523 . . . . 0.0 105.541 176.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1771 ' ' GLU . . . . . 0.526 ' H ' ' HA2' ' A' 1765 ' ' GLY . 40.3 tp10 . . . . . 0 N--CA 1.495 1.805 0 O-C-N 120.998 -1.064 . . . . 0.0 112.714 -175.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.264 8.5 p . . . . . 0 N--CA 1.499 2.022 0 CA-C-O 119.166 -0.445 . . . . 0.0 111.983 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . 0.426 12.3 mp0 -75.0 7.85 2.94 Favored 'General case' 0 C--O 1.195 -1.798 0 CA-C-O 127.095 3.331 . . . . 0.0 117.94 -159.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 60.31 6.36 1.02 Allowed 'General case' 0 N--CA 1.508 2.44 0 O-C-N 117.774 -3.079 . . . . 0.0 116.156 -174.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -80.82 18.67 0.95 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 118.148 -2.845 . . . . 0.0 115.999 171.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.396 1.7 m 52.49 28.48 5.99 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 174.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.533 0.2 OUTLIER 69.08 22.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 118.015 -2.928 . . . . 0.0 118.13 -176.439 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1727 ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' 1728 ' ' PRO . 15.4 tp10 -89.69 136.04 29.96 Favored Pre-proline 0 C--O 1.299 3.705 0 O-C-N 121.844 -0.535 . . . . 0.0 111.638 -175.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1728 ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' 1727 ' ' GLU . 40.9 Cg_exo -90.63 154.33 4.26 Favored 'Trans proline' 0 N--CA 1.52 3.034 0 C-N-CA 123.421 2.747 . . . . 0.0 107.618 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . 0.254 33.8 Cg_exo -70.52 146.56 55.85 Favored 'Trans proline' 0 CA--C 1.554 1.51 0 C-N-CA 121.555 1.504 . . . . 0.0 115.687 168.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -65.13 159.5 46.53 Favored 'Trans proline' 0 C--O 1.269 2.05 1 C-N-CA 125.756 4.304 . . . . 0.0 113.378 -176.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.85 158.85 52.04 Favored 'Trans proline' 0 N--CA 1.481 0.794 1 C-N-CA 126.867 5.044 . . . . 0.0 110.324 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.56 68.67 Favored 'General case' 0 CA--C 1.461 -2.447 0 O-C-N 119.872 -1.767 . . . . 0.0 114.615 168.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -41.45 -30.08 0.18 Allowed 'General case' 0 C--O 1.173 -2.956 0 CA-C-O 114.417 -2.706 . . . . 0.0 118.174 168.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 13.6 mt -75.9 -71.7 0.36 Allowed 'General case' 0 C--O 1.27 2.184 0 O-C-N 125.86 1.975 . . . . 0.0 110.715 165.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1735 ' ' HIS . . . . . 0.686 ' O ' HG23 ' A' 1739 ' ' VAL . 25.0 m80 -66.9 -48.61 68.16 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 127.347 2.259 . . . . 0.0 116.011 -170.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 30.8 t80 -76.92 -30.06 55.95 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 -175.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 8.8 ttp -74.5 -34.17 62.99 Favored 'General case' 0 C--O 1.275 2.424 0 C-N-CA 111.967 -3.893 . . . . 0.0 107.371 175.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.329 9.0 m-85 -55.4 -47.2 76.27 Favored 'General case' 0 CA--C 1.601 2.917 0 CA-C-N 119.065 0.848 . . . . 0.0 113.281 176.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1739 ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' 1735 ' ' HIS . 2.0 t -69.48 -35.17 65.44 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.562 0 CA-C-O 123.09 1.424 . . . . 0.0 112.114 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -69.12 -45.64 69.66 Favored 'General case' 0 CA--C 1.579 2.085 0 O-C-N 118.866 -2.396 . . . . 0.0 112.122 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -68.34 -51.32 45.83 Favored 'General case' 0 N--CA 1.53 3.525 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . 0.26 . . -59.01 -40.11 83.92 Favored 'General case' 0 C--O 1.271 2.191 0 CA-C-N 122.04 2.2 . . . . 0.0 115.258 176.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.7 95.1 Favored 'General case' 0 C--O 1.175 -2.836 0 CA-C-O 122.249 1.023 . . . . 0.0 111.562 -177.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 59.5 t80 -66.43 -44.62 82.39 Favored 'General case' 0 C--N 1.355 0.841 0 C-N-CA 131.355 3.862 . . . . 0.0 111.089 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 40.9 t -85.8 -26.92 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.643 0 CA-C-O 114.677 -2.582 . . . . 0.0 109.537 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 56.2 tp -71.72 -37.88 70.56 Favored 'General case' 0 C--O 1.261 1.667 0 C-N-CA 115.887 -2.325 . . . . 0.0 115.139 171.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 13.1 tp -74.64 -32.95 62.44 Favored 'General case' 0 C--O 1.239 0.535 0 O-C-N 120.473 -1.392 . . . . 0.0 113.626 -178.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.426 51.5 t80 -65.58 -50.22 65.93 Favored 'General case' 0 C--O 1.257 1.481 0 N-CA-C 118.01 2.596 . . . . 0.0 118.01 162.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.353 57.0 m-85 -77.58 -24.87 49.66 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -177.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 63.2 t -81.54 -51.77 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.867 0 CA-C-O 114.96 -2.447 . . . . 0.0 108.907 172.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -62.04 -41.69 99.69 Favored Glycine 1 CA--C 1.595 5.064 0 CA-C-N 124.637 3.381 . . . . 0.0 114.519 -174.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1752 ' ' CYS . . . . . . . . . . . . 0.327 9.0 t -68.56 -30.7 69.53 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 171.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -72.93 -25.4 73.87 Favored Glycine 0 CA--C 1.543 1.817 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -173.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 69.3 t -67.46 -44.19 86.95 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.427 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.92 -23.27 18.81 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 116.776 2.139 . . . . 0.0 116.776 -172.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 26.7 tp -74.06 -27.72 61.05 Favored 'General case' 0 CA--C 1.59 2.499 0 CA-C-N 113.839 -1.528 . . . . 0.0 112.673 168.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 1.1 t -62.82 -38.04 89.16 Favored 'General case' 0 C--O 1.278 2.57 0 CA-C-N 112.689 -2.051 . . . . 0.0 109.562 171.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 11.0 mtt85 -74.48 -66.7 0.7 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 119.027 -2.296 . . . . 0.0 113.267 164.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1759 ' ' LYS . . . . . . . . . . . . 0.324 16.2 pttm -150.93 -99.41 0.06 Allowed 'General case' 0 CA--C 1.47 -2.114 0 C-N-CA 127.688 2.395 . . . . 0.0 114.289 -170.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1760 ' ' ARG . . . . . . . . . . . . 0.364 14.0 ttm180 58.44 -45.65 0.06 Allowed 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -173.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . 0.274 19.5 ttm-85 -142.45 -73.89 0.3 Allowed 'General case' 0 CA--C 1.565 1.556 0 O-C-N 125.827 1.955 . . . . 0.0 113.365 169.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1762 ' ' ARG . . . . . . . . . . . . 0.263 55.9 mtp85 52.26 65.65 1.44 Allowed 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 124.764 1.225 . . . . 0.0 112.904 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -128.93 38.86 3.88 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 125.406 1.482 . . . . 0.0 114.607 -176.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.346 10.8 m-70 64.99 -49.72 0.34 Allowed 'General case' 0 C--N 1.357 0.93 0 C-N-CA 126.654 1.982 . . . . 0.0 113.837 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -67.25 30.74 0.2 Allowed Glycine 0 CA--C 1.474 -2.521 0 O-C-N 116.68 -3.762 . . . . 0.0 117.689 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1766 ' ' GLN . . . . . 0.46 ' H ' ' H ' ' A' 1767 ' ' LEU . 11.1 tt0 -166.12 4.8 0.03 OUTLIER 'General case' 0 C--N 1.359 0.986 0 C-N-CA 126.687 1.995 . . . . 0.0 109.176 -174.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1767 ' ' LEU . . . . . 0.46 ' H ' ' H ' ' A' 1766 ' ' GLN . 11.3 tp -82.84 67.87 9.09 Favored 'General case' 0 C--O 1.188 -2.159 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.862 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 75.6 m95 59.31 -48.88 0.07 Allowed 'General case' 0 CA--C 1.597 2.781 0 C-N-CA 130.328 3.451 . . . . 0.0 115.646 -165.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -84.1 125.81 71.59 Favored Pre-proline 0 C--N 1.297 -1.696 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -87.94 43.09 0.8 Allowed 'Trans proline' 0 N--CA 1.487 1.121 0 CA-C-N 121.656 1.627 . . . . 0.0 113.317 -169.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 . . . . . 0 N--CA 1.529 3.502 0 CA-C-O 116.267 -1.825 . . . . 0.0 113.593 -163.478 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.291 3.26 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -150.5 157.37 42.94 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.941 2.097 . . . . 0.0 111.511 -158.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 75.0 p -69.24 -0.29 5.9 Favored 'General case' 0 N--CA 1.507 2.396 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -76.76 -18.12 58.64 Favored 'General case' 0 C--N 1.29 -1.982 0 O-C-N 119.759 -1.838 . . . . 0.0 112.744 -175.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.339 1.4 m 61.46 32.01 18.95 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.616 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.383 0.3 OUTLIER 73.16 14.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.494 -1.192 0 CA-C-O 122.443 1.116 . . . . 0.0 113.89 -174.872 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -71.95 131.69 85.4 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 117.722 -3.111 . . . . 0.0 109.947 170.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.19 147.96 49.04 Favored 'Trans proline' 0 N--CA 1.526 3.409 0 C-N-CA 122.901 2.401 . . . . 0.0 116.145 170.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -43.09 140.84 3.15 Favored 'Trans proline' 0 N--CA 1.499 1.806 1 C-N-CA 126.828 5.018 . . . . 0.0 111.576 -178.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -56.85 145.09 85.82 Favored 'Trans proline' 0 CA--C 1.592 3.423 0 CA-C-N 124.605 2.68 . . . . 0.0 118.016 176.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.34 160.66 15.9 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 123.828 3.018 . . . . 0.0 111.649 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -63.34 -18.72 63.95 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.254 1.821 . . . . 0.0 113.555 171.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -49.83 -22.54 1.49 Allowed 'General case' 0 C--O 1.21 -0.997 1 O-C-N 116.237 -4.04 . . . . 0.0 116.179 160.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 12.7 tp -80.99 -77.29 0.21 Allowed 'General case' 0 C--N 1.397 2.663 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 170.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 31.7 m80 -71.29 -57.45 4.46 Favored 'General case' 0 CA--C 1.597 2.775 0 C-N-CA 130.026 3.33 . . . . 0.0 111.375 -165.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 2.9 t80 -57.93 -40.45 80.49 Favored 'General case' 0 CA--C 1.491 -1.321 0 CA-C-O 116.001 -1.952 . . . . 0.0 111.507 173.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . 0.269 16.5 ttp -65.24 -39.52 92.8 Favored 'General case' 0 N--CA 1.527 3.386 0 C-N-CA 116.727 -1.989 . . . . 0.0 113.068 174.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 67.6 t80 -55.29 -46.3 76.21 Favored 'General case' 0 C--N 1.364 1.201 0 N-CA-C 117.22 2.304 . . . . 0.0 117.22 176.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 83.5 t -59.12 -54.34 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 O-C-N 118.241 -2.787 . . . . 0.0 106.911 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -57.3 -51.4 69.54 Favored 'General case' 0 C--O 1.26 1.617 0 O-C-N 125.702 1.876 . . . . 0.0 114.857 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -70.1 -49.22 53.12 Favored 'General case' 0 C--O 1.186 -2.275 0 O-C-N 119.499 -2.001 . . . . 0.0 108.498 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -61.06 -32.95 72.58 Favored 'General case' 0 C--O 1.195 -1.768 1 O-C-N 116.205 -4.06 . . . . 0.0 114.397 171.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -71.16 -37.02 72.24 Favored 'General case' 0 CA--C 1.478 -1.817 0 O-C-N 124.779 1.299 . . . . 0.0 110.983 -176.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 2.4 t80 -70.33 -44.88 67.31 Favored 'General case' 0 CA--C 1.477 -1.842 0 C-N-CA 129.608 3.163 . . . . 0.0 111.673 175.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 7.9 t -62.25 -45.98 97.5 Favored 'Isoleucine or valine' 0 C--O 1.246 0.892 0 N-CA-C 105.399 -2.074 . . . . 0.0 105.399 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 20.1 tp -57.1 -53.64 55.79 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 117.14 2.274 . . . . 0.0 117.14 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 28.2 tp -64.02 -39.28 93.75 Favored 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 129.255 3.022 . . . . 0.0 110.2 -173.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.479 60.7 t80 -71.25 -35.68 71.5 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 117.706 2.484 . . . . 0.0 117.706 167.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.585 16.0 t80 -64.52 -44.54 90.55 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 175.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 53.9 t -86.4 -36.03 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.427 0 O-C-N 127.672 3.107 . . . . 0.0 110.396 -168.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -76.06 -39.07 33.48 Favored Glycine 0 CA--C 1.575 3.799 0 C-N-CA 114.405 -3.76 . . . . 0.0 111.219 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 50.8 t -62.56 -45.0 94.95 Favored 'General case' 0 CA--C 1.601 2.918 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 167.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -57.27 -16.88 22.2 Favored Glycine 1 CA--C 1.604 5.624 0 C-N-CA 125.232 1.396 . . . . 0.0 112.725 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 37.1 t -59.99 -52.96 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.41 0 O-C-N 119.135 -2.391 . . . . 0.0 109.639 172.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1755 ' ' LEU . . . . . 0.5 HD12 ' N ' ' A' 1756 ' ' LEU . 3.8 pp -95.97 -35.85 11.27 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 112.873 -1.967 . . . . 0.0 115.003 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1756 ' ' LEU . . . . . 0.5 ' N ' HD12 ' A' 1755 ' ' LEU . 11.6 tp -64.19 -22.61 67.01 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 170.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 12.3 t -46.95 -40.72 14.85 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 167.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1758 ' ' ARG . . . . . . . . . . . . 0.276 7.2 tpt180 -74.29 -67.28 0.63 Allowed 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 112.817 -3.468 . . . . 0.0 107.867 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1759 ' ' LYS . . . . . 0.474 ' HG3' ' H ' ' A' 1760 ' ' ARG . 2.6 ptpt -177.71 -69.42 0.01 OUTLIER 'General case' 0 C--N 1.376 1.735 0 O-C-N 128.606 3.691 . . . . 0.0 110.961 168.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1760 ' ' ARG . . . . . 0.474 ' H ' ' HG3' ' A' 1759 ' ' LYS 0.25 43.5 ttt85 50.59 -42.23 0.01 OUTLIER 'General case' 0 C--N 1.391 2.38 0 N-CA-C 118.486 2.772 . . . . 0.0 118.486 -171.307 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.6 -100.43 0.37 Allowed 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 177.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 55.18 31.51 16.57 Favored 'General case' 0 C--O 1.273 2.329 1 O-C-N 114.923 -4.861 . . . . 0.0 114.462 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 11.4 pm0 -81.09 49.79 1.3 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 117.115 -3.49 . . . . 0.0 110.408 176.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.39 36.7 m80 64.21 -176.32 0.16 Allowed 'General case' 0 N--CA 1.483 1.203 0 O-C-N 119.13 -2.231 . . . . 0.0 110.009 -164.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . 67.32 -10.96 0.83 Allowed Glycine 1 N--CA 1.536 5.361 0 O-C-N 116.863 -3.648 . . . . 0.0 113.314 -177.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -150.17 15.76 0.82 Allowed 'General case' 0 C--O 1.193 -1.887 0 C-N-CA 127.269 2.228 . . . . 0.0 107.127 -154.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1767 ' ' LEU . . . . . . . . . . . . 0.26 25.9 tp -101.18 66.05 1.11 Allowed 'General case' 0 CA--C 1.601 2.925 0 CA-C-O 127.826 3.679 . . . . 0.0 106.046 -165.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.409 47.0 t-105 76.8 -63.51 0.37 Allowed 'General case' 0 N--CA 1.419 -1.976 0 C-N-CA 128.617 2.767 . . . . 0.0 111.581 -176.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . 0.411 20.2 m-85 -74.22 147.03 85.2 Favored Pre-proline 0 C--O 1.268 2.034 0 CA-C-N 112.879 -1.964 . . . . 0.0 112.042 158.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.58 112.88 3.62 Favored 'Trans proline' 0 CA--C 1.572 2.38 0 C-N-CA 124.896 3.731 . . . . 0.0 106.883 152.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1771 ' ' GLU . . . . . . . . . . . . 0.337 9.0 tm-20 . . . . . 0 C--O 1.267 1.988 1 O-C-N 130.124 4.64 . . . . 0.0 115.773 173.552 . . . . . . . . 2 1 . 1 . 006 nuclear build full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.35 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -142.45 -5.14 0.96 Allowed 'General case' 0 CA--C 1.564 1.515 0 C-N-CA 126.664 1.985 . . . . 0.0 112.748 169.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 9.5 t -79.05 109.26 13.19 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 -174.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . 0.282 89.2 mt-10 52.62 4.11 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 -177.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 7.3 t -94.85 -29.65 14.6 Favored 'General case' 0 N--CA 1.423 -1.804 0 O-C-N 118.118 -2.864 . . . . 0.0 113.667 172.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 68.9 t -143.34 104.72 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.325 0 C-N-CA 128.818 2.847 . . . . 0.0 110.395 171.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -154.46 94.51 2.77 Favored Pre-proline 0 CA--C 1.589 2.456 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -61.32 162.02 21.6 Favored 'Trans proline' 0 CA--C 1.582 2.888 0 O-C-N 116.481 -2.431 . . . . 0.0 113.563 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -68.35 162.43 40.56 Favored 'Trans proline' 0 N--CA 1.426 -2.455 0 C-N-CA 124.488 3.459 . . . . 0.0 113.696 170.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -68.73 162.02 42.97 Favored 'Trans proline' 0 C--O 1.259 1.574 0 C-N-CA 122.17 1.913 . . . . 0.0 113.204 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -60.58 141.42 95.21 Favored 'Trans proline' 0 C--O 1.257 1.451 0 C-N-CA 123.921 3.081 . . . . 0.0 114.032 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -59.13 -17.38 26.31 Favored 'General case' 0 C--O 1.243 0.719 0 O-C-N 118.826 -2.422 . . . . 0.0 112.837 163.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -51.97 -30.8 26.5 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 123.726 2.966 . . . . 0.0 116.096 164.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 3.4 tt -74.26 -61.02 2.0 Favored 'General case' 0 C--O 1.195 -1.793 0 O-C-N 125.516 1.76 . . . . 0.0 110.659 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 53.7 m80 -73.99 -57.68 3.81 Favored 'General case' 0 C--O 1.277 2.517 0 C-N-CA 128.912 2.885 . . . . 0.0 110.246 -169.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 2.1 t80 -63.89 -32.04 73.43 Favored 'General case' 0 CA--C 1.575 1.939 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 36.2 ttm -77.1 -36.63 55.46 Favored 'General case' 0 C--N 1.381 1.938 0 O-C-N 118.035 -2.916 . . . . 0.0 113.218 174.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 24.6 t80 -55.28 -42.03 73.04 Favored 'General case' 0 CA--C 1.475 -1.918 0 O-C-N 119.259 -2.151 . . . . 0.0 112.231 174.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1739 ' ' VAL . . . . . 0.41 ' O ' ' HB3' ' A' 1743 ' ' ALA . 25.2 t -69.76 -41.09 79.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 CA-C-N 124.098 3.136 . . . . 0.0 109.748 175.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -69.06 -34.06 74.57 Favored 'General case' 0 CA--C 1.625 3.845 0 O-C-N 117.525 -3.234 . . . . 0.0 111.318 -176.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -81.85 -47.44 12.81 Favored 'General case' 0 C--N 1.291 -1.952 0 C-N-CA 129.129 2.972 . . . . 0.0 109.204 175.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -78.03 -27.16 48.74 Favored 'General case' 0 C--O 1.198 -1.608 0 CA-C-N 122.068 2.213 . . . . 0.0 109.226 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1743 ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' 1739 ' ' VAL . . . -77.4 -36.47 53.35 Favored 'General case' 0 C--O 1.202 -1.434 0 O-C-N 116.595 -3.816 . . . . 0.0 110.049 172.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 8.7 t80 -72.54 -34.0 67.24 Favored 'General case' 0 C--N 1.291 -1.977 0 O-C-N 119.901 -1.75 . . . . 0.0 107.989 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 2.6 t -83.14 -29.63 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 N-CA-C 104.339 -2.467 . . . . 0.0 104.339 -171.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 14.7 tp -81.64 -56.72 3.83 Favored 'General case' 0 C--O 1.26 1.61 0 CA-C-N 118.958 0.799 . . . . 0.0 109.792 175.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1747 ' ' LEU . . . . . 0.415 HD12 ' HA ' ' A' 1747 ' ' LEU . 22.3 tp -63.64 -22.66 67.02 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 118.419 -2.676 . . . . 0.0 110.43 -174.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1748 ' ' PHE . . . . . . . . . . . . . 35.3 t80 -81.98 -45.57 15.17 Favored 'General case' 0 C--O 1.193 -1.902 0 O-C-N 118.294 -2.754 . . . . 0.0 115.35 166.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.402 46.5 t80 -66.7 -13.32 61.15 Favored 'General case' 0 C--N 1.265 -3.088 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 177.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 93.9 t -102.37 -42.6 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.442 -3.205 0 CA-C-O 113.72 -3.038 . . . . 0.0 109.162 167.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -62.88 -49.2 74.56 Favored Glycine 1 N--CA 1.526 4.665 1 CA-C-N 126.433 4.197 . . . . 0.0 110.609 -176.809 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 46.3 t -79.76 -31.0 40.89 Favored 'General case' 0 C--O 1.197 -1.684 0 CA-C-O 114.753 -2.546 . . . . 0.0 108.066 173.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -68.32 -21.82 74.32 Favored Glycine 0 C--O 1.202 -1.889 0 CA-C-N 122.662 2.483 . . . . 0.0 116.946 176.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 3.8 t -84.83 -38.22 13.16 Favored 'Isoleucine or valine' 0 C--O 1.266 1.954 0 O-C-N 128.453 3.09 . . . . 0.0 107.342 -175.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.57 -27.67 25.37 Favored 'General case' 0 CA--C 1.494 -1.193 1 O-C-N 116.219 -4.05 . . . . 0.0 116.359 167.471 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1756 ' ' LEU . . . . . . . . . . . . 0.32 1.4 tt -80.96 -11.67 59.53 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 122.214 2.279 . . . . 0.0 113.057 173.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 56.5 p -49.94 -38.96 38.74 Favored 'General case' 0 N--CA 1.533 3.707 0 O-C-N 119.025 -2.297 . . . . 0.0 109.321 173.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -46.92 -61.81 1.69 Allowed 'General case' 0 N--CA 1.485 1.305 0 O-C-N 125.412 1.695 . . . . 0.0 111.148 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1759 ' ' LYS . . . . . . . . . . . . 0.31 34.6 pttt -176.88 -108.99 0.0 OUTLIER 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 116.33 -1.795 . . . . 0.0 108.091 -171.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1760 ' ' ARG . . . . . 0.42 ' HD3' ' O ' ' A' 1760 ' ' ARG . 0.0 OUTLIER 61.07 -12.08 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 131.088 3.755 . . . . 0.0 113.624 -178.387 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 63.54 89.27 0.09 Allowed 'General case' 0 N--CA 1.52 3.047 0 CA-C-O 124.636 2.16 . . . . 0.0 106.456 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.26 141.72 8.19 Favored 'General case' 0 CA--C 1.473 -1.985 0 N-CA-C 118.0 2.593 . . . . 0.0 118.0 169.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . 0.354 8.2 tp60 67.51 156.31 0.11 Allowed 'General case' 0 N--CA 1.424 -1.774 0 O-C-N 120.257 -1.527 . . . . 0.0 110.676 -169.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 28.5 m170 58.75 -17.77 0.02 OUTLIER 'General case' 0 C--N 1.377 1.764 0 N-CA-C 121.689 3.959 . . . . 0.0 121.689 -170.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -117.62 23.97 9.29 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 127.238 2.352 . . . . 0.0 115.429 168.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -147.56 6.11 0.82 Allowed 'General case' 0 N--CA 1.514 2.749 0 CA-C-O 116.173 -1.87 . . . . 0.0 113.511 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 27.4 tp -107.64 66.03 0.65 Allowed 'General case' 0 CA--C 1.455 -2.711 0 O-C-N 126.218 2.199 . . . . 0.0 111.912 -165.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 47.2 m95 71.93 -49.98 0.69 Allowed 'General case' 0 CA--C 1.452 -2.813 1 C-N-CA 134.732 5.213 . . . . 0.0 111.891 -175.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -99.2 96.59 4.37 Favored Pre-proline 0 C--O 1.285 2.93 0 CA-C-O 116.388 -1.768 . . . . 0.0 114.037 165.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . 0.288 68.2 Cg_endo -64.2 92.55 0.18 Allowed 'Trans proline' 0 C--N 1.378 2.131 1 C-N-CA 126.971 5.114 . . . . 0.0 112.349 -178.003 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 8.3 tp10 . . . . . 0 C--N 1.368 1.381 0 O-C-N 127.524 3.015 . . . . 0.0 110.72 -172.951 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -125.8 179.95 4.95 Favored 'General case' 0 CA--C 1.588 2.434 0 CA-C-O 123.315 1.531 . . . . 0.0 107.127 -175.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 22.2 t -106.29 140.32 39.41 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-O 115.365 -2.255 . . . . 0.0 115.416 174.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 8.5 tp10 62.46 -28.44 0.07 Allowed 'General case' 0 N--CA 1.483 1.212 1 O-C-N 129.546 4.279 . . . . 0.0 114.997 -163.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.261 0.3 OUTLIER -67.91 13.27 0.08 Allowed 'General case' 0 CA--C 1.596 2.731 0 C-N-CA 127.81 2.444 . . . . 0.0 117.401 175.858 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.448 1.4 t -64.02 -101.86 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.577 2.007 0 C-N-CA 128.738 2.815 . . . . 0.0 113.966 164.192 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1727 ' ' GLU . . . . . . . . . . . . 0.259 13.7 tt0 -151.74 111.5 2.94 Favored Pre-proline 0 N--CA 1.489 1.51 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 164.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -63.6 149.19 91.54 Favored 'Trans proline' 0 N--CA 1.43 -2.263 0 C-N-CA 125.066 3.844 . . . . 0.0 113.442 173.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -73.37 157.92 48.94 Favored 'Trans proline' 0 CA--C 1.578 2.708 0 C-N-CA 124.031 3.154 . . . . 0.0 110.59 170.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.32 155.1 5.17 Favored 'Trans proline' 0 N--CA 1.452 -0.961 1 C-N-CA 128.452 6.102 . . . . 0.0 108.68 168.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . 0.281 91.6 Cg_endo -73.29 99.37 1.11 Allowed 'Trans proline' 0 C--N 1.405 3.52 1 C-N-CA 129.558 6.839 . . . . 0.0 113.015 -176.183 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -53.84 -24.7 16.55 Favored 'General case' 0 N--CA 1.418 -2.052 0 C-N-CA 128.395 2.678 . . . . 0.0 111.876 177.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -39.94 -49.68 2.47 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.781 2.882 . . . . 0.0 118.781 160.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . 0.266 34.4 mt -62.36 -48.94 77.55 Favored 'General case' 0 C--N 1.275 -2.666 0 C-N-CA 126.962 2.105 . . . . 0.0 112.902 -172.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1735 ' ' HIS . . . . . . . . . . . . 0.309 36.0 m80 -64.35 -44.22 92.16 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 113.194 -1.821 . . . . 0.0 113.525 169.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 24.7 t80 -62.66 -54.59 37.18 Favored 'General case' 0 C--O 1.193 -1.897 0 C-N-CA 128.618 2.767 . . . . 0.0 112.618 -174.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 54.4 ttm -74.15 -27.56 60.9 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-N 110.661 -2.972 . . . . 0.0 113.991 176.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.283 43.9 t80 -55.2 -51.7 65.72 Favored 'General case' 0 N--CA 1.51 2.531 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 160.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 32.5 t -60.81 -46.68 95.75 Favored 'Isoleucine or valine' 0 C--N 1.357 0.9 0 O-C-N 120.422 -1.424 . . . . 0.0 111.663 172.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -67.53 -39.56 85.04 Favored 'General case' 0 C--N 1.279 -2.495 0 CA-C-O 115.777 -2.059 . . . . 0.0 112.724 -173.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -75.18 -45.68 39.08 Favored 'General case' 0 C--N 1.378 1.828 0 CA-C-O 114.455 -2.688 . . . . 0.0 107.744 175.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -58.14 -42.46 85.92 Favored 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 122.227 2.285 . . . . 0.0 112.87 175.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -69.0 -29.34 67.52 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 175.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 42.5 t80 -83.67 -35.56 24.45 Favored 'General case' 0 C--O 1.271 2.221 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 70.3 t -71.53 -40.9 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.386 -3.674 0 C-N-CA 126.88 2.072 . . . . 0.0 116.587 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.39 -46.24 67.38 Favored 'General case' 0 C--O 1.207 -1.168 0 CA-C-N 114.719 -1.128 . . . . 0.0 112.385 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 8.3 tt -69.22 -34.44 74.86 Favored 'General case' 0 N--CA 1.425 -1.694 0 CA-C-O 124.296 1.998 . . . . 0.0 110.894 -175.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.391 20.3 t80 -66.94 -63.79 0.99 Allowed 'General case' 0 CA--C 1.478 -1.79 0 CA-C-O 113.916 -2.945 . . . . 0.0 111.646 169.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.259 4.4 t80 -77.17 -2.95 37.08 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 127.349 2.906 . . . . 0.0 114.226 -169.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 91.8 t -92.53 -35.55 6.86 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.367 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 164.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -75.45 -45.38 18.67 Favored Glycine 0 N--CA 1.498 2.826 1 CA-C-O 128.741 4.523 . . . . 0.0 110.672 -176.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 47.8 t -67.55 -33.5 75.17 Favored 'General case' 0 CA--C 1.574 1.898 1 C-N-CA 133.826 4.85 . . . . 0.0 106.024 170.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -76.0 -22.34 74.35 Favored Glycine 0 CA--C 1.559 2.836 0 O-C-N 116.993 -3.567 . . . . 0.0 114.276 175.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 1.6 t -72.26 -46.93 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 118.457 -2.79 . . . . 0.0 112.822 176.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.54 -31.01 63.43 Favored 'General case' 0 CA--C 1.572 1.794 0 CA-C-N 112.838 -1.983 . . . . 0.0 110.9 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 22.5 mt -80.32 -31.73 38.04 Favored 'General case' 0 C--O 1.256 1.437 0 CA-C-O 124.239 1.971 . . . . 0.0 112.195 178.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 28.6 t -60.85 -30.29 70.03 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.292 -1.322 . . . . 0.0 114.077 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -82.99 -61.57 1.83 Allowed 'General case' 0 N--CA 1.528 3.453 0 CA-C-O 116.688 -1.625 . . . . 0.0 107.678 168.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 3.2 pttt -172.37 -56.01 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 120.909 1.686 . . . . 0.0 107.993 166.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 57.52 -55.31 0.03 OUTLIER 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 113.72 -3.038 . . . . 0.0 110.64 -154.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 5.6 tpp180 58.86 60.35 2.51 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 128.002 2.521 . . . . 0.0 111.545 -177.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -84.65 139.42 32.06 Favored 'General case' 0 N--CA 1.419 -1.984 0 O-C-N 119.065 -2.272 . . . . 0.0 116.742 162.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -177.92 95.37 0.04 OUTLIER 'General case' 0 CA--C 1.597 2.761 0 C-N-CA 127.529 2.332 . . . . 0.0 109.153 167.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 72.3 m-70 58.97 -48.3 0.06 Allowed 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 127.786 2.434 . . . . 0.0 112.983 175.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -61.78 8.76 0.12 Allowed Glycine 0 C--O 1.223 -0.551 0 N-CA-C 122.095 3.598 . . . . 0.0 122.095 175.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -151.29 2.35 0.41 Allowed 'General case' 0 N--CA 1.491 1.61 1 C-N-CA 132.626 4.37 . . . . 0.0 115.869 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 6.7 tp -89.05 83.21 6.56 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-O 125.178 2.418 . . . . 0.0 113.521 -173.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 50.4 t-105 66.74 -57.05 0.41 Allowed 'General case' 0 C--N 1.372 1.56 1 C-N-CA 135.043 5.337 . . . . 0.0 109.524 -177.188 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -83.83 133.93 45.27 Favored Pre-proline 0 C--N 1.376 1.744 0 O-C-N 118.946 -2.346 . . . . 0.0 109.183 157.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -84.63 61.19 6.16 Favored 'Trans proline' 0 N--CA 1.425 -2.506 1 C-N-CA 128.773 6.315 . . . . 0.0 107.568 178.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1771 ' ' GLU . . . . . . . . . . . . 0.306 73.7 mm-40 . . . . . 0 C--O 1.265 1.91 0 N-CA-C 118.098 2.629 . . . . 0.0 118.098 -170.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1721 ' ' VAL . . . . . 0.544 ' N ' ' HG1' ' A' 1725 ' ' THR 0.389 0.2 OUTLIER . . . . . 0 N--CA 1.52 3.052 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 . . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -156.39 158.27 37.05 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 104.481 -2.414 . . . . 0.0 104.481 -166.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 60.5 p -61.85 -24.04 66.65 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 117.695 -1.602 . . . . 0.0 113.423 -167.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . 0.262 23.6 pt-20 -78.58 -15.73 58.22 Favored 'General case' 0 C--N 1.371 1.533 0 CA-C-N 121.583 1.992 . . . . 0.0 115.202 178.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1725 ' ' THR . . . . . 0.544 ' HG1' ' N ' ' A' 1721 ' ' VAL 0.41 0.1 OUTLIER -76.14 -10.72 59.64 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 121.338 3.829 . . . . 0.0 121.338 166.188 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 10.1 m -127.14 -1.97 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.93 0 O-C-N 120.917 -1.115 . . . . 0.0 111.686 -164.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -66.98 129.83 93.98 Favored Pre-proline 0 CA--C 1.564 1.489 0 CA-C-N 122.36 2.346 . . . . 0.0 116.135 177.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -62.12 149.81 89.06 Favored 'Trans proline' 0 CA--C 1.49 -1.716 0 C-N-CA 121.366 1.377 . . . . 0.0 108.64 168.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . 0.266 52.2 Cg_exo -50.26 147.6 15.76 Favored 'Trans proline' 0 C--O 1.26 1.604 0 CA-C-O 113.928 -2.613 . . . . 0.0 115.581 172.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -59.62 147.24 92.71 Favored 'Trans proline' 0 C--N 1.386 2.541 0 N-CA-C 105.986 -2.352 . . . . 0.0 105.986 176.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -64.77 114.22 2.67 Favored 'Trans proline' 0 CA--C 1.577 2.657 0 C-N-CA 122.688 2.259 . . . . 0.0 112.319 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -66.62 -9.94 40.71 Favored 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 113.92 -1.491 . . . . 0.0 114.286 -177.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 30.3 tp60 -50.47 -35.94 31.24 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 167.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 25.7 tp -60.16 -58.38 8.76 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 128.656 2.782 . . . . 0.0 111.85 173.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 21.6 m80 -60.48 -51.42 69.54 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.542 1.137 . . . . 0.0 114.027 177.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 13.4 t80 -54.98 -48.59 73.07 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 111.327 -2.669 . . . . 0.0 116.655 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . 0.27 61.0 ttp -75.66 -37.49 59.57 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 128.434 2.693 . . . . 0.0 112.634 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.519 83.5 t80 -44.57 -58.84 2.77 Favored 'General case' 0 N--CA 1.437 -1.094 1 N-CA-C 122.521 4.267 . . . . 0.0 122.521 157.218 . . . . . . . . 3 2 . 1 . 008 nuclear build full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 61.8 t -79.1 -36.77 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-N 113.005 -1.907 . . . . 0.0 108.298 -172.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -56.76 -47.69 79.52 Favored 'General case' 0 CA--C 1.578 2.049 0 O-C-N 121.257 -0.902 . . . . 0.0 111.904 176.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -76.38 -39.29 54.16 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 116.012 -1.947 . . . . 0.0 106.395 -179.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -56.71 -40.45 75.69 Favored 'General case' 0 C--O 1.264 1.864 0 CA-C-N 121.448 1.931 . . . . 0.0 112.091 172.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -74.39 -39.49 62.66 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.957 0.903 . . . . 0.0 109.431 -174.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 1.6 t80 -70.32 -37.75 74.8 Favored 'General case' 0 C--N 1.349 0.574 0 O-C-N 118.135 -2.853 . . . . 0.0 115.299 174.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 85.8 t -78.57 -41.58 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.93 0 O-C-N 127.734 3.147 . . . . 0.0 108.933 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.46 -37.53 87.12 Favored 'General case' 0 CA--C 1.581 2.17 0 CA-C-O 116.353 -1.784 . . . . 0.0 109.132 -175.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 26.1 tp -81.9 -46.77 13.62 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 103.864 -2.643 . . . . 0.0 103.864 -167.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1748 ' ' PHE . . . . . . . . . . . . . 85.0 t80 -60.33 -45.8 92.15 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 118.582 2.808 . . . . 0.0 118.582 163.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.336 44.0 t80 -63.04 -31.85 73.09 Favored 'General case' 0 C--O 1.196 -1.758 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 174.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 7.5 t -78.62 -39.26 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 -176.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -73.0 -35.46 57.83 Favored Glycine 0 C--O 1.25 1.101 0 N-CA-C 108.958 -1.657 . . . . 0.0 108.958 -176.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 41.8 t -65.18 -45.62 84.14 Favored 'General case' 0 N--CA 1.487 1.42 1 C-N-CA 131.843 4.057 . . . . 0.0 106.975 172.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -79.38 -27.86 54.07 Favored Glycine 1 N--CA 1.392 -4.255 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 -165.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . 0.31 2.1 p -76.4 -30.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.784 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -179.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 1.3 pp -94.94 -16.7 22.61 Favored 'General case' 0 C--N 1.386 2.196 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 173.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 86.1 mt -77.19 -23.89 51.44 Favored 'General case' 0 C--N 1.384 2.068 0 CA-C-O 114.404 -2.713 . . . . 0.0 110.829 158.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 9.1 t -38.67 -50.12 1.61 Allowed 'General case' 0 C--O 1.273 2.3 0 CA-C-N 123.536 2.88 . . . . 0.0 116.358 -174.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 19.1 ttt-85 -79.02 -66.46 0.86 Allowed 'General case' 0 CA--C 1.553 1.071 0 O-C-N 125.929 2.018 . . . . 0.0 110.646 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1759 ' ' LYS . . . . . 0.481 ' HG3' ' H ' ' A' 1760 ' ' ARG . 15.9 pttt -167.23 -60.21 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.017 1 C-N-CA 132.01 4.124 . . . . 0.0 117.202 166.167 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1760 ' ' ARG . . . . . 0.481 ' H ' ' HG3' ' A' 1759 ' ' LYS . 34.9 ttt85 56.13 -14.83 0.01 OUTLIER 'General case' 0 C--N 1.379 1.872 0 N-CA-C 119.679 3.214 . . . . 0.0 119.679 -174.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 62.58 78.73 0.28 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.655 1.982 . . . . 0.0 115.191 162.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1762 ' ' ARG . . . . . 0.49 ' HA ' ' HB3' ' A' 1766 ' ' GLN . 29.8 mtp180 -119.7 56.7 0.93 Allowed 'General case' 0 N--CA 1.414 -2.263 0 C-N-CA 131.271 3.828 . . . . 0.0 112.997 169.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -140.03 149.49 43.24 Favored 'General case' 0 C--O 1.184 -2.351 0 CA-C-N 112.367 -2.197 . . . . 0.0 107.437 165.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.255 8.9 m80 56.85 -81.25 0.01 OUTLIER 'General case' 0 CA--C 1.574 1.878 0 O-C-N 126.693 2.495 . . . . 0.0 114.542 -176.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -63.74 -3.02 6.92 Favored Glycine 0 C--N 1.388 3.471 0 O-C-N 118.092 -2.88 . . . . 0.0 117.679 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1766 ' ' GLN . . . . . 0.49 ' HB3' ' HA ' ' A' 1762 ' ' ARG . 2.4 tp60 -144.26 31.21 1.24 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 128.025 2.53 . . . . 0.0 109.136 172.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 12.1 tp -74.9 51.75 0.51 Allowed 'General case' 0 CA--C 1.578 2.055 0 O-C-N 118.102 -2.874 . . . . 0.0 112.694 -171.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.431 2.7 t90 64.24 -39.37 0.23 Allowed 'General case' 0 C--O 1.262 1.743 1 O-C-N 115.458 -4.526 . . . . 0.0 116.775 -158.183 . . . . . . . . 3 2 . 1 . 008 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 78.4 t80 -109.38 109.56 60.23 Favored Pre-proline 0 N--CA 1.433 -1.322 0 C-N-CA 128.902 2.881 . . . . 0.0 106.129 173.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -80.49 130.5 7.96 Favored 'Trans proline' 0 N--CA 1.443 -1.475 0 CA-C-O 121.351 0.48 . . . . 0.0 112.093 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 53.9 tt0 . . . . . 0 C--O 1.295 3.482 0 CA-C-O 113.753 -3.022 . . . . 0.0 112.026 -174.789 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.273 2.34 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 28.8 mp0 -146.84 -33.08 0.3 Allowed 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 116.653 -1.641 . . . . 0.0 114.673 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 27.7 t -80.9 118.64 22.58 Favored 'General case' 0 N--CA 1.427 -1.601 0 O-C-N 126.89 2.619 . . . . 0.0 111.181 175.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -49.62 -35.13 20.01 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.679 -1.263 . . . . 0.0 110.488 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 8.3 m -62.0 -13.21 23.55 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -176.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 1.9 m -140.0 32.75 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.259 1.59 0 O-C-N 119.106 -2.246 . . . . 0.0 109.188 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -80.41 114.13 44.92 Favored Pre-proline 0 CA--C 1.607 3.16 0 O-C-N 118.752 -2.467 . . . . 0.0 115.135 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1728 ' ' PRO . . . . . . . . . . . . 0.321 4.9 Cg_exo -72.2 159.64 49.23 Favored 'Trans proline' 0 C--O 1.279 2.537 0 C-N-CA 121.702 1.602 . . . . 0.0 112.371 -175.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -65.63 163.47 30.09 Favored 'Trans proline' 0 CA--C 1.567 2.138 0 C-N-CA 122.059 1.839 . . . . 0.0 109.093 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -73.68 160.76 43.33 Favored 'Trans proline' 0 CA--C 1.556 1.605 0 C-N-CA 123.816 3.01 . . . . 0.0 112.77 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -81.34 152.23 17.98 Favored 'Trans proline' 0 N--CA 1.521 3.137 0 C-N-CA 124.687 3.591 . . . . 0.0 110.865 -172.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -61.48 -14.46 29.05 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 116.465 2.024 . . . . 0.0 116.465 177.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -58.17 -27.9 64.25 Favored 'General case' 0 CA--C 1.615 3.462 0 C-N-CA 128.336 2.655 . . . . 0.0 106.135 177.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 6.4 mt -81.46 -81.25 0.14 Allowed 'General case' 0 C--N 1.36 1.03 0 CA-C-N 120.097 1.317 . . . . 0.0 109.34 171.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 63.4 m80 -55.12 -58.45 7.6 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 116.452 -1.737 . . . . 0.0 109.678 -168.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . 0.356 52.8 t80 -60.5 -42.32 96.13 Favored 'General case' 0 CA--C 1.485 -1.528 0 O-C-N 125.964 2.04 . . . . 0.0 113.664 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 11.7 ttp -65.72 -38.03 88.05 Favored 'General case' 0 C--N 1.387 2.22 0 C-N-CA 113.673 -3.211 . . . . 0.0 113.578 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.525 12.2 t80 -47.73 -50.7 24.5 Favored 'General case' 0 C--O 1.25 1.123 0 N-CA-C 120.323 3.453 . . . . 0.0 120.323 169.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 96.8 t -73.83 -38.0 49.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 O-C-N 119.446 -2.034 . . . . 0.0 111.591 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -64.77 -42.85 94.8 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-O 122.849 1.309 . . . . 0.0 111.986 -178.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -71.51 -49.47 40.72 Favored 'General case' 0 N--CA 1.438 -1.036 0 C-N-CA 128.525 2.73 . . . . 0.0 109.425 178.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.48 81.04 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.576 -1.25 . . . . 0.0 112.627 176.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -70.39 -38.78 74.76 Favored 'General case' 0 N--CA 1.418 -2.069 0 O-C-N 117.246 -3.409 . . . . 0.0 111.612 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 35.2 t80 -65.69 -48.7 71.15 Favored 'General case' 0 C--N 1.376 1.744 0 C-N-CA 126.312 1.845 . . . . 0.0 110.826 173.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 63.0 t -72.56 -30.31 33.65 Favored 'Isoleucine or valine' 0 CA--C 1.446 -3.046 0 CA-C-N 119.639 1.109 . . . . 0.0 111.519 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 45.8 tp -69.56 -44.19 71.37 Favored 'General case' 0 C--N 1.296 -1.728 1 O-C-N 114.956 -4.84 . . . . 0.0 111.272 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 53.4 tp -74.32 -40.29 62.32 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 128.482 2.713 . . . . 0.0 108.024 -176.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.302 38.9 t80 -55.36 -52.17 64.41 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 117.272 2.323 . . . . 0.0 117.272 160.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.324 2.4 t80 -70.4 -28.33 64.99 Favored 'General case' 0 C--N 1.401 2.839 0 C-N-CA 117.139 -1.824 . . . . 0.0 113.381 -169.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 23.3 t -83.21 -46.72 18.62 Favored 'Isoleucine or valine' 0 C--O 1.172 -2.988 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.32 175.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -64.45 -52.67 41.35 Favored Glycine 0 CA--C 1.558 2.74 0 CA-C-N 121.441 1.928 . . . . 0.0 113.697 -176.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 42.6 t -70.0 -34.83 73.83 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-O 113.048 -3.358 . . . . 0.0 107.182 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -61.28 -34.83 89.63 Favored Glycine 0 C--O 1.265 2.037 0 O-C-N 125.575 1.797 . . . . 0.0 112.678 174.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -74.28 -33.12 33.38 Favored 'Isoleucine or valine' 0 C--O 1.266 1.962 0 CA-C-N 120.429 2.114 . . . . 0.0 108.036 -168.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 1.3 pp -93.95 -26.49 16.82 Favored 'General case' 0 N--CA 1.428 -1.541 0 O-C-N 119.94 -1.725 . . . . 0.0 114.599 172.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 9.8 tp -64.47 -31.67 72.97 Favored 'General case' 0 N--CA 1.524 3.241 0 CA-C-N 121.184 1.811 . . . . 0.0 109.424 171.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 59.9 p -65.46 -31.17 72.11 Favored 'General case' 0 C--O 1.2 -1.531 0 N-CA-C 117.864 2.542 . . . . 0.0 117.864 -170.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1758 ' ' ARG . . . . . 0.422 ' HG3' ' H ' ' A' 1758 ' ' ARG . 2.4 mtt180 -61.41 -42.38 98.65 Favored 'General case' 0 C--O 1.257 1.482 1 O-C-N 115.265 -4.647 . . . . 0.0 110.426 -172.082 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 12.7 ptmt -169.55 -17.3 0.02 OUTLIER 'General case' 0 C--N 1.365 1.242 0 C-N-CA 128.998 2.919 . . . . 0.0 114.962 162.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -56.11 -10.55 0.86 Allowed 'General case' 0 N--CA 1.505 2.292 0 CA-C-N 124.412 3.278 . . . . 0.0 118.632 -165.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -51.84 135.35 30.03 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 118.839 -2.413 . . . . 0.0 107.913 167.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -134.64 -75.33 0.46 Allowed 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 114.669 -2.586 . . . . 0.0 108.896 169.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . 0.28 17.0 mp0 61.49 -155.69 0.35 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 128.627 3.705 . . . . 0.0 113.915 168.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 55.2 m80 36.91 -86.39 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 CA-C-O 114.17 -2.824 . . . . 0.0 113.324 169.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -67.51 5.0 3.41 Favored Glycine 0 C--O 1.198 -2.112 0 CA-C-N 122.815 2.552 . . . . 0.0 115.305 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -145.87 26.24 1.25 Allowed 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 128.179 2.591 . . . . 0.0 107.771 -171.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 40.9 tp -89.21 57.42 4.04 Favored 'General case' 0 C--O 1.19 -2.048 0 O-C-N 120.103 -1.623 . . . . 0.0 111.335 -170.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.433 6.5 p90 58.69 -44.52 0.06 Allowed 'General case' 0 C--N 1.372 1.572 0 C-N-CA 130.607 3.563 . . . . 0.0 115.349 -159.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -84.87 128.44 60.59 Favored Pre-proline 0 C--N 1.314 -0.96 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 169.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . 0.277 0.5 OUTLIER -80.56 55.01 5.49 Favored 'Trans proline' 0 CA--C 1.582 2.881 1 C-N-CA 126.737 4.958 . . . . 0.0 111.716 179.631 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 47.9 tp10 . . . . . 0 N--CA 1.506 2.367 0 CA-C-N 120.157 1.344 . . . . 0.0 113.09 -168.469 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.474 2.3 t . . . . . 0 N--CA 1.502 2.164 0 CA-C-O 123.023 1.392 . . . . 0.0 112.89 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.77 159.2 42.71 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 112.191 -2.277 . . . . 0.0 106.657 -176.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 13.1 t -62.18 -29.05 70.1 Favored 'General case' 0 C--O 1.267 2.002 0 N-CA-C 119.245 3.054 . . . . 0.0 119.245 163.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.0 -5.32 43.36 Favored 'General case' 0 C--O 1.196 -1.741 0 CA-C-N 112.81 -1.996 . . . . 0.0 114.278 -176.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.476 0.2 OUTLIER -81.51 -49.12 10.96 Favored 'General case' 0 C--O 1.253 1.243 0 N-CA-C 117.3 2.333 . . . . 0.0 117.3 168.898 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 7.5 p -101.97 56.01 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.537 3.88 0 CA-C-O 124.446 2.07 . . . . 0.0 111.578 -176.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -130.04 127.1 22.63 Favored Pre-proline 0 CA--C 1.56 1.335 0 CA-C-O 114.128 -2.844 . . . . 0.0 108.587 174.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.11 157.47 50.6 Favored 'Trans proline' 0 CA--C 1.493 -1.569 0 O-C-N 127.261 3.242 . . . . 0.0 108.823 176.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.78 162.92 14.54 Favored 'Trans proline' 0 C--O 1.266 1.886 0 N-CA-C 115.441 1.285 . . . . 0.0 115.441 177.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1730 ' ' PRO . . . . . . . . . . . . 0.251 6.3 Cg_exo -64.21 164.86 21.27 Favored 'Trans proline' 0 CA--C 1.587 3.148 0 C-N-CA 121.451 1.434 . . . . 0.0 110.314 174.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -64.72 107.9 0.97 Allowed 'Trans proline' 0 N--CA 1.498 1.772 0 C-N-CA 124.336 3.357 . . . . 0.0 114.286 178.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -68.86 -9.13 49.76 Favored 'General case' 0 N--CA 1.399 -3.017 0 CA-C-N 121.496 1.953 . . . . 0.0 110.904 175.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -45.32 -32.41 2.01 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 127.482 2.313 . . . . 0.0 112.533 169.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 1.4 mt -78.23 -48.9 14.8 Favored 'General case' 0 C--O 1.27 2.151 0 O-C-N 121.192 -0.942 . . . . 0.0 108.499 -176.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 50.4 m80 -74.95 -52.15 11.9 Favored 'General case' 0 N--CA 1.496 1.871 0 C-N-CA 126.749 2.019 . . . . 0.0 112.581 -177.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 18.1 t80 -56.23 -39.38 72.44 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 175.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1737 ' ' MET . . . . . . . . . . . . 0.27 2.3 ttp -80.21 -40.43 27.14 Favored 'General case' 0 CA--C 1.571 1.773 0 CA-C-O 123.686 1.708 . . . . 0.0 113.716 175.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.258 3.6 t80 -54.97 -37.77 66.92 Favored 'General case' 0 N--CA 1.414 -2.263 0 O-C-N 118.999 -2.313 . . . . 0.0 113.668 168.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1739 ' ' VAL . . . . . . . . . . . . 0.251 94.0 t -62.32 -67.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 CA-C-N 120.988 1.722 . . . . 0.0 110.58 167.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -48.13 -47.17 34.86 Favored 'General case' 0 C--O 1.277 2.507 0 N-CA-C 116.295 1.961 . . . . 0.0 116.295 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -76.14 -38.43 56.78 Favored 'General case' 0 CA--C 1.581 2.147 0 C-N-CA 127.851 2.46 . . . . 0.0 109.613 -177.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -72.69 -38.91 67.4 Favored 'General case' 0 C--O 1.194 -1.849 0 O-C-N 118.077 -2.89 . . . . 0.0 111.45 177.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -71.06 -36.95 72.48 Favored 'General case' 0 C--O 1.169 -3.148 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 173.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1744 ' ' PHE . . . . . 0.419 ' O ' ' HB3' ' A' 1748 ' ' PHE . 85.9 t80 -67.52 -38.83 84.83 Favored 'General case' 0 N--CA 1.428 -1.55 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 176.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 13.6 t -79.12 -38.13 20.04 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.899 0 C-N-CA 117.523 -1.671 . . . . 0.0 106.636 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 52.3 mt -92.75 -40.92 10.41 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 116.652 -3.78 . . . . 0.0 112.538 -168.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 4.2 tp -73.69 -18.48 61.01 Favored 'General case' 0 C--N 1.375 1.683 0 C-N-CA 125.135 1.374 . . . . 0.0 110.574 175.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1748 ' ' PHE . . . . . 0.478 ' O ' ' HB3' ' A' 1752 ' ' CYS 0.522 1.4 t80 -81.63 -41.02 22.08 Favored 'General case' 0 CA--C 1.463 -2.394 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 156.612 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.575 64.5 t80 -63.06 -32.55 73.95 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 119.765 -1.835 . . . . 0.0 113.56 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 55.4 t -92.9 -41.04 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 115.54 -2.172 . . . . 0.0 110.439 175.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -68.1 -44.11 78.38 Favored Glycine 0 C--N 1.37 2.436 0 CA-C-N 124.385 3.266 . . . . 0.0 111.561 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1752 ' ' CYS . . . . . 0.478 ' HB3' ' O ' ' A' 1748 ' ' PHE . 42.4 t -79.11 -39.96 32.33 Favored 'General case' 0 C--O 1.204 -1.314 0 CA-C-N 112.1 -2.05 . . . . 0.0 107.76 -177.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -76.1 -19.23 78.81 Favored Glycine 0 N--CA 1.41 -3.05 0 N-CA-C 117.266 1.666 . . . . 0.0 117.266 173.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 11.3 p -76.44 -34.61 25.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 1 CA-C-O 111.594 -4.05 . . . . 0.0 108.617 175.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 4.2 pp -87.47 -31.54 19.94 Favored 'General case' 0 C--O 1.206 -1.195 1 O-C-N 132.8 6.312 . . . . 0.0 113.911 178.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 6.2 tt -70.73 -20.85 62.61 Favored 'General case' 0 C--O 1.193 -1.909 0 N-CA-C 106.827 -1.545 . . . . 0.0 106.827 167.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1757 ' ' SER . . . . . . . . . . . . 0.289 1.6 m -64.48 -19.27 65.46 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-N 124.198 3.181 . . . . 0.0 114.003 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -74.75 -75.47 0.16 Allowed 'General case' 0 C--O 1.266 1.93 0 O-C-N 118.862 -2.399 . . . . 0.0 111.036 174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -166.12 100.87 0.64 Allowed 'General case' 0 N--CA 1.522 3.134 0 C-N-CA 126.529 1.932 . . . . 0.0 110.052 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 16.1 ttt85 -142.26 -0.02 1.3 Allowed 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 116.539 2.052 . . . . 0.0 116.539 173.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 62.94 148.18 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 C-N-CA 129.001 2.92 . . . . 0.0 115.671 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1762 ' ' ARG . . . . . . . . . . . . 0.262 8.3 ptm180 -141.91 14.35 2.09 Favored 'General case' 0 C--N 1.283 -2.298 0 C-N-CA 126.904 2.081 . . . . 0.0 113.442 -167.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -155.98 164.78 38.04 Favored 'General case' 0 CA--C 1.496 -1.132 0 C-N-CA 127.677 2.391 . . . . 0.0 107.156 -173.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 91.7 m-70 64.31 -81.98 0.03 OUTLIER 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 125.225 1.578 . . . . 0.0 110.073 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -72.83 19.63 1.18 Allowed Glycine 0 N--CA 1.483 1.826 0 C-N-CA 127.577 2.513 . . . . 0.0 117.241 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -160.57 2.75 0.07 Allowed 'General case' 0 C--N 1.362 1.152 0 C-N-CA 127.33 2.252 . . . . 0.0 111.284 -167.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1767 ' ' LEU . . . . . 0.464 HD22 ' HA ' ' A' 1767 ' ' LEU . 0.4 OUTLIER -88.17 72.33 9.12 Favored 'General case' 0 N--CA 1.434 -1.273 0 CA-C-N 119.847 1.203 . . . . 0.0 113.112 -171.204 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 35.8 t-105 68.64 -36.08 0.31 Allowed 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 129.786 3.235 . . . . 0.0 115.043 -173.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -113.31 106.97 54.15 Favored Pre-proline 0 N--CA 1.415 -2.18 0 C-N-CA 128.876 2.87 . . . . 0.0 110.105 168.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -70.49 81.36 1.01 Allowed 'Trans proline' 0 N--CA 1.417 -2.989 0 C-N-CA 122.093 1.862 . . . . 0.0 115.597 -178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 87.8 tt0 . . . . . 0 CA--C 1.585 2.327 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -159.014 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 123.338 1.542 . . . . 0.0 112.245 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -82.71 137.08 34.55 Favored 'General case' 0 C--N 1.386 2.156 0 C-N-CA 126.681 1.993 . . . . 0.0 109.885 -162.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 52.9 p -53.11 -13.12 0.43 Allowed 'General case' 0 N--CA 1.523 3.216 0 O-C-N 118.163 -2.836 . . . . 0.0 117.861 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.99 -16.76 57.86 Favored 'General case' 0 C--N 1.391 2.39 0 O-C-N 116.57 -3.831 . . . . 0.0 113.891 175.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.417 5.1 t -133.9 -5.9 2.77 Favored 'General case' 0 C--O 1.274 2.372 0 C-N-CA 127.025 2.13 . . . . 0.0 112.252 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.06 -17.45 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.999 0 CA-C-N 121.973 2.169 . . . . 0.0 116.261 169.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -132.83 146.62 62.1 Favored Pre-proline 0 CA--C 1.609 3.228 0 CA-C-N 124.028 3.104 . . . . 0.0 111.714 167.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -87.78 149.19 7.23 Favored 'Trans proline' 0 N--CA 1.437 -1.798 0 CA-C-O 122.862 1.109 . . . . 0.0 114.683 152.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -59.53 165.85 8.86 Favored 'Trans proline' 0 CA--C 1.585 3.05 0 C-N-CA 125.299 4.0 . . . . 0.0 112.48 161.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -73.31 160.68 44.45 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 116.869 -1.621 . . . . 0.0 110.36 -171.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -62.13 110.57 1.04 Allowed 'Trans proline' 0 C--O 1.281 2.663 0 C-N-CA 122.164 1.91 . . . . 0.0 109.369 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . 0.326 . . -68.72 -7.39 33.17 Favored 'General case' 0 CA--C 1.584 2.261 1 O-C-N 114.515 -5.116 . . . . 0.0 111.567 172.542 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -63.43 -42.1 98.68 Favored 'General case' 0 N--CA 1.509 2.499 0 CA-C-N 119.448 1.022 . . . . 0.0 112.798 165.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 8.2 mp -89.67 -52.45 5.0 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 -172.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.27 -43.93 79.27 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 117.797 2.517 . . . . 0.0 117.797 -176.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . 0.263 21.1 t80 -78.95 -35.49 43.16 Favored 'General case' 0 C--O 1.271 2.224 0 N-CA-C 104.594 -2.373 . . . . 0.0 104.594 -177.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 20.6 ttp -67.66 -29.21 68.44 Favored 'General case' 0 C--N 1.385 2.124 0 CA-C-N 120.642 1.565 . . . . 0.0 112.797 174.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.349 9.0 m-85 -56.62 -46.1 81.12 Favored 'General case' 0 N--CA 1.407 -2.593 0 CA-C-O 116.241 -1.838 . . . . 0.0 112.776 170.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 4.5 t -63.48 -41.11 91.53 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.66 0 CA-C-O 124.14 1.924 . . . . 0.0 112.927 176.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -63.23 -55.12 27.56 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 118.289 -2.757 . . . . 0.0 112.575 175.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -69.99 -48.12 59.46 Favored 'General case' 0 N--CA 1.413 -2.291 1 O-C-N 113.93 -5.482 . . . . 0.0 109.215 -174.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -51.76 -46.19 64.02 Favored 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 120.034 -1.666 . . . . 0.0 112.295 169.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -70.33 -32.77 70.64 Favored 'General case' 0 C--N 1.363 1.192 0 C-N-CA 116.263 -2.175 . . . . 0.0 110.184 -176.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 69.5 t80 -72.79 -40.56 65.79 Favored 'General case' 0 N--CA 1.517 2.912 0 CA-C-O 124.281 1.991 . . . . 0.0 112.021 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 94.4 t -73.6 -40.5 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.732 0 CA-C-O 115.936 -1.983 . . . . 0.0 107.79 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 61.2 tp -63.01 -50.7 69.66 Favored 'General case' 0 N--CA 1.522 3.131 1 O-C-N 129.419 4.199 . . . . 0.0 106.17 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 13.6 tp -68.19 -35.0 77.32 Favored 'General case' 0 CA--C 1.573 1.857 0 C-N-CA 127.051 2.14 . . . . 0.0 108.212 -165.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.434 74.3 t80 -65.19 -52.57 54.03 Favored 'General case' 0 C--O 1.182 -2.448 0 CA-C-O 115.767 -2.064 . . . . 0.0 115.032 161.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . . 3.8 t80 -69.12 -22.51 63.96 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 115.59 -2.444 . . . . 0.0 115.489 -175.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 53.7 t -89.31 -44.48 15.24 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 O-C-N 116.484 -3.885 . . . . 0.0 109.393 176.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -64.22 -44.05 96.15 Favored Glycine 0 CA--C 1.57 3.521 0 CA-C-O 127.272 3.706 . . . . 0.0 112.004 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 9.1 t -71.77 -40.2 69.46 Favored 'General case' 0 CA--C 1.563 1.459 0 O-C-N 118.376 -2.838 . . . . 0.0 107.551 172.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -69.37 -26.45 74.56 Favored Glycine 0 C--O 1.216 -1.031 0 CA-C-O 122.517 1.065 . . . . 0.0 112.024 -171.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . 0.371 4.5 p -72.42 -48.81 45.95 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.843 0 O-C-N 120.155 -1.791 . . . . 0.0 108.802 -173.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 3.1 pp -76.11 -41.46 50.13 Favored 'General case' 0 CA--C 1.494 -1.188 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.697 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 16.4 mt -60.61 -20.16 59.87 Favored 'General case' 0 CA--C 1.501 -0.925 0 O-C-N 119.969 -1.707 . . . . 0.0 113.91 175.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 71.4 m -68.26 -11.3 59.17 Favored 'General case' 0 C--O 1.258 1.521 0 N-CA-C 117.401 2.371 . . . . 0.0 117.401 175.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -77.83 -63.62 1.34 Allowed 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 170.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . 0.415 ' HG3' ' H ' ' A' 1760 ' ' ARG 0.355 38.0 pttt -158.35 -102.47 0.03 OUTLIER 'General case' 0 N--CA 1.531 3.581 0 C-N-CA 126.043 1.737 . . . . 0.0 109.765 171.844 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . 0.415 ' H ' ' HG3' ' A' 1759 ' ' LYS 0.263 11.7 tpp85 53.23 -51.44 0.01 OUTLIER 'General case' 0 C--O 1.189 -2.1 0 C-N-CA 131.219 3.808 . . . . 0.0 117.346 -177.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . 0.256 0.0 OUTLIER -67.4 56.88 0.05 Allowed 'General case' 0 N--CA 1.521 3.076 0 C-N-CA 127.539 2.336 . . . . 0.0 115.614 -169.197 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -64.7 -42.66 95.12 Favored 'General case' 0 CA--C 1.571 1.761 0 O-C-N 119.284 -2.135 . . . . 0.0 114.424 170.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 6.4 tm0? 53.91 -156.42 0.2 Allowed 'General case' 0 N--CA 1.522 3.173 0 O-C-N 125.515 1.759 . . . . 0.0 108.303 -166.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.26 52.9 t-80 36.03 -93.99 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.022 0 CA-C-O 117.725 -1.131 . . . . 0.0 113.017 -176.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -67.95 18.44 0.36 Allowed Glycine 0 CA--C 1.557 2.677 0 CA-C-O 124.652 2.251 . . . . 0.0 115.638 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -150.7 5.15 0.51 Allowed 'General case' 0 C--N 1.301 -1.53 0 O-C-N 117.253 -3.498 . . . . 0.0 108.319 -175.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 23.2 tp -73.78 73.81 1.57 Allowed 'General case' 0 CA--C 1.568 1.671 0 C-N-CA 130.948 3.699 . . . . 0.0 114.319 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 25.6 t-105 72.69 -65.42 0.36 Allowed 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 112.885 -1.961 . . . . 0.0 111.432 -178.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -70.93 135.94 85.22 Favored Pre-proline 0 C--N 1.378 1.81 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 152.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -81.2 102.95 1.39 Allowed 'Trans proline' 1 CA--C 1.625 5.069 0 O-C-N 126.819 3.01 . . . . 0.0 105.731 164.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 36.7 tp10 . . . . . 0 C--N 1.296 -1.724 1 CA-C-O 111.35 -4.166 . . . . 0.0 118.238 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.514 -0.41 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -109.18 -81.89 0.57 Allowed 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 115.253 -2.308 . . . . 0.0 110.7 -175.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 41.9 t -166.23 115.0 0.93 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 128.717 2.807 . . . . 0.0 109.541 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . 0.314 91.2 mt-10 65.71 -0.67 1.21 Allowed 'General case' 0 C--N 1.278 -2.529 0 CA-C-O 124.901 2.286 . . . . 0.0 116.652 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 11.3 p -81.84 -16.27 51.34 Favored 'General case' 0 C--N 1.289 -2.054 0 O-C-N 118.888 -2.383 . . . . 0.0 111.946 -167.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -140.28 11.38 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.583 2.216 0 CA-C-O 122.802 1.286 . . . . 0.0 112.824 -170.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -154.21 132.82 6.88 Favored Pre-proline 0 N--CA 1.485 1.321 0 C-N-CA 125.102 1.361 . . . . 0.0 108.419 175.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -60.15 143.21 99.55 Favored 'Trans proline' 0 C--O 1.28 2.576 0 C-N-CA 123.203 2.602 . . . . 0.0 114.723 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . 0.255 26.2 Cg_exo -46.71 156.84 0.57 Allowed 'Trans proline' 0 CA--C 1.551 1.334 0 C-N-CA 124.297 3.332 . . . . 0.0 113.101 157.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -58.13 152.32 53.02 Favored 'Trans proline' 0 N--CA 1.444 -1.405 1 C-N-CA 126.045 4.496 . . . . 0.0 111.419 176.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -64.33 158.59 48.1 Favored 'Trans proline' 0 CA--C 1.575 2.562 0 O-C-N 123.24 1.126 . . . . 0.0 114.385 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -62.21 -25.01 67.56 Favored 'General case' 0 C--O 1.183 -2.413 0 O-C-N 118.801 -2.437 . . . . 0.0 114.97 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -56.08 -24.79 42.34 Favored 'General case' 0 CA--C 1.562 1.435 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.28 -60.41 3.44 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 124.745 2.212 . . . . 0.0 105.721 169.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 58.9 m80 -67.56 -45.0 76.88 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 116.747 -3.721 . . . . 0.0 112.12 -173.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 27.2 t80 -70.51 -29.37 65.86 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-O 128.2 3.857 . . . . 0.0 113.341 -177.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 36.9 ttm -68.51 -49.4 59.97 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 118.064 -2.897 . . . . 0.0 112.171 164.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -54.02 -11.83 0.5 Allowed 'General case' 0 C--N 1.369 1.433 0 O-C-N 117.08 -3.513 . . . . 0.0 118.037 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 3.1 t -99.24 -63.31 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.184 -2.361 0 O-C-N 119.646 -1.909 . . . . 0.0 107.167 173.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -52.47 -50.35 62.85 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 117.975 2.583 . . . . 0.0 117.975 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -88.08 -24.67 23.36 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 114.742 -2.551 . . . . 0.0 106.56 -170.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . 0.287 . . -68.48 -47.18 67.74 Favored 'General case' 0 N--CA 1.413 -2.288 0 O-C-N 125.583 1.802 . . . . 0.0 109.903 172.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.87 77.81 Favored 'General case' 0 CA--C 1.454 -2.727 0 O-C-N 125.521 1.763 . . . . 0.0 115.168 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 26.7 t80 -63.13 -49.85 72.78 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-O 113.894 -2.955 . . . . 0.0 111.334 174.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 41.8 t -60.18 -42.86 91.71 Favored 'Isoleucine or valine' 0 C--N 1.375 1.69 1 O-C-N 129.591 4.307 . . . . 0.0 111.116 176.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 10.5 tp -73.27 -44.77 58.68 Favored 'General case' 0 C--N 1.355 0.836 1 O-C-N 115.957 -4.214 . . . . 0.0 110.552 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . . . . . . . . 0.304 65.9 tp -64.48 -37.88 89.07 Favored 'General case' 0 CA--C 1.575 1.909 0 CA-C-N 122.195 2.271 . . . . 0.0 110.873 -178.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.329 29.1 t80 -66.44 -41.49 89.07 Favored 'General case' 0 C--O 1.252 1.212 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 167.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.425 87.0 t80 -70.88 -29.41 65.5 Favored 'General case' 0 C--O 1.21 -0.985 0 C-N-CA 116.297 -2.161 . . . . 0.0 114.037 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 8.0 t -83.26 -50.82 15.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.636 176.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -58.85 -56.27 26.25 Favored Glycine 0 N--CA 1.414 -2.779 0 CA-C-O 125.088 2.493 . . . . 0.0 113.574 -168.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 52.6 t -80.9 -38.78 27.39 Favored 'General case' 0 C--N 1.378 1.824 0 CA-C-N 109.947 -3.126 . . . . 0.0 110.083 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -76.03 -17.65 79.91 Favored Glycine 0 N--CA 1.511 3.691 0 CA-C-O 115.452 -2.86 . . . . 0.0 108.393 -169.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 7.1 t -75.99 -52.61 17.43 Favored 'Isoleucine or valine' 0 C--N 1.353 0.719 0 CA-C-N 121.599 2.7 . . . . 0.0 106.517 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . . . . . . . . 0.276 2.4 pp -71.7 -27.33 62.95 Favored 'General case' 0 C--O 1.242 0.693 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 4.4 tt -76.99 -22.84 52.54 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 117.81 -1.09 . . . . 0.0 111.851 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 72.7 m -72.81 -36.93 67.65 Favored 'General case' 0 C--O 1.258 1.511 0 O-C-N 124.64 1.213 . . . . 0.0 111.197 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 21.6 ttt-85 -68.16 -52.33 35.81 Favored 'General case' 0 CA--C 1.506 -0.736 1 O-C-N 129.141 4.026 . . . . 0.0 108.544 -175.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 16.4 ptpt 162.13 125.05 0.0 OUTLIER 'General case' 0 N--CA 1.533 3.722 0 CA-C-N 112.787 -2.006 . . . . 0.0 110.087 158.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -170.33 -6.32 0.02 OUTLIER 'General case' 0 N--CA 1.524 3.275 0 N-CA-C 118.977 2.954 . . . . 0.0 118.977 -170.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 50.0 mtp85 -46.69 -59.02 3.29 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 119.534 -1.979 . . . . 0.0 108.047 -172.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . . . . . . . . 0.325 33.6 mmm-85 55.24 -103.93 0.2 Allowed 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 121.83 2.105 . . . . 0.0 115.694 170.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 62.89 -27.71 0.07 Allowed 'General case' 0 C--O 1.174 -2.894 1 C-N-CA 133.157 4.583 . . . . 0.0 115.286 174.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -78.07 -98.43 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.986 0 C-N-CA 128.782 2.833 . . . . 0.0 107.407 173.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -80.71 45.67 3.17 Favored Glycine 0 CA--C 1.469 -2.83 0 O-C-N 117.52 -3.237 . . . . 0.0 115.486 -171.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -160.09 -3.69 0.06 Allowed 'General case' 1 N--CA 1.543 4.189 0 O-C-N 118.689 -2.654 . . . . 0.0 112.436 -177.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.88 99.24 12.24 Favored 'General case' 0 CA--C 1.585 2.31 0 CA-C-O 123.989 1.852 . . . . 0.0 110.147 -168.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 20.3 t90 55.76 -54.52 0.02 OUTLIER 'General case' 0 N--CA 1.53 3.565 0 CA-C-O 116.198 -1.858 . . . . 0.0 115.907 -165.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -108.72 131.99 21.43 Favored Pre-proline 0 C--N 1.288 -2.098 0 C-N-CA 124.583 1.153 . . . . 0.0 111.599 165.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -85.09 60.74 5.71 Favored 'Trans proline' 0 N--CA 1.436 -1.905 0 C-N-CA 121.924 1.749 . . . . 0.0 116.01 -168.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 15.2 tp10 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 126.009 2.814 . . . . 0.0 113.028 -166.137 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.4 1.5 p . . . . . 0 CA--C 1.547 0.853 0 CA-C-O 124.217 1.961 . . . . 0.0 111.527 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.79 156.11 46.24 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 125.79 1.636 . . . . 0.0 110.768 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 64.4 m -54.7 143.93 23.59 Favored 'General case' 0 CA--C 1.582 2.204 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 162.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 61.6 tt0 61.7 -35.86 0.11 Allowed 'General case' 0 C--O 1.262 1.745 0 N-CA-C 118.25 2.685 . . . . 0.0 118.25 -169.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 1.3 p -70.59 -16.44 62.85 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-O 125.242 2.448 . . . . 0.0 115.8 171.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.302 0.5 OUTLIER -123.9 -36.86 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.401 2.833 0 O-C-N 118.685 -2.51 . . . . 0.0 116.316 176.276 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -107.22 100.85 35.39 Favored Pre-proline 0 C--O 1.27 2.137 0 N-CA-C 105.688 -1.968 . . . . 0.0 105.688 -170.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -89.71 153.16 5.13 Favored 'Trans proline' 0 C--O 1.248 1.009 0 C-N-CA 123.126 2.551 . . . . 0.0 112.922 -169.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -63.15 161.56 29.76 Favored 'Trans proline' 0 N--CA 1.438 -1.762 0 CA-C-O 113.82 -2.658 . . . . 0.0 117.248 174.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -70.63 160.06 50.7 Favored 'Trans proline' 0 C--O 1.284 2.803 1 C-N-CA 125.681 4.254 . . . . 0.0 112.411 171.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -76.63 128.12 10.02 Favored 'Trans proline' 0 CA--C 1.566 2.105 0 C-N-CA 121.928 1.752 . . . . 0.0 111.944 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -50.56 -26.24 5.04 Favored 'General case' 0 C--O 1.199 -1.584 0 CA-C-N 114.45 -1.25 . . . . 0.0 113.556 173.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -53.47 -23.79 11.18 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.183 1.393 . . . . 0.0 110.315 177.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 94.3 mt -79.12 -65.67 0.97 Allowed 'General case' 0 C--O 1.19 -2.049 0 CA-C-O 123.835 1.779 . . . . 0.0 113.735 173.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 72.2 t60 -70.35 -29.47 66.17 Favored 'General case' 0 CA--C 1.561 1.366 1 O-C-N 114.718 -4.989 . . . . 0.0 116.538 -176.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 2.7 t80 -75.47 -43.02 51.61 Favored 'General case' 0 CA--C 1.57 1.715 0 N-CA-C 103.465 -2.791 . . . . 0.0 103.465 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 43.0 ttm -70.13 -32.82 71.01 Favored 'General case' 0 C--O 1.186 -2.242 0 C-N-CA 116.054 -2.258 . . . . 0.0 114.771 169.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 11.5 t80 -49.61 -46.74 49.64 Favored 'General case' 0 CA--C 1.622 3.734 1 N-CA-C 122.228 4.159 . . . . 0.0 122.228 167.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 2.9 t -69.94 -39.65 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 CA-C-N 113.289 -1.778 . . . . 0.0 107.937 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -59.29 -48.92 79.8 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 127.515 3.531 . . . . 0.0 118.68 177.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . 0.276 . . -83.11 -40.15 20.19 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 112.093 -2.321 . . . . 0.0 113.85 -177.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -63.89 -33.21 75.18 Favored 'General case' 0 N--CA 1.403 -2.815 0 C-N-CA 116.688 -2.005 . . . . 0.0 112.491 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -74.88 -31.51 61.61 Favored 'General case' 0 C--N 1.384 2.076 0 O-C-N 117.916 -2.99 . . . . 0.0 106.281 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 9.3 t80 -75.22 -46.08 36.25 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 131.498 3.919 . . . . 0.0 111.667 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 88.4 t -64.18 -32.42 57.34 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-O 123.138 1.447 . . . . 0.0 110.026 170.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 36.4 tp -81.72 -37.6 27.05 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 118.377 -2.702 . . . . 0.0 106.557 -166.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 9.1 tt -85.13 -23.74 28.3 Favored 'General case' 0 C--O 1.249 1.047 0 O-C-N 118.594 -2.566 . . . . 0.0 108.078 -170.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . . . . . . . . . 1.2 t80 -73.02 -43.43 62.1 Favored 'General case' 0 CA--C 1.477 -1.856 0 N-CA-C 117.011 2.226 . . . . 0.0 117.011 155.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.288 1.2 t80 -65.86 -28.9 69.31 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 -178.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 90.1 t -89.99 -45.77 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 116.985 -1.483 . . . . 0.0 114.062 170.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -59.26 -49.53 77.53 Favored Glycine 0 C--O 1.255 1.451 0 CA-C-O 123.511 1.617 . . . . 0.0 113.411 -175.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 7.6 t -67.03 -49.06 66.43 Favored 'General case' 0 C--O 1.187 -2.189 0 C-N-CA 131.558 3.943 . . . . 0.0 111.244 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -75.26 -26.45 66.06 Favored Glycine 0 CA--C 1.472 -2.596 0 CA-C-O 115.768 -2.685 . . . . 0.0 111.886 -173.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . 0.415 0.3 OUTLIER -61.89 -45.37 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 CA-C-N 119.869 1.835 . . . . 0.0 112.327 171.635 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . 0.405 ' H ' ' HG ' ' A' 1755 ' ' LEU . 16.2 mt -73.32 -37.41 66.18 Favored 'General case' 0 C--O 1.245 0.819 0 O-C-N 118.468 -2.645 . . . . 0.0 105.307 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 19.4 tp -64.64 -21.54 66.75 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-O 123.933 1.825 . . . . 0.0 111.899 -177.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 9.1 t -54.27 -33.77 59.33 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 117.278 2.325 . . . . 0.0 117.278 -167.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -69.21 -6.67 30.48 Favored 'General case' 0 C--O 1.262 1.756 0 CA-C-O 127.637 3.589 . . . . 0.0 118.34 170.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 50.4 mttp -119.38 -23.41 6.69 Favored 'General case' 0 C--N 1.369 1.418 0 O-C-N 116.932 -3.605 . . . . 0.0 110.133 -176.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -47.06 -34.96 6.31 Favored 'General case' 0 N--CA 1.512 2.634 0 C-N-CA 129.117 2.967 . . . . 0.0 114.647 -173.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . 0.379 75.4 ttt180 -50.66 -22.8 2.22 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 124.428 2.061 . . . . 0.0 116.069 178.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -63.5 -54.83 30.11 Favored 'General case' 0 CA--C 1.477 -1.843 0 O-C-N 118.419 -2.676 . . . . 0.0 111.249 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 66.91 149.36 0.05 Allowed 'General case' 0 C--O 1.253 1.25 0 CA-C-N 122.462 2.392 . . . . 0.0 113.017 171.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 11.7 m170 63.1 -63.33 0.12 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 127.763 2.425 . . . . 0.0 114.36 -174.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . 0.526 ' HA2' ' H ' ' A' 1771 ' ' GLU . . . -76.51 44.88 2.03 Favored Glycine 0 N--CA 1.462 0.371 0 O-C-N 119.119 -2.238 . . . . 0.0 114.728 178.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -149.15 -7.91 0.35 Allowed 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 125.865 1.666 . . . . 0.0 108.371 173.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . . . . . . . . 0.258 23.9 tp -81.95 73.05 9.0 Favored 'General case' 0 N--CA 1.381 -3.886 0 C-N-CA 128.627 2.771 . . . . 0.0 112.394 -171.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.447 16.1 t90 71.51 -64.28 0.39 Allowed 'General case' 0 C--N 1.291 -1.957 0 CA-C-N 112.469 -2.15 . . . . 0.0 108.336 -163.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . 0.257 6.6 m-85 -86.92 139.25 32.76 Favored Pre-proline 0 N--CA 1.431 -1.418 0 C-N-CA 127.267 2.227 . . . . 0.0 113.593 -175.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -95.15 99.51 0.11 Allowed 'Trans proline' 1 N--CA 1.399 -4.079 0 N-CA-C 105.541 -2.523 . . . . 0.0 105.541 176.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . 0.526 ' H ' ' HA2' ' A' 1765 ' ' GLY . 40.3 tp10 . . . . . 0 N--CA 1.495 1.805 0 O-C-N 120.998 -1.064 . . . . 0.0 112.714 -175.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.264 8.5 p . . . . . 0 N--CA 1.499 2.022 0 CA-C-O 119.166 -0.445 . . . . 0.0 111.983 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . 0.426 12.3 mp0 -75.0 7.85 2.94 Favored 'General case' 0 C--O 1.195 -1.798 0 CA-C-O 127.095 3.331 . . . . 0.0 117.94 -159.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 60.31 6.36 1.02 Allowed 'General case' 0 N--CA 1.508 2.44 0 O-C-N 117.774 -3.079 . . . . 0.0 116.156 -174.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -80.82 18.67 0.95 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 118.148 -2.845 . . . . 0.0 115.999 171.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.396 1.7 m 52.49 28.48 5.99 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 174.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.533 0.2 OUTLIER 69.08 22.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 118.015 -2.928 . . . . 0.0 118.13 -176.439 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' 1728 ' ' PRO . 15.4 tp10 -89.69 136.04 29.96 Favored Pre-proline 0 C--O 1.299 3.705 0 O-C-N 121.844 -0.535 . . . . 0.0 111.638 -175.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' 1727 ' ' GLU . 40.9 Cg_exo -90.63 154.33 4.26 Favored 'Trans proline' 0 N--CA 1.52 3.034 0 C-N-CA 123.421 2.747 . . . . 0.0 107.618 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . 0.254 33.8 Cg_exo -70.52 146.56 55.85 Favored 'Trans proline' 0 CA--C 1.554 1.51 0 C-N-CA 121.555 1.504 . . . . 0.0 115.687 168.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -65.13 159.5 46.53 Favored 'Trans proline' 0 C--O 1.269 2.05 1 C-N-CA 125.756 4.304 . . . . 0.0 113.378 -176.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.85 158.85 52.04 Favored 'Trans proline' 0 N--CA 1.481 0.794 1 C-N-CA 126.867 5.044 . . . . 0.0 110.324 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -63.84 -26.56 68.67 Favored 'General case' 0 CA--C 1.461 -2.447 0 O-C-N 119.872 -1.767 . . . . 0.0 114.615 168.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -41.45 -30.08 0.18 Allowed 'General case' 0 C--O 1.173 -2.956 0 CA-C-O 114.417 -2.706 . . . . 0.0 118.174 168.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 13.6 mt -75.9 -71.7 0.36 Allowed 'General case' 0 C--O 1.27 2.184 0 O-C-N 125.86 1.975 . . . . 0.0 110.715 165.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . 0.686 ' O ' HG23 ' A' 1739 ' ' VAL . 25.0 m80 -66.9 -48.61 68.16 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 127.347 2.259 . . . . 0.0 116.011 -170.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 30.8 t80 -76.92 -30.06 55.95 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 -175.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 8.8 ttp -74.5 -34.17 62.99 Favored 'General case' 0 C--O 1.275 2.424 0 C-N-CA 111.967 -3.893 . . . . 0.0 107.371 175.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.329 9.0 m-85 -55.4 -47.2 76.27 Favored 'General case' 0 CA--C 1.601 2.917 0 CA-C-N 119.065 0.848 . . . . 0.0 113.281 176.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' 1735 ' ' HIS . 2.0 t -69.48 -35.17 65.44 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.562 0 CA-C-O 123.09 1.424 . . . . 0.0 112.114 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -69.12 -45.64 69.66 Favored 'General case' 0 CA--C 1.579 2.085 0 O-C-N 118.866 -2.396 . . . . 0.0 112.122 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -68.34 -51.32 45.83 Favored 'General case' 0 N--CA 1.53 3.525 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . 0.26 . . -59.01 -40.11 83.92 Favored 'General case' 0 C--O 1.271 2.191 0 CA-C-N 122.04 2.2 . . . . 0.0 115.258 176.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.7 95.1 Favored 'General case' 0 C--O 1.175 -2.836 0 CA-C-O 122.249 1.023 . . . . 0.0 111.562 -177.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 59.5 t80 -66.43 -44.62 82.39 Favored 'General case' 0 C--N 1.355 0.841 0 C-N-CA 131.355 3.862 . . . . 0.0 111.089 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 40.9 t -85.8 -26.92 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.643 0 CA-C-O 114.677 -2.582 . . . . 0.0 109.537 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 56.2 tp -71.72 -37.88 70.56 Favored 'General case' 0 C--O 1.261 1.667 0 C-N-CA 115.887 -2.325 . . . . 0.0 115.139 171.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 13.1 tp -74.64 -32.95 62.44 Favored 'General case' 0 C--O 1.239 0.535 0 O-C-N 120.473 -1.392 . . . . 0.0 113.626 -178.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.426 51.5 t80 -65.58 -50.22 65.93 Favored 'General case' 0 C--O 1.257 1.481 0 N-CA-C 118.01 2.596 . . . . 0.0 118.01 162.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.353 57.0 m-85 -77.58 -24.87 49.66 Favored 'General case' 0 CA--C 1.496 -1.115 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -177.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 63.2 t -81.54 -51.77 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.867 0 CA-C-O 114.96 -2.447 . . . . 0.0 108.907 172.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -62.04 -41.69 99.69 Favored Glycine 1 CA--C 1.595 5.064 0 CA-C-N 124.637 3.381 . . . . 0.0 114.519 -174.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . . . . . . . . 0.327 9.0 t -68.56 -30.7 69.53 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 171.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -72.93 -25.4 73.87 Favored Glycine 0 CA--C 1.543 1.817 0 N-CA-C 110.178 -1.169 . . . . 0.0 110.178 -173.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 69.3 t -67.46 -44.19 86.95 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.427 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.92 -23.27 18.81 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 116.776 2.139 . . . . 0.0 116.776 -172.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 26.7 tp -74.06 -27.72 61.05 Favored 'General case' 0 CA--C 1.59 2.499 0 CA-C-N 113.839 -1.528 . . . . 0.0 112.673 168.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 1.1 t -62.82 -38.04 89.16 Favored 'General case' 0 C--O 1.278 2.57 0 CA-C-N 112.689 -2.051 . . . . 0.0 109.562 171.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 11.0 mtt85 -74.48 -66.7 0.7 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 119.027 -2.296 . . . . 0.0 113.267 164.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . . . . . . . . 0.324 16.2 pttm -150.93 -99.41 0.06 Allowed 'General case' 0 CA--C 1.47 -2.114 0 C-N-CA 127.688 2.395 . . . . 0.0 114.289 -170.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . . . . . . . . 0.364 14.0 ttm180 58.44 -45.65 0.06 Allowed 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 -173.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . 0.274 19.5 ttm-85 -142.45 -73.89 0.3 Allowed 'General case' 0 CA--C 1.565 1.556 0 O-C-N 125.827 1.955 . . . . 0.0 113.365 169.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . . . . . . . . 0.263 55.9 mtp85 52.26 65.65 1.44 Allowed 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 124.764 1.225 . . . . 0.0 112.904 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -128.93 38.86 3.88 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 125.406 1.482 . . . . 0.0 114.607 -176.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.346 10.8 m-70 64.99 -49.72 0.34 Allowed 'General case' 0 C--N 1.357 0.93 0 C-N-CA 126.654 1.982 . . . . 0.0 113.837 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -67.25 30.74 0.2 Allowed Glycine 0 CA--C 1.474 -2.521 0 O-C-N 116.68 -3.762 . . . . 0.0 117.689 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . 0.46 ' H ' ' H ' ' A' 1767 ' ' LEU . 11.1 tt0 -166.12 4.8 0.03 OUTLIER 'General case' 0 C--N 1.359 0.986 0 C-N-CA 126.687 1.995 . . . . 0.0 109.176 -174.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . 0.46 ' H ' ' H ' ' A' 1766 ' ' GLN . 11.3 tp -82.84 67.87 9.09 Favored 'General case' 0 C--O 1.188 -2.159 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.862 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 75.6 m95 59.31 -48.88 0.07 Allowed 'General case' 0 CA--C 1.597 2.781 0 C-N-CA 130.328 3.451 . . . . 0.0 115.646 -165.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -84.1 125.81 71.59 Favored Pre-proline 0 C--N 1.297 -1.696 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 172.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -87.94 43.09 0.8 Allowed 'Trans proline' 0 N--CA 1.487 1.121 0 CA-C-N 121.656 1.627 . . . . 0.0 113.317 -169.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 . . . . . 0 N--CA 1.529 3.502 0 CA-C-O 116.267 -1.825 . . . . 0.0 113.593 -163.478 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.291 3.26 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -150.5 157.37 42.94 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.941 2.097 . . . . 0.0 111.511 -158.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 75.0 p -69.24 -0.29 5.9 Favored 'General case' 0 N--CA 1.507 2.396 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -76.76 -18.12 58.64 Favored 'General case' 0 C--N 1.29 -1.982 0 O-C-N 119.759 -1.838 . . . . 0.0 112.744 -175.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.339 1.4 m 61.46 32.01 18.95 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.616 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.383 0.3 OUTLIER 73.16 14.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.494 -1.192 0 CA-C-O 122.443 1.116 . . . . 0.0 113.89 -174.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 71.3 tt0 -71.95 131.69 85.4 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 117.722 -3.111 . . . . 0.0 109.947 170.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.19 147.96 49.04 Favored 'Trans proline' 0 N--CA 1.526 3.409 0 C-N-CA 122.901 2.401 . . . . 0.0 116.145 170.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -43.09 140.84 3.15 Favored 'Trans proline' 0 N--CA 1.499 1.806 1 C-N-CA 126.828 5.018 . . . . 0.0 111.576 -178.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -56.85 145.09 85.82 Favored 'Trans proline' 0 CA--C 1.592 3.423 0 CA-C-N 124.605 2.68 . . . . 0.0 118.016 176.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -58.34 160.66 15.9 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 123.828 3.018 . . . . 0.0 111.649 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -63.34 -18.72 63.95 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.254 1.821 . . . . 0.0 113.555 171.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -49.83 -22.54 1.49 Allowed 'General case' 0 C--O 1.21 -0.997 1 O-C-N 116.237 -4.04 . . . . 0.0 116.179 160.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 12.7 tp -80.99 -77.29 0.21 Allowed 'General case' 0 C--N 1.397 2.663 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 170.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 31.7 m80 -71.29 -57.45 4.46 Favored 'General case' 0 CA--C 1.597 2.775 0 C-N-CA 130.026 3.33 . . . . 0.0 111.375 -165.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 2.9 t80 -57.93 -40.45 80.49 Favored 'General case' 0 CA--C 1.491 -1.321 0 CA-C-O 116.001 -1.952 . . . . 0.0 111.507 173.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . 0.269 16.5 ttp -65.24 -39.52 92.8 Favored 'General case' 0 N--CA 1.527 3.386 0 C-N-CA 116.727 -1.989 . . . . 0.0 113.068 174.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 67.6 t80 -55.29 -46.3 76.21 Favored 'General case' 0 C--N 1.364 1.201 0 N-CA-C 117.22 2.304 . . . . 0.0 117.22 176.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 83.5 t -59.12 -54.34 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 O-C-N 118.241 -2.787 . . . . 0.0 106.911 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -57.3 -51.4 69.54 Favored 'General case' 0 C--O 1.26 1.617 0 O-C-N 125.702 1.876 . . . . 0.0 114.857 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -70.1 -49.22 53.12 Favored 'General case' 0 C--O 1.186 -2.275 0 O-C-N 119.499 -2.001 . . . . 0.0 108.498 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -61.06 -32.95 72.58 Favored 'General case' 0 C--O 1.195 -1.768 1 O-C-N 116.205 -4.06 . . . . 0.0 114.397 171.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -71.16 -37.02 72.24 Favored 'General case' 0 CA--C 1.478 -1.817 0 O-C-N 124.779 1.299 . . . . 0.0 110.983 -176.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 2.4 t80 -70.33 -44.88 67.31 Favored 'General case' 0 CA--C 1.477 -1.842 0 C-N-CA 129.608 3.163 . . . . 0.0 111.673 175.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 7.9 t -62.25 -45.98 97.5 Favored 'Isoleucine or valine' 0 C--O 1.246 0.892 0 N-CA-C 105.399 -2.074 . . . . 0.0 105.399 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 20.1 tp -57.1 -53.64 55.79 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 117.14 2.274 . . . . 0.0 117.14 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 28.2 tp -64.02 -39.28 93.75 Favored 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 129.255 3.022 . . . . 0.0 110.2 -173.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.479 60.7 t80 -71.25 -35.68 71.5 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 117.706 2.484 . . . . 0.0 117.706 167.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.585 16.0 t80 -64.52 -44.54 90.55 Favored 'General case' 0 CA--C 1.482 -1.646 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 175.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 53.9 t -86.4 -36.03 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.427 0 O-C-N 127.672 3.107 . . . . 0.0 110.396 -168.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -76.06 -39.07 33.48 Favored Glycine 0 CA--C 1.575 3.799 0 C-N-CA 114.405 -3.76 . . . . 0.0 111.219 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 50.8 t -62.56 -45.0 94.95 Favored 'General case' 0 CA--C 1.601 2.918 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 167.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -57.27 -16.88 22.2 Favored Glycine 1 CA--C 1.604 5.624 0 C-N-CA 125.232 1.396 . . . . 0.0 112.725 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 37.1 t -59.99 -52.96 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.41 0 O-C-N 119.135 -2.391 . . . . 0.0 109.639 172.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . 0.5 HD12 ' N ' ' A' 1756 ' ' LEU . 3.8 pp -95.97 -35.85 11.27 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 112.873 -1.967 . . . . 0.0 115.003 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . 0.5 ' N ' HD12 ' A' 1755 ' ' LEU . 11.6 tp -64.19 -22.61 67.01 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 170.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 12.3 t -46.95 -40.72 14.85 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 167.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . . . . . . . . 0.276 7.2 tpt180 -74.29 -67.28 0.63 Allowed 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 112.817 -3.468 . . . . 0.0 107.867 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . 0.474 ' HG3' ' H ' ' A' 1760 ' ' ARG . 2.6 ptpt -177.71 -69.42 0.01 OUTLIER 'General case' 0 C--N 1.376 1.735 0 O-C-N 128.606 3.691 . . . . 0.0 110.961 168.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . 0.474 ' H ' ' HG3' ' A' 1759 ' ' LYS 0.25 43.5 ttt85 50.59 -42.23 0.01 OUTLIER 'General case' 0 C--N 1.391 2.38 0 N-CA-C 118.486 2.772 . . . . 0.0 118.486 -171.307 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -108.6 -100.43 0.37 Allowed 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 177.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 55.18 31.51 16.57 Favored 'General case' 0 C--O 1.273 2.329 1 O-C-N 114.923 -4.861 . . . . 0.0 114.462 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 11.4 pm0 -81.09 49.79 1.3 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 117.115 -3.49 . . . . 0.0 110.408 176.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.39 36.7 m80 64.21 -176.32 0.16 Allowed 'General case' 0 N--CA 1.483 1.203 0 O-C-N 119.13 -2.231 . . . . 0.0 110.009 -164.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . 67.32 -10.96 0.83 Allowed Glycine 1 N--CA 1.536 5.361 0 O-C-N 116.863 -3.648 . . . . 0.0 113.314 -177.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -150.17 15.76 0.82 Allowed 'General case' 0 C--O 1.193 -1.887 0 C-N-CA 127.269 2.228 . . . . 0.0 107.127 -154.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . . . . . . . . 0.26 25.9 tp -101.18 66.05 1.11 Allowed 'General case' 0 CA--C 1.601 2.925 0 CA-C-O 127.826 3.679 . . . . 0.0 106.046 -165.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.409 47.0 t-105 76.8 -63.51 0.37 Allowed 'General case' 0 N--CA 1.419 -1.976 0 C-N-CA 128.617 2.767 . . . . 0.0 111.581 -176.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . 0.411 20.2 m-85 -74.22 147.03 85.2 Favored Pre-proline 0 C--O 1.268 2.034 0 CA-C-N 112.879 -1.964 . . . . 0.0 112.042 158.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.58 112.88 3.62 Favored 'Trans proline' 0 CA--C 1.572 2.38 0 C-N-CA 124.896 3.731 . . . . 0.0 106.883 152.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . . . . . . . . 0.337 9.0 tm-20 . . . . . 0 C--O 1.267 1.988 1 O-C-N 130.124 4.64 . . . . 0.0 115.773 173.552 . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.35 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -142.45 -5.14 0.96 Allowed 'General case' 0 CA--C 1.564 1.515 0 C-N-CA 126.664 1.985 . . . . 0.0 112.748 169.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 9.5 t -79.05 109.26 13.19 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 -174.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . 0.282 89.2 mt-10 52.62 4.11 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 -177.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 7.3 t -94.85 -29.65 14.6 Favored 'General case' 0 N--CA 1.423 -1.804 0 O-C-N 118.118 -2.864 . . . . 0.0 113.667 172.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 68.9 t -143.34 104.72 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.325 0 C-N-CA 128.818 2.847 . . . . 0.0 110.395 171.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -154.46 94.51 2.77 Favored Pre-proline 0 CA--C 1.589 2.456 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -61.32 162.02 21.6 Favored 'Trans proline' 0 CA--C 1.582 2.888 0 O-C-N 116.481 -2.431 . . . . 0.0 113.563 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -68.35 162.43 40.56 Favored 'Trans proline' 0 N--CA 1.426 -2.455 0 C-N-CA 124.488 3.459 . . . . 0.0 113.696 170.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -68.73 162.02 42.97 Favored 'Trans proline' 0 C--O 1.259 1.574 0 C-N-CA 122.17 1.913 . . . . 0.0 113.204 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -60.58 141.42 95.21 Favored 'Trans proline' 0 C--O 1.257 1.451 0 C-N-CA 123.921 3.081 . . . . 0.0 114.032 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -59.13 -17.38 26.31 Favored 'General case' 0 C--O 1.243 0.719 0 O-C-N 118.826 -2.422 . . . . 0.0 112.837 163.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -51.97 -30.8 26.5 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 123.726 2.966 . . . . 0.0 116.096 164.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 3.4 tt -74.26 -61.02 2.0 Favored 'General case' 0 C--O 1.195 -1.793 0 O-C-N 125.516 1.76 . . . . 0.0 110.659 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 53.7 m80 -73.99 -57.68 3.81 Favored 'General case' 0 C--O 1.277 2.517 0 C-N-CA 128.912 2.885 . . . . 0.0 110.246 -169.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 2.1 t80 -63.89 -32.04 73.43 Favored 'General case' 0 CA--C 1.575 1.939 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 36.2 ttm -77.1 -36.63 55.46 Favored 'General case' 0 C--N 1.381 1.938 0 O-C-N 118.035 -2.916 . . . . 0.0 113.218 174.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . . 24.6 t80 -55.28 -42.03 73.04 Favored 'General case' 0 CA--C 1.475 -1.918 0 O-C-N 119.259 -2.151 . . . . 0.0 112.231 174.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . 0.41 ' O ' ' HB3' ' A' 1743 ' ' ALA . 25.2 t -69.76 -41.09 79.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 CA-C-N 124.098 3.136 . . . . 0.0 109.748 175.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -69.06 -34.06 74.57 Favored 'General case' 0 CA--C 1.625 3.845 0 O-C-N 117.525 -3.234 . . . . 0.0 111.318 -176.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -81.85 -47.44 12.81 Favored 'General case' 0 C--N 1.291 -1.952 0 C-N-CA 129.129 2.972 . . . . 0.0 109.204 175.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -78.03 -27.16 48.74 Favored 'General case' 0 C--O 1.198 -1.608 0 CA-C-N 122.068 2.213 . . . . 0.0 109.226 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' 1739 ' ' VAL . . . -77.4 -36.47 53.35 Favored 'General case' 0 C--O 1.202 -1.434 0 O-C-N 116.595 -3.816 . . . . 0.0 110.049 172.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 8.7 t80 -72.54 -34.0 67.24 Favored 'General case' 0 C--N 1.291 -1.977 0 O-C-N 119.901 -1.75 . . . . 0.0 107.989 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 2.6 t -83.14 -29.63 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 N-CA-C 104.339 -2.467 . . . . 0.0 104.339 -171.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 14.7 tp -81.64 -56.72 3.83 Favored 'General case' 0 C--O 1.26 1.61 0 CA-C-N 118.958 0.799 . . . . 0.0 109.792 175.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . 0.415 ' HA ' HD12 ' A' 1747 ' ' LEU . 22.3 tp -63.64 -22.66 67.02 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 118.419 -2.676 . . . . 0.0 110.43 -174.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . . . . . . . . . 35.3 t80 -81.98 -45.57 15.17 Favored 'General case' 0 C--O 1.193 -1.902 0 O-C-N 118.294 -2.754 . . . . 0.0 115.35 166.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.402 46.5 t80 -66.7 -13.32 61.15 Favored 'General case' 0 C--N 1.265 -3.088 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 177.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 93.9 t -102.37 -42.6 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.442 -3.205 0 CA-C-O 113.72 -3.038 . . . . 0.0 109.162 167.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -62.88 -49.2 74.56 Favored Glycine 1 N--CA 1.526 4.665 1 CA-C-N 126.433 4.197 . . . . 0.0 110.609 -176.809 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 46.3 t -79.76 -31.0 40.89 Favored 'General case' 0 C--O 1.197 -1.684 0 CA-C-O 114.753 -2.546 . . . . 0.0 108.066 173.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -68.32 -21.82 74.32 Favored Glycine 0 C--O 1.202 -1.889 0 CA-C-N 122.662 2.483 . . . . 0.0 116.946 176.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 3.8 t -84.83 -38.22 13.16 Favored 'Isoleucine or valine' 0 C--O 1.266 1.954 0 O-C-N 128.453 3.09 . . . . 0.0 107.342 -175.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.57 -27.67 25.37 Favored 'General case' 0 CA--C 1.494 -1.193 1 O-C-N 116.219 -4.05 . . . . 0.0 116.359 167.471 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . . . . . . . . 0.32 1.4 tt -80.96 -11.67 59.53 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 122.214 2.279 . . . . 0.0 113.057 173.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 56.5 p -49.94 -38.96 38.74 Favored 'General case' 0 N--CA 1.533 3.707 0 O-C-N 119.025 -2.297 . . . . 0.0 109.321 173.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -46.92 -61.81 1.69 Allowed 'General case' 0 N--CA 1.485 1.305 0 O-C-N 125.412 1.695 . . . . 0.0 111.148 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . . . . . . . . 0.31 34.6 pttt -176.88 -108.99 0.0 OUTLIER 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 116.33 -1.795 . . . . 0.0 108.091 -171.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . 0.42 ' O ' ' HD3' ' A' 1760 ' ' ARG . 0.0 OUTLIER 61.07 -12.08 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 131.088 3.755 . . . . 0.0 113.624 -178.387 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 63.54 89.27 0.09 Allowed 'General case' 0 N--CA 1.52 3.047 0 CA-C-O 124.636 2.16 . . . . 0.0 106.456 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.26 141.72 8.19 Favored 'General case' 0 CA--C 1.473 -1.985 0 N-CA-C 118.0 2.593 . . . . 0.0 118.0 169.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . 0.354 8.2 tp60 67.51 156.31 0.11 Allowed 'General case' 0 N--CA 1.424 -1.774 0 O-C-N 120.257 -1.527 . . . . 0.0 110.676 -169.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 28.5 m170 58.75 -17.77 0.02 OUTLIER 'General case' 0 C--N 1.377 1.764 0 N-CA-C 121.689 3.959 . . . . 0.0 121.689 -170.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -117.62 23.97 9.29 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 127.238 2.352 . . . . 0.0 115.429 168.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -147.56 6.11 0.82 Allowed 'General case' 0 N--CA 1.514 2.749 0 CA-C-O 116.173 -1.87 . . . . 0.0 113.511 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 27.4 tp -107.64 66.03 0.65 Allowed 'General case' 0 CA--C 1.455 -2.711 0 O-C-N 126.218 2.199 . . . . 0.0 111.912 -165.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 47.2 m95 71.93 -49.98 0.69 Allowed 'General case' 0 CA--C 1.452 -2.813 1 C-N-CA 134.732 5.213 . . . . 0.0 111.891 -175.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -99.2 96.59 4.37 Favored Pre-proline 0 C--O 1.285 2.93 0 CA-C-O 116.388 -1.768 . . . . 0.0 114.037 165.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . 0.288 68.2 Cg_endo -64.2 92.55 0.18 Allowed 'Trans proline' 0 C--N 1.378 2.131 1 C-N-CA 126.971 5.114 . . . . 0.0 112.349 -178.003 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 8.3 tp10 . . . . . 0 C--N 1.368 1.381 0 O-C-N 127.524 3.015 . . . . 0.0 110.72 -172.951 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -125.8 179.95 4.95 Favored 'General case' 0 CA--C 1.588 2.434 0 CA-C-O 123.315 1.531 . . . . 0.0 107.127 -175.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 22.2 t -106.29 140.32 39.41 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-O 115.365 -2.255 . . . . 0.0 115.416 174.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 8.5 tp10 62.46 -28.44 0.07 Allowed 'General case' 0 N--CA 1.483 1.212 1 O-C-N 129.546 4.279 . . . . 0.0 114.997 -163.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.261 0.3 OUTLIER -67.91 13.27 0.08 Allowed 'General case' 0 CA--C 1.596 2.731 0 C-N-CA 127.81 2.444 . . . . 0.0 117.401 175.858 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . 0.448 1.4 t -64.02 -101.86 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.577 2.007 0 C-N-CA 128.738 2.815 . . . . 0.0 113.966 164.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . . . . . . . . 0.259 13.7 tt0 -151.74 111.5 2.94 Favored Pre-proline 0 N--CA 1.489 1.51 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 164.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -63.6 149.19 91.54 Favored 'Trans proline' 0 N--CA 1.43 -2.263 0 C-N-CA 125.066 3.844 . . . . 0.0 113.442 173.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -73.37 157.92 48.94 Favored 'Trans proline' 0 CA--C 1.578 2.708 0 C-N-CA 124.031 3.154 . . . . 0.0 110.59 170.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.32 155.1 5.17 Favored 'Trans proline' 0 N--CA 1.452 -0.961 1 C-N-CA 128.452 6.102 . . . . 0.0 108.68 168.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . 0.281 91.6 Cg_endo -73.29 99.37 1.11 Allowed 'Trans proline' 0 C--N 1.405 3.52 1 C-N-CA 129.558 6.839 . . . . 0.0 113.015 -176.183 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -53.84 -24.7 16.55 Favored 'General case' 0 N--CA 1.418 -2.052 0 C-N-CA 128.395 2.678 . . . . 0.0 111.876 177.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -39.94 -49.68 2.47 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.781 2.882 . . . . 0.0 118.781 160.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . 0.266 34.4 mt -62.36 -48.94 77.55 Favored 'General case' 0 C--N 1.275 -2.666 0 C-N-CA 126.962 2.105 . . . . 0.0 112.902 -172.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . . . . . . . . 0.309 36.0 m80 -64.35 -44.22 92.16 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 113.194 -1.821 . . . . 0.0 113.525 169.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 24.7 t80 -62.66 -54.59 37.18 Favored 'General case' 0 C--O 1.193 -1.897 0 C-N-CA 128.618 2.767 . . . . 0.0 112.618 -174.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 54.4 ttm -74.15 -27.56 60.9 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-N 110.661 -2.972 . . . . 0.0 113.991 176.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.283 43.9 t80 -55.2 -51.7 65.72 Favored 'General case' 0 N--CA 1.51 2.531 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 160.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 32.5 t -60.81 -46.68 95.75 Favored 'Isoleucine or valine' 0 C--N 1.357 0.9 0 O-C-N 120.422 -1.424 . . . . 0.0 111.663 172.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -67.53 -39.56 85.04 Favored 'General case' 0 C--N 1.279 -2.495 0 CA-C-O 115.777 -2.059 . . . . 0.0 112.724 -173.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -75.18 -45.68 39.08 Favored 'General case' 0 C--N 1.378 1.828 0 CA-C-O 114.455 -2.688 . . . . 0.0 107.744 175.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -58.14 -42.46 85.92 Favored 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 122.227 2.285 . . . . 0.0 112.87 175.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -69.0 -29.34 67.52 Favored 'General case' 0 N--CA 1.428 -1.543 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 175.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 42.5 t80 -83.67 -35.56 24.45 Favored 'General case' 0 C--O 1.271 2.221 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 70.3 t -71.53 -40.9 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.386 -3.674 0 C-N-CA 126.88 2.072 . . . . 0.0 116.587 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.39 -46.24 67.38 Favored 'General case' 0 C--O 1.207 -1.168 0 CA-C-N 114.719 -1.128 . . . . 0.0 112.385 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 8.3 tt -69.22 -34.44 74.86 Favored 'General case' 0 N--CA 1.425 -1.694 0 CA-C-O 124.296 1.998 . . . . 0.0 110.894 -175.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.391 20.3 t80 -66.94 -63.79 0.99 Allowed 'General case' 0 CA--C 1.478 -1.79 0 CA-C-O 113.916 -2.945 . . . . 0.0 111.646 169.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.259 4.4 t80 -77.17 -2.95 37.08 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 127.349 2.906 . . . . 0.0 114.226 -169.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 91.8 t -92.53 -35.55 6.86 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.367 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 164.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -75.45 -45.38 18.67 Favored Glycine 0 N--CA 1.498 2.826 1 CA-C-O 128.741 4.523 . . . . 0.0 110.672 -176.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 47.8 t -67.55 -33.5 75.17 Favored 'General case' 0 CA--C 1.574 1.898 1 C-N-CA 133.826 4.85 . . . . 0.0 106.024 170.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -76.0 -22.34 74.35 Favored Glycine 0 CA--C 1.559 2.836 0 O-C-N 116.993 -3.567 . . . . 0.0 114.276 175.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 1.6 t -72.26 -46.93 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 118.457 -2.79 . . . . 0.0 112.822 176.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.54 -31.01 63.43 Favored 'General case' 0 CA--C 1.572 1.794 0 CA-C-N 112.838 -1.983 . . . . 0.0 110.9 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 22.5 mt -80.32 -31.73 38.04 Favored 'General case' 0 C--O 1.256 1.437 0 CA-C-O 124.239 1.971 . . . . 0.0 112.195 178.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 28.6 t -60.85 -30.29 70.03 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.292 -1.322 . . . . 0.0 114.077 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -82.99 -61.57 1.83 Allowed 'General case' 0 N--CA 1.528 3.453 0 CA-C-O 116.688 -1.625 . . . . 0.0 107.678 168.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 3.2 pttt -172.37 -56.01 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 120.909 1.686 . . . . 0.0 107.993 166.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 57.52 -55.31 0.03 OUTLIER 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 113.72 -3.038 . . . . 0.0 110.64 -154.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 5.6 tpp180 58.86 60.35 2.51 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 128.002 2.521 . . . . 0.0 111.545 -177.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -84.65 139.42 32.06 Favored 'General case' 0 N--CA 1.419 -1.984 0 O-C-N 119.065 -2.272 . . . . 0.0 116.742 162.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -177.92 95.37 0.04 OUTLIER 'General case' 0 CA--C 1.597 2.761 0 C-N-CA 127.529 2.332 . . . . 0.0 109.153 167.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 72.3 m-70 58.97 -48.3 0.06 Allowed 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 127.786 2.434 . . . . 0.0 112.983 175.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -61.78 8.76 0.12 Allowed Glycine 0 C--O 1.223 -0.551 0 N-CA-C 122.095 3.598 . . . . 0.0 122.095 175.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -151.29 2.35 0.41 Allowed 'General case' 0 N--CA 1.491 1.61 1 C-N-CA 132.626 4.37 . . . . 0.0 115.869 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 6.7 tp -89.05 83.21 6.56 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-O 125.178 2.418 . . . . 0.0 113.521 -173.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 50.4 t-105 66.74 -57.05 0.41 Allowed 'General case' 0 C--N 1.372 1.56 1 C-N-CA 135.043 5.337 . . . . 0.0 109.524 -177.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -83.83 133.93 45.27 Favored Pre-proline 0 C--N 1.376 1.744 0 O-C-N 118.946 -2.346 . . . . 0.0 109.183 157.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -84.63 61.19 6.16 Favored 'Trans proline' 0 N--CA 1.425 -2.506 1 C-N-CA 128.773 6.315 . . . . 0.0 107.568 178.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . . . . . . . . 0.306 73.7 mm-40 . . . . . 0 C--O 1.265 1.91 0 N-CA-C 118.098 2.629 . . . . 0.0 118.098 -170.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . 0.544 ' N ' ' HG1' ' A' 1725 ' ' THR 0.389 0.2 OUTLIER . . . . . 0 N--CA 1.52 3.052 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 . . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -156.39 158.27 37.05 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 104.481 -2.414 . . . . 0.0 104.481 -166.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 60.5 p -61.85 -24.04 66.65 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 117.695 -1.602 . . . . 0.0 113.423 -167.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . 0.262 23.6 pt-20 -78.58 -15.73 58.22 Favored 'General case' 0 C--N 1.371 1.533 0 CA-C-N 121.583 1.992 . . . . 0.0 115.202 178.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . 0.544 ' HG1' ' N ' ' A' 1721 ' ' VAL 0.41 0.1 OUTLIER -76.14 -10.72 59.64 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 121.338 3.829 . . . . 0.0 121.338 166.188 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 10.1 m -127.14 -1.97 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.538 3.93 0 O-C-N 120.917 -1.115 . . . . 0.0 111.686 -164.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -66.98 129.83 93.98 Favored Pre-proline 0 CA--C 1.564 1.489 0 CA-C-N 122.36 2.346 . . . . 0.0 116.135 177.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -62.12 149.81 89.06 Favored 'Trans proline' 0 CA--C 1.49 -1.716 0 C-N-CA 121.366 1.377 . . . . 0.0 108.64 168.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . 0.266 52.2 Cg_exo -50.26 147.6 15.76 Favored 'Trans proline' 0 C--O 1.26 1.604 0 CA-C-O 113.928 -2.613 . . . . 0.0 115.581 172.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -59.62 147.24 92.71 Favored 'Trans proline' 0 C--N 1.386 2.541 0 N-CA-C 105.986 -2.352 . . . . 0.0 105.986 176.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -64.77 114.22 2.67 Favored 'Trans proline' 0 CA--C 1.577 2.657 0 C-N-CA 122.688 2.259 . . . . 0.0 112.319 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -66.62 -9.94 40.71 Favored 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 113.92 -1.491 . . . . 0.0 114.286 -177.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 30.3 tp60 -50.47 -35.94 31.24 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 167.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 25.7 tp -60.16 -58.38 8.76 Favored 'General case' 0 C--N 1.292 -1.922 0 C-N-CA 128.656 2.782 . . . . 0.0 111.85 173.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 21.6 m80 -60.48 -51.42 69.54 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.542 1.137 . . . . 0.0 114.027 177.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 13.4 t80 -54.98 -48.59 73.07 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 111.327 -2.669 . . . . 0.0 116.655 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . 0.27 61.0 ttp -75.66 -37.49 59.57 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 128.434 2.693 . . . . 0.0 112.634 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.519 83.5 t80 -44.57 -58.84 2.77 Favored 'General case' 0 N--CA 1.437 -1.094 1 N-CA-C 122.521 4.267 . . . . 0.0 122.521 157.218 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 61.8 t -79.1 -36.77 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-N 113.005 -1.907 . . . . 0.0 108.298 -172.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -56.76 -47.69 79.52 Favored 'General case' 0 CA--C 1.578 2.049 0 O-C-N 121.257 -0.902 . . . . 0.0 111.904 176.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -76.38 -39.29 54.16 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 116.012 -1.947 . . . . 0.0 106.395 -179.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -56.71 -40.45 75.69 Favored 'General case' 0 C--O 1.264 1.864 0 CA-C-N 121.448 1.931 . . . . 0.0 112.091 172.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -74.39 -39.49 62.66 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.957 0.903 . . . . 0.0 109.431 -174.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 1.6 t80 -70.32 -37.75 74.8 Favored 'General case' 0 C--N 1.349 0.574 0 O-C-N 118.135 -2.853 . . . . 0.0 115.299 174.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 85.8 t -78.57 -41.58 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.93 0 O-C-N 127.734 3.147 . . . . 0.0 108.933 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.46 -37.53 87.12 Favored 'General case' 0 CA--C 1.581 2.17 0 CA-C-O 116.353 -1.784 . . . . 0.0 109.132 -175.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 26.1 tp -81.9 -46.77 13.62 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 103.864 -2.643 . . . . 0.0 103.864 -167.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . . . . . . . . . 85.0 t80 -60.33 -45.8 92.15 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 118.582 2.808 . . . . 0.0 118.582 163.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.336 44.0 t80 -63.04 -31.85 73.09 Favored 'General case' 0 C--O 1.196 -1.758 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 174.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 7.5 t -78.62 -39.26 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 -176.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -73.0 -35.46 57.83 Favored Glycine 0 C--O 1.25 1.101 0 N-CA-C 108.958 -1.657 . . . . 0.0 108.958 -176.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 41.8 t -65.18 -45.62 84.14 Favored 'General case' 0 N--CA 1.487 1.42 1 C-N-CA 131.843 4.057 . . . . 0.0 106.975 172.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -79.38 -27.86 54.07 Favored Glycine 1 N--CA 1.392 -4.255 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 -165.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . 0.31 2.1 p -76.4 -30.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.784 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -179.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 1.3 pp -94.94 -16.7 22.61 Favored 'General case' 0 C--N 1.386 2.196 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 173.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 86.1 mt -77.19 -23.89 51.44 Favored 'General case' 0 C--N 1.384 2.068 0 CA-C-O 114.404 -2.713 . . . . 0.0 110.829 158.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 9.1 t -38.67 -50.12 1.61 Allowed 'General case' 0 C--O 1.273 2.3 0 CA-C-N 123.536 2.88 . . . . 0.0 116.358 -174.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 19.1 ttt-85 -79.02 -66.46 0.86 Allowed 'General case' 0 CA--C 1.553 1.071 0 O-C-N 125.929 2.018 . . . . 0.0 110.646 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . 0.481 ' HG3' ' H ' ' A' 1760 ' ' ARG . 15.9 pttt -167.23 -60.21 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.017 1 C-N-CA 132.01 4.124 . . . . 0.0 117.202 166.167 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . 0.481 ' H ' ' HG3' ' A' 1759 ' ' LYS . 34.9 ttt85 56.13 -14.83 0.01 OUTLIER 'General case' 0 C--N 1.379 1.872 0 N-CA-C 119.679 3.214 . . . . 0.0 119.679 -174.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 62.58 78.73 0.28 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.655 1.982 . . . . 0.0 115.191 162.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . 0.49 ' HA ' ' HB3' ' A' 1766 ' ' GLN . 29.8 mtp180 -119.7 56.7 0.93 Allowed 'General case' 0 N--CA 1.414 -2.263 0 C-N-CA 131.271 3.828 . . . . 0.0 112.997 169.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -140.03 149.49 43.24 Favored 'General case' 0 C--O 1.184 -2.351 0 CA-C-N 112.367 -2.197 . . . . 0.0 107.437 165.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . 0.255 8.9 m80 56.85 -81.25 0.01 OUTLIER 'General case' 0 CA--C 1.574 1.878 0 O-C-N 126.693 2.495 . . . . 0.0 114.542 -176.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -63.74 -3.02 6.92 Favored Glycine 0 C--N 1.388 3.471 0 O-C-N 118.092 -2.88 . . . . 0.0 117.679 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . 0.49 ' HB3' ' HA ' ' A' 1762 ' ' ARG . 2.4 tp60 -144.26 31.21 1.24 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 128.025 2.53 . . . . 0.0 109.136 172.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 12.1 tp -74.9 51.75 0.51 Allowed 'General case' 0 CA--C 1.578 2.055 0 O-C-N 118.102 -2.874 . . . . 0.0 112.694 -171.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.431 2.7 t90 64.24 -39.37 0.23 Allowed 'General case' 0 C--O 1.262 1.743 1 O-C-N 115.458 -4.526 . . . . 0.0 116.775 -158.183 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 78.4 t80 -109.38 109.56 60.23 Favored Pre-proline 0 N--CA 1.433 -1.322 0 C-N-CA 128.902 2.881 . . . . 0.0 106.129 173.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -80.49 130.5 7.96 Favored 'Trans proline' 0 N--CA 1.443 -1.475 0 CA-C-O 121.351 0.48 . . . . 0.0 112.093 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 53.9 tt0 . . . . . 0 C--O 1.295 3.482 0 CA-C-O 113.753 -3.022 . . . . 0.0 112.026 -174.789 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.273 2.34 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 28.8 mp0 -146.84 -33.08 0.3 Allowed 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 116.653 -1.641 . . . . 0.0 114.673 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 27.7 t -80.9 118.64 22.58 Favored 'General case' 0 N--CA 1.427 -1.601 0 O-C-N 126.89 2.619 . . . . 0.0 111.181 175.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -49.62 -35.13 20.01 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.679 -1.263 . . . . 0.0 110.488 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . . . . . . . . . 8.3 m -62.0 -13.21 23.55 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -176.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 1.9 m -140.0 32.75 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.259 1.59 0 O-C-N 119.106 -2.246 . . . . 0.0 109.188 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -80.41 114.13 44.92 Favored Pre-proline 0 CA--C 1.607 3.16 0 O-C-N 118.752 -2.467 . . . . 0.0 115.135 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . . . . . . . . 0.321 4.9 Cg_exo -72.2 159.64 49.23 Favored 'Trans proline' 0 C--O 1.279 2.537 0 C-N-CA 121.702 1.602 . . . . 0.0 112.371 -175.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -65.63 163.47 30.09 Favored 'Trans proline' 0 CA--C 1.567 2.138 0 C-N-CA 122.059 1.839 . . . . 0.0 109.093 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -73.68 160.76 43.33 Favored 'Trans proline' 0 CA--C 1.556 1.605 0 C-N-CA 123.816 3.01 . . . . 0.0 112.77 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -81.34 152.23 17.98 Favored 'Trans proline' 0 N--CA 1.521 3.137 0 C-N-CA 124.687 3.591 . . . . 0.0 110.865 -172.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -61.48 -14.46 29.05 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 116.465 2.024 . . . . 0.0 116.465 177.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -58.17 -27.9 64.25 Favored 'General case' 0 CA--C 1.615 3.462 0 C-N-CA 128.336 2.655 . . . . 0.0 106.135 177.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 6.4 mt -81.46 -81.25 0.14 Allowed 'General case' 0 C--N 1.36 1.03 0 CA-C-N 120.097 1.317 . . . . 0.0 109.34 171.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 63.4 m80 -55.12 -58.45 7.6 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 116.452 -1.737 . . . . 0.0 109.678 -168.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . 0.356 52.8 t80 -60.5 -42.32 96.13 Favored 'General case' 0 CA--C 1.485 -1.528 0 O-C-N 125.964 2.04 . . . . 0.0 113.664 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . . 11.7 ttp -65.72 -38.03 88.05 Favored 'General case' 0 C--N 1.387 2.22 0 C-N-CA 113.673 -3.211 . . . . 0.0 113.578 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.525 12.2 t80 -47.73 -50.7 24.5 Favored 'General case' 0 C--O 1.25 1.123 0 N-CA-C 120.323 3.453 . . . . 0.0 120.323 169.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . . . . . . . . . 96.8 t -73.83 -38.0 49.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 O-C-N 119.446 -2.034 . . . . 0.0 111.591 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -64.77 -42.85 94.8 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-O 122.849 1.309 . . . . 0.0 111.986 -178.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -71.51 -49.47 40.72 Favored 'General case' 0 N--CA 1.438 -1.036 0 C-N-CA 128.525 2.73 . . . . 0.0 109.425 178.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.48 81.04 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.576 -1.25 . . . . 0.0 112.627 176.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -70.39 -38.78 74.76 Favored 'General case' 0 N--CA 1.418 -2.069 0 O-C-N 117.246 -3.409 . . . . 0.0 111.612 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . . . . . . . . . 35.2 t80 -65.69 -48.7 71.15 Favored 'General case' 0 C--N 1.376 1.744 0 C-N-CA 126.312 1.845 . . . . 0.0 110.826 173.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 63.0 t -72.56 -30.31 33.65 Favored 'Isoleucine or valine' 0 CA--C 1.446 -3.046 0 CA-C-N 119.639 1.109 . . . . 0.0 111.519 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 45.8 tp -69.56 -44.19 71.37 Favored 'General case' 0 C--N 1.296 -1.728 1 O-C-N 114.956 -4.84 . . . . 0.0 111.272 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 53.4 tp -74.32 -40.29 62.32 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 128.482 2.713 . . . . 0.0 108.024 -176.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . . . . . . . . 0.302 38.9 t80 -55.36 -52.17 64.41 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 117.272 2.323 . . . . 0.0 117.272 160.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.324 2.4 t80 -70.4 -28.33 64.99 Favored 'General case' 0 C--N 1.401 2.839 0 C-N-CA 117.139 -1.824 . . . . 0.0 113.381 -169.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 23.3 t -83.21 -46.72 18.62 Favored 'Isoleucine or valine' 0 C--O 1.172 -2.988 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.32 175.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -64.45 -52.67 41.35 Favored Glycine 0 CA--C 1.558 2.74 0 CA-C-N 121.441 1.928 . . . . 0.0 113.697 -176.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . . . . . . . . . 42.6 t -70.0 -34.83 73.83 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-O 113.048 -3.358 . . . . 0.0 107.182 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -61.28 -34.83 89.63 Favored Glycine 0 C--O 1.265 2.037 0 O-C-N 125.575 1.797 . . . . 0.0 112.678 174.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -74.28 -33.12 33.38 Favored 'Isoleucine or valine' 0 C--O 1.266 1.962 0 CA-C-N 120.429 2.114 . . . . 0.0 108.036 -168.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 1.3 pp -93.95 -26.49 16.82 Favored 'General case' 0 N--CA 1.428 -1.541 0 O-C-N 119.94 -1.725 . . . . 0.0 114.599 172.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 9.8 tp -64.47 -31.67 72.97 Favored 'General case' 0 N--CA 1.524 3.241 0 CA-C-N 121.184 1.811 . . . . 0.0 109.424 171.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . . 59.9 p -65.46 -31.17 72.11 Favored 'General case' 0 C--O 1.2 -1.531 0 N-CA-C 117.864 2.542 . . . . 0.0 117.864 -170.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . 0.422 ' HG3' ' H ' ' A' 1758 ' ' ARG . 2.4 mtt180 -61.41 -42.38 98.65 Favored 'General case' 0 C--O 1.257 1.482 1 O-C-N 115.265 -4.647 . . . . 0.0 110.426 -172.082 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 12.7 ptmt -169.55 -17.3 0.02 OUTLIER 'General case' 0 C--N 1.365 1.242 0 C-N-CA 128.998 2.919 . . . . 0.0 114.962 162.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -56.11 -10.55 0.86 Allowed 'General case' 0 N--CA 1.505 2.292 0 CA-C-N 124.412 3.278 . . . . 0.0 118.632 -165.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -51.84 135.35 30.03 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 118.839 -2.413 . . . . 0.0 107.913 167.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -134.64 -75.33 0.46 Allowed 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 114.669 -2.586 . . . . 0.0 108.896 169.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . 0.28 17.0 mp0 61.49 -155.69 0.35 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 128.627 3.705 . . . . 0.0 113.915 168.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 55.2 m80 36.91 -86.39 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 CA-C-O 114.17 -2.824 . . . . 0.0 113.324 169.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -67.51 5.0 3.41 Favored Glycine 0 C--O 1.198 -2.112 0 CA-C-N 122.815 2.552 . . . . 0.0 115.305 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -145.87 26.24 1.25 Allowed 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 128.179 2.591 . . . . 0.0 107.771 -171.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . . . . . . . . . 40.9 tp -89.21 57.42 4.04 Favored 'General case' 0 C--O 1.19 -2.048 0 O-C-N 120.103 -1.623 . . . . 0.0 111.335 -170.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . 0.433 6.5 p90 58.69 -44.52 0.06 Allowed 'General case' 0 C--N 1.372 1.572 0 C-N-CA 130.607 3.563 . . . . 0.0 115.349 -159.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -84.87 128.44 60.59 Favored Pre-proline 0 C--N 1.314 -0.96 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 169.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . 0.277 0.5 OUTLIER -80.56 55.01 5.49 Favored 'Trans proline' 0 CA--C 1.582 2.881 1 C-N-CA 126.737 4.958 . . . . 0.0 111.716 179.631 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 47.9 tp10 . . . . . 0 N--CA 1.506 2.367 0 CA-C-N 120.157 1.344 . . . . 0.0 113.09 -168.469 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1721 ' ' VAL . . . . . . . . . . . . 0.474 2.3 t . . . . . 0 N--CA 1.502 2.164 0 CA-C-O 123.023 1.392 . . . . 0.0 112.89 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1722 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.77 159.2 42.71 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 112.191 -2.277 . . . . 0.0 106.657 -176.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1723 ' ' SER . . . . . . . . . . . . . 13.1 t -62.18 -29.05 70.1 Favored 'General case' 0 C--O 1.267 2.002 0 N-CA-C 119.245 3.054 . . . . 0.0 119.245 163.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1724 ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.0 -5.32 43.36 Favored 'General case' 0 C--O 1.196 -1.741 0 CA-C-N 112.81 -1.996 . . . . 0.0 114.278 -176.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1725 ' ' THR . . . . . . . . . . . . 0.476 0.2 OUTLIER -81.51 -49.12 10.96 Favored 'General case' 0 C--O 1.253 1.243 0 N-CA-C 117.3 2.333 . . . . 0.0 117.3 168.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1726 ' ' VAL . . . . . . . . . . . . . 7.5 p -101.97 56.01 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.537 3.88 0 CA-C-O 124.446 2.07 . . . . 0.0 111.578 -176.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1727 ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -130.04 127.1 22.63 Favored Pre-proline 0 CA--C 1.56 1.335 0 CA-C-O 114.128 -2.844 . . . . 0.0 108.587 174.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1728 ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.11 157.47 50.6 Favored 'Trans proline' 0 CA--C 1.493 -1.569 0 O-C-N 127.261 3.242 . . . . 0.0 108.823 176.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1729 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.78 162.92 14.54 Favored 'Trans proline' 0 C--O 1.266 1.886 0 N-CA-C 115.441 1.285 . . . . 0.0 115.441 177.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1730 ' ' PRO . . . . . . . . . . . . 0.251 6.3 Cg_exo -64.21 164.86 21.27 Favored 'Trans proline' 0 CA--C 1.587 3.148 0 C-N-CA 121.451 1.434 . . . . 0.0 110.314 174.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1731 ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -64.72 107.9 0.97 Allowed 'Trans proline' 0 N--CA 1.498 1.772 0 C-N-CA 124.336 3.357 . . . . 0.0 114.286 178.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1732 ' ' ALA . . . . . . . . . . . . . . . -68.86 -9.13 49.76 Favored 'General case' 0 N--CA 1.399 -3.017 0 CA-C-N 121.496 1.953 . . . . 0.0 110.904 175.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1733 ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -45.32 -32.41 2.01 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 127.482 2.313 . . . . 0.0 112.533 169.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1734 ' ' LEU . . . . . . . . . . . . . 1.4 mt -78.23 -48.9 14.8 Favored 'General case' 0 C--O 1.27 2.151 0 O-C-N 121.192 -0.942 . . . . 0.0 108.499 -176.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1735 ' ' HIS . . . . . . . . . . . . . 50.4 m80 -74.95 -52.15 11.9 Favored 'General case' 0 N--CA 1.496 1.871 0 C-N-CA 126.749 2.019 . . . . 0.0 112.581 -177.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1736 ' ' PHE . . . . . . . . . . . . . 18.1 t80 -56.23 -39.38 72.44 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 175.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1737 ' ' MET . . . . . . . . . . . . 0.27 2.3 ttp -80.21 -40.43 27.14 Favored 'General case' 0 CA--C 1.571 1.773 0 CA-C-O 123.686 1.708 . . . . 0.0 113.716 175.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1738 ' ' TYR . . . . . . . . . . . . 0.258 3.6 t80 -54.97 -37.77 66.92 Favored 'General case' 0 N--CA 1.414 -2.263 0 O-C-N 118.999 -2.313 . . . . 0.0 113.668 168.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1739 ' ' VAL . . . . . . . . . . . . 0.251 94.0 t -62.32 -67.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 CA-C-N 120.988 1.722 . . . . 0.0 110.58 167.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1740 ' ' ALA . . . . . . . . . . . . . . . -48.13 -47.17 34.86 Favored 'General case' 0 C--O 1.277 2.507 0 N-CA-C 116.295 1.961 . . . . 0.0 116.295 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1741 ' ' ALA . . . . . . . . . . . . . . . -76.14 -38.43 56.78 Favored 'General case' 0 CA--C 1.581 2.147 0 C-N-CA 127.851 2.46 . . . . 0.0 109.613 -177.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1742 ' ' ALA . . . . . . . . . . . . . . . -72.69 -38.91 67.4 Favored 'General case' 0 C--O 1.194 -1.849 0 O-C-N 118.077 -2.89 . . . . 0.0 111.45 177.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1743 ' ' ALA . . . . . . . . . . . . . . . -71.06 -36.95 72.48 Favored 'General case' 0 C--O 1.169 -3.148 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 173.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1744 ' ' PHE . . . . . 0.419 ' O ' ' HB3' ' A' 1748 ' ' PHE . 85.9 t80 -67.52 -38.83 84.83 Favored 'General case' 0 N--CA 1.428 -1.55 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 176.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1745 ' ' VAL . . . . . . . . . . . . . 13.6 t -79.12 -38.13 20.04 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.899 0 C-N-CA 117.523 -1.671 . . . . 0.0 106.636 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1746 ' ' LEU . . . . . . . . . . . . . 52.3 mt -92.75 -40.92 10.41 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 116.652 -3.78 . . . . 0.0 112.538 -168.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1747 ' ' LEU . . . . . . . . . . . . . 4.2 tp -73.69 -18.48 61.01 Favored 'General case' 0 C--N 1.375 1.683 0 C-N-CA 125.135 1.374 . . . . 0.0 110.574 175.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1748 ' ' PHE . . . . . 0.478 ' O ' ' HB3' ' A' 1752 ' ' CYS 0.522 1.4 t80 -81.63 -41.02 22.08 Favored 'General case' 0 CA--C 1.463 -2.394 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 156.612 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1749 ' ' PHE . . . . . . . . . . . . 0.575 64.5 t80 -63.06 -32.55 73.95 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 119.765 -1.835 . . . . 0.0 113.56 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1750 ' ' VAL . . . . . . . . . . . . . 55.4 t -92.9 -41.04 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 115.54 -2.172 . . . . 0.0 110.439 175.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1751 ' ' GLY . . . . . . . . . . . . . . . -68.1 -44.11 78.38 Favored Glycine 0 C--N 1.37 2.436 0 CA-C-N 124.385 3.266 . . . . 0.0 111.561 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1752 ' ' CYS . . . . . 0.478 ' HB3' ' O ' ' A' 1748 ' ' PHE . 42.4 t -79.11 -39.96 32.33 Favored 'General case' 0 C--O 1.204 -1.314 0 CA-C-N 112.1 -2.05 . . . . 0.0 107.76 -177.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1753 ' ' GLY . . . . . . . . . . . . . . . -76.1 -19.23 78.81 Favored Glycine 0 N--CA 1.41 -3.05 0 N-CA-C 117.266 1.666 . . . . 0.0 117.266 173.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1754 ' ' VAL . . . . . . . . . . . . . 11.3 p -76.44 -34.61 25.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 1 CA-C-O 111.594 -4.05 . . . . 0.0 108.617 175.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1755 ' ' LEU . . . . . . . . . . . . . 4.2 pp -87.47 -31.54 19.94 Favored 'General case' 0 C--O 1.206 -1.195 1 O-C-N 132.8 6.312 . . . . 0.0 113.911 178.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1756 ' ' LEU . . . . . . . . . . . . . 6.2 tt -70.73 -20.85 62.61 Favored 'General case' 0 C--O 1.193 -1.909 0 N-CA-C 106.827 -1.545 . . . . 0.0 106.827 167.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1757 ' ' SER . . . . . . . . . . . . 0.289 1.6 m -64.48 -19.27 65.46 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-N 124.198 3.181 . . . . 0.0 114.003 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1758 ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -74.75 -75.47 0.16 Allowed 'General case' 0 C--O 1.266 1.93 0 O-C-N 118.862 -2.399 . . . . 0.0 111.036 174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1759 ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -166.12 100.87 0.64 Allowed 'General case' 0 N--CA 1.522 3.134 0 C-N-CA 126.529 1.932 . . . . 0.0 110.052 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1760 ' ' ARG . . . . . . . . . . . . . 16.1 ttt85 -142.26 -0.02 1.3 Allowed 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 116.539 2.052 . . . . 0.0 116.539 173.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1761 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 62.94 148.18 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 C-N-CA 129.001 2.92 . . . . 0.0 115.671 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1762 ' ' ARG . . . . . . . . . . . . 0.262 8.3 ptm180 -141.91 14.35 2.09 Favored 'General case' 0 C--N 1.283 -2.298 0 C-N-CA 126.904 2.081 . . . . 0.0 113.442 -167.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1763 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -155.98 164.78 38.04 Favored 'General case' 0 CA--C 1.496 -1.132 0 C-N-CA 127.677 2.391 . . . . 0.0 107.156 -173.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1764 ' ' HIS . . . . . . . . . . . . . 91.7 m-70 64.31 -81.98 0.03 OUTLIER 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 125.225 1.578 . . . . 0.0 110.073 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1765 ' ' GLY . . . . . . . . . . . . . . . -72.83 19.63 1.18 Allowed Glycine 0 N--CA 1.483 1.826 0 C-N-CA 127.577 2.513 . . . . 0.0 117.241 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1766 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -160.57 2.75 0.07 Allowed 'General case' 0 C--N 1.362 1.152 0 C-N-CA 127.33 2.252 . . . . 0.0 111.284 -167.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1767 ' ' LEU . . . . . 0.464 HD22 ' HA ' ' A' 1767 ' ' LEU . 0.4 OUTLIER -88.17 72.33 9.12 Favored 'General case' 0 N--CA 1.434 -1.273 0 CA-C-N 119.847 1.203 . . . . 0.0 113.112 -171.204 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1768 ' ' TRP . . . . . . . . . . . . . 35.8 t-105 68.64 -36.08 0.31 Allowed 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 129.786 3.235 . . . . 0.0 115.043 -173.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1769 ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -113.31 106.97 54.15 Favored Pre-proline 0 N--CA 1.415 -2.18 0 C-N-CA 128.876 2.87 . . . . 0.0 110.105 168.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1770 ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -70.49 81.36 1.01 Allowed 'Trans proline' 0 N--CA 1.417 -2.989 0 C-N-CA 122.093 1.862 . . . . 0.0 115.597 -178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1771 ' ' GLU . . . . . . . . . . . . . 87.8 tt0 . . . . . 0 CA--C 1.585 2.327 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -159.014 . . . . . . . . 0 0 . 1 stop_ save_