data_6aa3_residue ############################ # Computer software used # ############################ 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 6aa3 _Structure_validation_residue.Date_analyzed 2019-03-06 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 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.491 0 CA-C-O 120.683 0.278 . . . . 69.650000000000006 110.635 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.0 p -127.48 160.64 30.88 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 108.729 -0.841 . . . . 53.520000000000003 108.729 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -119.63 139.98 51.34 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.687 -1.227 . . . . 75.090000000000003 107.687 174.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 62.9 tp -100.94 124.28 46.4 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.13 -0.322 . . . . 40.5 110.13 -170.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -133.37 160.83 36.21 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.726 0.774 . . . . 54.869999999999997 111.246 -175.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.0 p -124.78 153.55 42.31 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.471 -0.786 . . . . 38.32 109.703 173.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.5 tp -141.83 131.99 24.81 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 106.717 -1.586 . . . . 36.219999999999999 106.717 172.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.3 t -126.56 124.35 65.05 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 108.91 -0.774 . . . . 34.590000000000003 108.91 -173.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.7 mp -106.85 122.31 46.15 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.835 -0.802 . . . . 47.899999999999999 108.835 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 70.2 t -93.55 107.93 19.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 105.4 -2.074 . . . . 42.979999999999997 105.4 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 tp -129.43 117.89 21.27 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.109 -1.441 . . . . 51.539999999999999 107.109 -161.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -117.55 165.98 14.46 Favored Pre-proline 0 C--O 1.243 0.738 0 N-CA-C 108.218 -1.03 . . . . 53.25 108.218 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -48.76 -48.24 18.41 Favored 'Trans proline' 0 C--O 1.239 0.554 0 N-CA-C 115.688 1.38 . . . . 52.770000000000003 115.688 -167.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -102.71 -1.7 29.55 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 115.129 1.529 . . . . 70.180000000000007 115.129 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -150.87 158.1 43.73 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 118.889 -1.124 . . . . 43.649999999999999 112.136 -166.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.3 p -131.83 135.3 58.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.171 -0.922 . . . . 36.869999999999997 108.782 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.8 tp -90.18 117.67 29.12 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.821 -1.177 . . . . 36.630000000000003 107.821 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.8 mt -111.77 175.42 5.43 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 107.895 -1.15 . . . . 39.299999999999997 107.895 172.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.36 145.88 17.47 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.358 -1.401 . . . . 38.119999999999997 110.493 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 8.2 tpp -96.99 122.36 39.89 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.156 -2.164 . . . . 57.640000000000001 105.156 -173.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -69.51 118.98 13.07 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.71 -1.219 . . . . 60.280000000000001 107.71 178.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -83.82 -32.13 25.47 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.428 0.529 . . . . 61.909999999999997 112.428 -171.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -151.87 165.62 33.99 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 107.244 -1.391 . . . . 73.980000000000004 107.244 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.65 -161.19 28.27 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-O 122.766 1.203 . . . . 68.680000000000007 112.668 174.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -63.86 137.56 58.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.333 -0.934 . . . . 66.390000000000001 110.723 178.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 65.4 22.92 69.83 Favored Glycine 0 C--N 1.333 0.413 0 N-CA-C 114.708 0.643 . . . . 59.359999999999999 114.708 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.9 139.49 51.45 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 117.871 0.836 . . . . 54.299999999999997 110.036 178.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.56 -0.25 73.87 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.207 -0.997 . . . . 49.130000000000003 115.183 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -104.76 149.36 25.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 118.32 1.06 . . . . 59.5 109.525 175.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -95.06 139.11 31.87 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 107.712 -1.218 . . . . 43.170000000000002 107.712 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -154.36 178.98 9.43 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 119.618 -0.833 . . . . 53.810000000000002 110.707 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.64 179.72 40.23 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 109.746 -1.341 . . . . 38.18 109.746 171.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -101.28 143.21 31.62 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.822 -0.807 . . . . 39.07 108.822 -176.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 155.14 -160.57 29.86 Favored Glycine 0 C--O 1.224 -0.473 0 C-N-CA 118.843 -1.646 . . . . 43.649999999999999 110.933 175.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 159.45 -162.48 32.89 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 110.355 -1.098 . . . . 40.060000000000002 110.355 -176.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.2 tttm -74.6 135.49 42.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.583 -0.808 . . . . 63.259999999999998 110.284 -172.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 42.4 t -77.18 125.14 36.72 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.251 0 N-CA-C 105.78 -1.933 . . . . 42.340000000000003 105.78 172.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -88.82 168.61 12.31 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 116.739 -1.984 . . . . 61.659999999999997 110.249 -176.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -68.28 142.2 55.64 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 118.896 -1.122 . . . . 46.460000000000001 108.581 174.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.07 3.49 82.64 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 116.314 1.286 . . . . 53.009999999999998 116.314 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -132.04 150.62 52.11 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 119.296 1.548 . . . . 45.990000000000002 110.213 175.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 70.4 p -77.13 160.72 28.8 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.895 0.855 . . . . 41.670000000000002 110.174 174.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 70.4 mt -57.73 -46.84 86.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.242 -0.89 . . . . 41.299999999999997 109.922 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -32.03 70.37 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 119.431 -0.908 . . . . 69.670000000000002 112.373 -174.855 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -71.2 -36.87 72.08 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.458 -0.897 . . . . 58.049999999999997 111.455 173.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -64.26 -38.69 96.24 Favored Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.018 -1.087 . . . . 38.969999999999999 112.004 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -45.92 91.16 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.371 -0.488 . . . . 41.030000000000001 110.874 174.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 73.7 mtt-85 -64.45 -40.11 95.11 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.256 -0.978 . . . . 61.07 110.796 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.2 ttp85 -61.2 -52.64 63.94 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 120.654 -0.419 . . . . 54.649999999999999 111.296 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -60.32 -38.95 85.3 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.04 -1.064 . . . . 60.409999999999997 111.445 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.4 -43.47 94.33 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.142 -1.023 . . . . 43.640000000000001 111.244 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -61.25 -45.84 92.85 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.882 -0.511 . . . . 57.329999999999998 111.587 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -66.37 -42.9 87.34 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 119.655 -0.818 . . . . 57.549999999999997 111.559 -178.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -82.42 -37.17 25.89 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.673 0.62 . . . . 50.07 112.673 -169.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 83.3 p -111.82 -10.47 14.01 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 115.821 1.786 . . . . 45.130000000000003 115.821 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 72.62 14.68 77.71 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 115.932 1.133 . . . . 49.799999999999997 115.932 -169.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 95.4 mt -105.46 147.69 28.01 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 118.928 1.364 . . . . 45.359999999999999 111.614 -173.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 88.7 m -110.53 148.91 31.16 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.719 -1.215 . . . . 50.359999999999999 107.719 172.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 m -126.53 142.51 42.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 N-CA-C 109.379 -0.6 . . . . 52.090000000000003 109.379 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -77.53 -41.52 38.86 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.462 0.476 . . . . 71.349999999999994 111.39 174.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.58 149.81 41.24 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.57 -0.53 . . . . 49.420000000000002 109.57 -177.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 70.8 mt -120.69 136.56 54.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.665 -1.235 . . . . 44.5 107.665 169.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -105.84 132.04 52.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.849 -1.167 . . . . 49.399999999999999 107.849 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -76.57 112.84 13.54 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 104.999 -2.223 . . . . 61.590000000000003 104.999 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.0 m -106.16 -11.16 10.17 Favored 'Isoleucine or valine' 0 C--O 1.247 0.935 0 N-CA-C 114.157 1.169 . . . . 48.32 114.157 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 173.8 168.59 35.0 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 116.065 -2.969 . . . . 40.009999999999998 114.113 -172.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLN . . . . . 0.443 ' NE2' ' O ' ' A' ' 302' ' ' HOH . 48.4 mm-40 -135.11 131.83 37.37 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 105.63 -1.989 . . . . 56.0 105.63 -179.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 53.2 mt -128.79 138.01 55.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 107.52 -1.289 . . . . 44.789999999999999 107.52 173.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 94.4 t -110.72 130.97 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.354 -0.98 . . . . 42.450000000000003 108.354 171.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -109.09 131.69 54.83 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.648 -0.871 . . . . 48.689999999999998 108.648 174.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -121.91 135.46 54.88 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 123.547 0.739 . . . . 70.269999999999996 109.075 172.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -116.33 158.08 23.99 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.289 -1.004 . . . . 68.959999999999994 108.289 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.6 m -92.41 127.89 44.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-N 115.618 -0.719 . . . . 76.209999999999994 109.2 176.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 97.19 -22.34 41.3 Favored Glycine 0 N--CA 1.44 -1.094 0 CA-C-O 119.155 -0.803 . . . . 82.159999999999997 114.513 -172.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -108.14 122.41 40.72 Favored Pre-proline 0 C--O 1.242 0.664 0 CA-C-N 118.333 1.066 . . . . 83.450000000000003 109.579 179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.78 -15.99 33.27 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 120.212 0.608 . . . . 71.060000000000002 113.563 173.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -68.3 133.82 49.37 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.019 0.372 . . . . 75.109999999999999 110.803 178.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.3 mt -102.78 149.34 24.57 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.448 -0.945 . . . . 54.0 108.448 165.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 55.2 mtm -105.86 122.57 46.39 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.381 -0.6 . . . . 62.0 109.381 176.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -99.78 104.49 16.19 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 105.606 -1.998 . . . . 37.030000000000001 105.606 176.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 49.0 t -106.09 114.26 44.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.241 -1.022 . . . . 33.979999999999997 108.241 -172.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -92.52 118.98 31.54 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.936 -1.135 . . . . 39.159999999999997 107.936 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 42.0 t -98.89 135.44 33.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 N-CA-C 109.17 -0.678 . . . . 37.060000000000002 109.17 -175.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -130.61 156.02 45.57 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.174 -1.047 . . . . 40.590000000000003 108.174 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 27.2 p -130.76 162.48 29.41 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.703 -0.851 . . . . 47.280000000000001 108.703 165.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.0 t -148.38 136.77 21.32 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.45 -0.796 . . . . 49.0 109.512 179.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -97.41 -19.04 18.72 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 113.824 1.046 . . . . 72.0 113.824 168.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.1 p -111.3 101.33 9.81 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 107.74 -1.207 . . . . 57.359999999999999 107.74 -167.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 28.5 pt -118.79 159.1 19.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 107.708 -1.219 . . . . 52.299999999999997 107.708 -178.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -137.33 144.66 42.68 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.164 -0.925 . . . . 67.25 108.557 173.888 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 107.02 174.95 22.81 Favored Glycine 0 C--N 1.321 -0.265 0 CA-C-O 122.525 1.07 . . . . 44.850000000000001 111.435 -178.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -113.49 140.3 24.33 Favored Pre-proline 0 N--CA 1.444 -0.743 1 C-N-CA 109.131 -5.028 . . . . 52.450000000000003 109.186 173.743 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -64.53 134.46 41.42 Favored 'Trans proline' 0 C--N 1.331 -0.371 0 N-CA-C 110.583 -0.583 . . . . 43.600000000000001 110.583 -172.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.5 p -146.84 145.38 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 108.124 -1.065 . . . . 43.390000000000001 108.124 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.14 153.83 38.03 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 119.225 -0.99 . . . . 46.439999999999998 111.102 -172.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 60.1 p -103.42 -177.4 3.36 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.34 -1.356 . . . . 46.0 107.34 167.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . 0.518 ' OD2' ' N ' ' A' ' 99' ' ' ASP . 0.1 OUTLIER -61.57 -32.71 72.81 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.324 -0.951 . . . . 79.540000000000006 111.452 172.506 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -83.73 -38.6 21.18 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.277 0.843 . . . . 74.409999999999997 113.277 -174.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.3 mmm -140.8 145.39 36.25 Favored 'General case' 0 C--N 1.343 0.302 0 N-CA-C 112.263 0.468 . . . . 55.869999999999997 112.263 -165.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 45.6 ttm105 -119.67 115.42 33.73 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-O 119.308 -0.377 . . . . 44.390000000000001 111.445 174.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -77.61 144.64 22.53 Favored 'Trans proline' 0 C--O 1.234 0.283 0 CA-C-N 120.165 1.095 . . . . 38.439999999999998 112.138 -177.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 33.3 t -149.69 146.82 27.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.17 -1.048 . . . . 53.700000000000003 108.17 173.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -88.9 144.93 25.86 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 123.575 0.547 . . . . 40.840000000000003 109.706 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -129.43 139.01 51.77 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.881 -0.785 . . . . 38.969999999999999 108.881 175.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -67.58 146.32 54.0 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 117.926 -1.51 . . . . 53.520000000000003 108.878 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 24.8 mt -60.26 -24.33 64.82 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.587 0.958 . . . . 47.969999999999999 113.587 -171.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.6 p30 -92.57 -1.84 56.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 113.279 0.844 . . . . 60.460000000000001 113.279 177.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -106.15 13.04 29.53 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 114.527 1.306 . . . . 57.030000000000001 114.527 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 37.8 mm -51.33 128.52 31.78 Favored Pre-proline 0 C--O 1.24 0.56 0 CA-C-N 119.059 0.845 . . . . 48.670000000000002 109.477 -176.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -87.07 68.76 4.03 Favored 'Trans proline' 0 N--CA 1.483 0.865 0 C-N-CA 122.124 1.883 . . . . 45.600000000000001 112.836 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -59.92 -27.24 66.58 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 119.909 -0.717 . . . . 43.759999999999998 112.144 -174.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.2 pttp -70.87 -23.57 62.33 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 119.234 -0.986 . . . . 65.090000000000003 112.142 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -98.8 11.48 38.58 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.254 1.422 . . . . 57.109999999999999 113.842 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 68.1 mtp -118.72 174.66 6.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.288 0.566 . . . . 43.350000000000001 109.954 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -65.19 145.83 99.03 Favored Pre-proline 0 C--O 1.237 0.399 0 C-N-CA 120.549 -0.461 . . . . 54.659999999999997 110.307 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.92 -33.15 92.89 Favored 'Trans proline' 0 CA--C 1.516 -0.417 0 N-CA-C 114.637 0.976 . . . . 46.520000000000003 114.637 -173.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -64.63 -23.12 67.16 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 118.449 -1.3 . . . . 45.789999999999999 111.611 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.83 -29.29 70.63 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.919 -0.712 . . . . 49.119999999999997 111.475 -175.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 58.5 m -60.89 -24.56 66.07 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 112.175 0.435 . . . . 48.159999999999997 112.175 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -85.63 -60.84 1.91 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.833 0.679 . . . . 63.649999999999999 112.833 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 64.0 p-90 -84.83 -22.23 29.55 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 114.863 1.431 . . . . 42.5 114.863 -174.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -57.38 -46.31 99.81 Favored Pre-proline 0 C--O 1.246 0.898 0 CA-C-O 118.355 -0.831 . . . . 53.810000000000002 112.09 177.169 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -48.18 -42.51 33.01 Favored 'Trans proline' 0 C--O 1.238 0.483 0 CA-C-N 121.123 1.437 . . . . 50.219999999999999 115.2 170.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.4 mt -66.7 -47.89 70.98 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 119.347 0.976 . . . . 53.07 110.962 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -49.75 -46.72 50.84 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.771 0.32 . . . . 52.280000000000001 110.801 173.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.4 mt -70.8 -16.96 62.78 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 113.393 0.886 . . . . 55.189999999999998 113.393 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -94.15 6.65 47.94 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.102 0.864 . . . . 59.380000000000003 112.747 173.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 62.22 34.86 15.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.207 0.527 . . . . 61.159999999999997 112.048 -176.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -103.58 141.66 35.64 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.92 -0.77 . . . . 66.069999999999993 108.92 175.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -94.24 146.73 23.81 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 123.565 0.746 . . . . 54.700000000000003 109.0 175.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -147.1 161.11 41.52 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 119.123 -1.031 . . . . 47.399999999999999 112.093 -167.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 63.6 m170 -120.95 138.91 53.9 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.912 1.285 . . . . 61.210000000000001 107.9 162.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -145.44 158.0 27.52 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.193 -1.003 . . . . 43.710000000000001 111.419 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -141.74 134.33 28.36 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 106.992 -1.484 . . . . 61.850000000000001 106.992 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -136.23 119.28 16.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.418 -0.586 . . . . 49.579999999999998 109.418 -178.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -93.94 118.59 31.69 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 123.669 0.606 . . . . 70.140000000000001 109.381 174.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -105.25 150.64 24.96 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.021 0.929 . . . . 61.259999999999998 111.188 -171.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -126.82 110.89 13.56 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 106.591 -1.633 . . . . 70.439999999999998 106.591 171.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . 65.04 -158.55 45.01 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 114.93 -3.51 . . . . 69.879999999999995 112.449 -170.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -84.4 -42.97 15.15 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 113.495 0.924 . . . . 75.439999999999998 113.495 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -96.78 3.6 52.21 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 114.878 1.436 . . . . 78.980000000000004 114.878 -164.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 8.5 m -129.41 112.19 13.56 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 119.701 1.137 . . . . 63.240000000000002 111.668 -165.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 75.3 mt -79.74 121.02 32.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 108.255 -1.017 . . . . 48.719999999999999 108.255 168.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 20.5 mt -80.35 -46.6 15.81 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 111.91 0.337 . . . . 59.229999999999997 111.91 174.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -155.06 160.65 41.18 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 107.863 -1.162 . . . . 67.909999999999997 107.863 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -159.57 160.32 34.31 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 118.867 -1.133 . . . . 58.18 110.218 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 1.4 p -137.98 146.16 42.81 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.091 -0.959 . . . . 64.159999999999997 108.611 166.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 16.0 tp -147.52 137.25 22.79 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.499 -1.297 . . . . 54.93 107.499 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -144.32 136.11 25.99 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 123.518 0.511 . . . . 78.260000000000005 110.313 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -69.72 157.28 37.61 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.579 0.704 . . . . 81.099999999999994 109.225 167.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 14.5 m -144.56 158.94 14.78 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 108.332 -0.988 . . . . 61.509999999999998 108.332 178.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -79.09 -59.17 2.88 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.73 -0.668 . . . . 72.370000000000005 111.662 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 26.8 p -116.34 155.34 28.62 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.796 -0.816 . . . . 62.579999999999998 108.796 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 57.5 t -99.13 106.31 18.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 C-N-CA 119.339 -0.945 . . . . 61.689999999999998 111.695 -174.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 34.99 77.69 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 119.743 3.238 . . . . 64.030000000000001 119.743 130.731 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -81.69 128.67 34.21 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 120.04 1.291 . . . . 56.590000000000003 110.253 169.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -92.82 -15.03 26.99 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 114.28 1.215 . . . . 44.710000000000001 114.28 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 53.4 m80 53.83 50.56 16.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.592 0.711 . . . . 47.75 112.322 -179.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -69.04 120.0 14.22 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 106.756 -1.572 . . . . 47.539999999999999 106.756 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -95.45 -2.32 49.05 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 117.291 -1.764 . . . . 47.859999999999999 113.563 -173.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -99.51 -0.48 40.54 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.887 0.699 . . . . 43.359999999999999 112.887 165.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 . . . . . 0 C--N 1.324 -0.512 0 C-N-CA 119.815 -0.754 . . . . 42.100000000000001 111.871 -177.602 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.443 ' O ' ' NE2' ' A' ' 69' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.491 0 CA-C-O 120.683 0.278 . . . . 69.65 110.635 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.0 p -127.48 160.64 30.88 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 108.729 -0.841 . . . . 53.52 108.729 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . 0.556 ' HB2' ' HE1' ' A' ' 7' ' ' TYR . 8.6 mmm180 -119.63 139.98 51.34 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.687 -1.227 . . . . 75.09 107.687 174.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 62.9 tp -100.94 124.28 46.4 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.13 -0.322 . . . . 40.5 110.13 -170.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . 0.556 ' HE1' ' HB2' ' A' ' 5' ' ' ARG . 82.3 m-85 -133.37 160.83 36.21 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.726 0.774 . . . . 54.87 111.246 -175.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.0 p -124.78 153.55 42.31 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.471 -0.786 . . . . 38.32 109.703 173.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.5 tp -141.83 131.99 24.81 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 106.717 -1.586 . . . . 36.22 106.717 172.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.3 t -126.56 124.35 65.05 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 108.91 -0.774 . . . . 34.59 108.91 -173.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . 0.642 HD22 ' HG ' ' A' ' 127' ' ' LEU . 7.7 mp -106.85 122.31 46.15 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.835 -0.802 . . . . 47.9 108.835 176.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 70.2 t -93.55 107.93 19.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 105.4 -2.074 . . . . 42.98 105.4 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 tp -129.43 117.89 21.27 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.109 -1.441 . . . . 51.54 107.109 -161.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -117.55 165.98 14.46 Favored Pre-proline 0 C--O 1.243 0.738 0 N-CA-C 108.218 -1.03 . . . . 53.25 108.218 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -48.76 -48.24 18.41 Favored 'Trans proline' 0 C--O 1.239 0.554 0 N-CA-C 115.688 1.38 . . . . 52.77 115.688 -167.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -102.71 -1.7 29.55 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 115.129 1.529 . . . . 70.18 115.129 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -150.87 158.1 43.73 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 118.889 -1.124 . . . . 43.65 112.136 -166.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.3 p -131.83 135.3 58.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.171 -0.922 . . . . 36.87 108.782 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.8 tp -90.18 117.67 29.12 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.821 -1.177 . . . . 36.63 107.821 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.8 mt -111.77 175.42 5.43 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 107.895 -1.15 . . . . 39.3 107.895 172.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.36 145.88 17.47 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.358 -1.401 . . . . 38.12 110.493 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 8.2 tpp -96.99 122.36 39.89 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.156 -2.164 . . . . 57.64 105.156 -173.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -69.51 118.98 13.07 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.71 -1.219 . . . . 60.28 107.71 178.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -83.82 -32.13 25.47 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.428 0.529 . . . . 61.91 112.428 -171.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -151.87 165.62 33.99 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 107.244 -1.391 . . . . 73.98 107.244 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.65 -161.19 28.27 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-O 122.766 1.203 . . . . 68.68 112.668 174.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -63.86 137.56 58.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.333 -0.934 . . . . 66.39 110.723 178.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 65.4 22.92 69.83 Favored Glycine 0 C--N 1.333 0.413 0 N-CA-C 114.708 0.643 . . . . 59.36 114.708 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.9 139.49 51.45 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 117.871 0.836 . . . . 54.3 110.036 178.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.56 -0.25 73.87 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.207 -0.997 . . . . 49.13 115.183 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -104.76 149.36 25.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 118.32 1.06 . . . . 59.5 109.525 175.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -95.06 139.11 31.87 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 107.712 -1.218 . . . . 43.17 107.712 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -154.36 178.98 9.43 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 119.618 -0.833 . . . . 53.81 110.707 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.64 179.72 40.23 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 109.746 -1.341 . . . . 38.18 109.746 171.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -101.28 143.21 31.62 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.822 -0.807 . . . . 39.07 108.822 -176.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 155.14 -160.57 29.86 Favored Glycine 0 C--O 1.224 -0.473 0 C-N-CA 118.843 -1.646 . . . . 43.65 110.933 175.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 159.45 -162.48 32.89 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 110.355 -1.098 . . . . 40.06 110.355 -176.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.2 tttm -74.6 135.49 42.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.583 -0.808 . . . . 63.26 110.284 -172.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 42.4 t -77.18 125.14 36.72 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.251 0 N-CA-C 105.78 -1.933 . . . . 42.34 105.78 172.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -88.82 168.61 12.31 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 116.739 -1.984 . . . . 61.66 110.249 -176.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -68.28 142.2 55.64 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 118.896 -1.122 . . . . 46.46 108.581 174.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.07 3.49 82.64 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 116.314 1.286 . . . . 53.01 116.314 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -132.04 150.62 52.11 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 119.296 1.548 . . . . 45.99 110.213 175.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 70.4 p -77.13 160.72 28.8 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.895 0.855 . . . . 41.67 110.174 174.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 70.4 mt -57.73 -46.84 86.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.242 -0.89 . . . . 41.3 109.922 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -32.03 70.37 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 119.431 -0.908 . . . . 69.67 112.373 -174.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -71.2 -36.87 72.08 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.458 -0.897 . . . . 58.05 111.455 173.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -64.26 -38.69 96.24 Favored Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.018 -1.087 . . . . 38.97 112.004 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -45.92 91.16 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.371 -0.488 . . . . 41.03 110.874 174.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 73.7 mtt-85 -64.45 -40.11 95.11 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.256 -0.978 . . . . 61.07 110.796 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.2 ttp85 -61.2 -52.64 63.94 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 120.654 -0.419 . . . . 54.65 111.296 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -60.32 -38.95 85.3 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.04 -1.064 . . . . 60.41 111.445 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.4 -43.47 94.33 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.142 -1.023 . . . . 43.64 111.244 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -61.25 -45.84 92.85 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.882 -0.511 . . . . 57.33 111.587 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -66.37 -42.9 87.34 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 119.655 -0.818 . . . . 57.55 111.559 -178.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -82.42 -37.17 25.89 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.673 0.62 . . . . 50.07 112.673 -169.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 83.3 p -111.82 -10.47 14.01 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 115.821 1.786 . . . . 45.13 115.821 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 72.62 14.68 77.71 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 115.932 1.133 . . . . 49.8 115.932 -169.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 95.4 mt -105.46 147.69 28.01 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 118.928 1.364 . . . . 45.36 111.614 -173.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 88.7 m -110.53 148.91 31.16 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.719 -1.215 . . . . 50.36 107.719 172.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . 0.485 HG11 HG21 ' A' ' 88' ' ' THR . 3.2 m -126.53 142.51 42.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 N-CA-C 109.379 -0.6 . . . . 52.09 109.379 -177.784 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -77.53 -41.52 38.86 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.462 0.476 . . . . 71.35 111.39 174.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.58 149.81 41.24 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.57 -0.53 . . . . 49.42 109.57 -177.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 70.8 mt -120.69 136.56 54.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.665 -1.235 . . . . 44.5 107.665 169.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -105.84 132.04 52.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.849 -1.167 . . . . 49.4 107.849 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -76.57 112.84 13.54 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 104.999 -2.223 . . . . 61.59 104.999 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . 0.417 HG21 HD21 ' A' ' 127' ' ' LEU . 2.0 m -106.16 -11.16 10.17 Favored 'Isoleucine or valine' 0 C--O 1.247 0.935 0 N-CA-C 114.157 1.169 . . . . 48.32 114.157 -179.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 173.8 168.59 35.0 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 116.065 -2.969 . . . . 40.01 114.113 -172.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLN . . . . . 0.456 ' HG3' HD13 ' A' ' 157' ' ' LEU . 48.4 mm-40 -135.11 131.83 37.37 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 105.63 -1.989 . . . . 56.0 105.63 -179.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 53.2 mt -128.79 138.01 55.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 107.52 -1.289 . . . . 44.79 107.52 173.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 94.4 t -110.72 130.97 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.354 -0.98 . . . . 42.45 108.354 171.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PHE . . . . . 0.47 ' HB2' ' HB2' ' A' ' 81' ' ' MET . 17.0 m-85 -109.09 131.69 54.83 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.648 -0.871 . . . . 48.69 108.648 174.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -121.91 135.46 54.88 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 123.547 0.739 . . . . 70.27 109.075 172.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -116.33 158.08 23.99 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.289 -1.004 . . . . 68.96 108.289 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.6 m -92.41 127.89 44.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-N 115.618 -0.719 . . . . 76.21 109.2 176.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 97.19 -22.34 41.3 Favored Glycine 0 N--CA 1.44 -1.094 0 CA-C-O 119.155 -0.803 . . . . 82.16 114.513 -172.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . 0.408 ' HB3' ' HG2' ' A' ' 79' ' ' GLU . 1.1 mt-10 -108.14 122.41 40.72 Favored Pre-proline 0 C--O 1.242 0.664 0 CA-C-N 118.333 1.066 . . . . 83.45 109.579 179.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.78 -15.99 33.27 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 120.212 0.608 . . . . 71.06 113.563 173.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLU . . . . . 0.408 ' HG2' ' HB3' ' A' ' 77' ' ' GLU . 1.1 pt-20 -68.3 133.82 49.37 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.019 0.372 . . . . 75.11 110.803 178.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.3 mt -102.78 149.34 24.57 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.448 -0.945 . . . . 54.0 108.448 165.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' MET . . . . . 0.47 ' HB2' ' HB2' ' A' ' 72' ' ' PHE . 55.2 mtm -105.86 122.57 46.39 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.381 -0.6 . . . . 62.0 109.381 176.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -99.78 104.49 16.19 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 105.606 -1.998 . . . . 37.03 105.606 176.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 49.0 t -106.09 114.26 44.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.241 -1.022 . . . . 33.98 108.241 -172.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -92.52 118.98 31.54 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.936 -1.135 . . . . 39.16 107.936 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 42.0 t -98.89 135.44 33.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 N-CA-C 109.17 -0.678 . . . . 37.06 109.17 -175.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -130.61 156.02 45.57 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.174 -1.047 . . . . 40.59 108.174 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 27.2 p -130.76 162.48 29.41 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.703 -0.851 . . . . 47.28 108.703 165.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' THR . . . . . 0.485 HG21 HG11 ' A' ' 61' ' ' VAL . 6.0 t -148.38 136.77 21.32 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.45 -0.796 . . . . 49.0 109.512 179.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -97.41 -19.04 18.72 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 113.824 1.046 . . . . 72.0 113.824 168.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.1 p -111.3 101.33 9.81 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 107.74 -1.207 . . . . 57.36 107.74 -167.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 28.5 pt -118.79 159.1 19.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 107.708 -1.219 . . . . 52.3 107.708 -178.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -137.33 144.66 42.68 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.164 -0.925 . . . . 67.25 108.557 173.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 107.02 174.95 22.81 Favored Glycine 0 C--N 1.321 -0.265 0 CA-C-O 122.525 1.07 . . . . 44.85 111.435 -178.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -113.49 140.3 24.33 Favored Pre-proline 0 N--CA 1.444 -0.743 1 C-N-CA 109.131 -5.028 . . . . 52.45 109.186 173.743 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -64.53 134.46 41.42 Favored 'Trans proline' 0 C--N 1.331 -0.371 0 N-CA-C 110.583 -0.583 . . . . 43.6 110.583 -172.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.5 p -146.84 145.38 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 108.124 -1.065 . . . . 43.39 108.124 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.14 153.83 38.03 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 119.225 -0.99 . . . . 46.44 111.102 -172.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 60.1 p -103.42 -177.4 3.36 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.34 -1.356 . . . . 46.0 107.34 167.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . 0.518 ' OD2' ' N ' ' A' ' 99' ' ' ASP . 0.1 OUTLIER -61.57 -32.71 72.81 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.324 -0.951 . . . . 79.54 111.452 172.506 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -83.73 -38.6 21.18 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.277 0.843 . . . . 74.41 113.277 -174.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.3 mmm -140.8 145.39 36.25 Favored 'General case' 0 C--N 1.343 0.302 0 N-CA-C 112.263 0.468 . . . . 55.87 112.263 -165.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 45.6 ttm105 -119.67 115.42 33.73 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-O 119.308 -0.377 . . . . 44.39 111.445 174.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -77.61 144.64 22.53 Favored 'Trans proline' 0 C--O 1.234 0.283 0 CA-C-N 120.165 1.095 . . . . 38.44 112.138 -177.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 33.3 t -149.69 146.82 27.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.17 -1.048 . . . . 53.7 108.17 173.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -88.9 144.93 25.86 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 123.575 0.547 . . . . 40.84 109.706 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -129.43 139.01 51.77 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.881 -0.785 . . . . 38.97 108.881 175.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -67.58 146.32 54.0 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 117.926 -1.51 . . . . 53.52 108.878 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 24.8 mt -60.26 -24.33 64.82 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.587 0.958 . . . . 47.97 113.587 -171.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.6 p30 -92.57 -1.84 56.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 113.279 0.844 . . . . 60.46 113.279 177.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -106.15 13.04 29.53 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 114.527 1.306 . . . . 57.03 114.527 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 37.8 mm -51.33 128.52 31.78 Favored Pre-proline 0 C--O 1.24 0.56 0 CA-C-N 119.059 0.845 . . . . 48.67 109.477 -176.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -87.07 68.76 4.03 Favored 'Trans proline' 0 N--CA 1.483 0.865 0 C-N-CA 122.124 1.883 . . . . 45.6 112.836 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -59.92 -27.24 66.58 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 119.909 -0.717 . . . . 43.76 112.144 -174.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.2 pttp -70.87 -23.57 62.33 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 119.234 -0.986 . . . . 65.09 112.142 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -98.8 11.48 38.58 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.254 1.422 . . . . 57.11 113.842 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 68.1 mtp -118.72 174.66 6.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.288 0.566 . . . . 43.35 109.954 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -65.19 145.83 99.03 Favored Pre-proline 0 C--O 1.237 0.399 0 C-N-CA 120.549 -0.461 . . . . 54.66 110.307 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.92 -33.15 92.89 Favored 'Trans proline' 0 CA--C 1.516 -0.417 0 N-CA-C 114.637 0.976 . . . . 46.52 114.637 -173.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -64.63 -23.12 67.16 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 118.449 -1.3 . . . . 45.79 111.611 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASP . . . . . 0.602 ' O ' ' HB2' ' A' ' 124' ' ' PHE . 6.6 m-20 -62.83 -29.29 70.63 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.919 -0.712 . . . . 49.12 111.475 -175.349 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 58.5 m -60.89 -24.56 66.07 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 112.175 0.435 . . . . 48.16 112.175 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -85.63 -60.84 1.91 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.833 0.679 . . . . 63.65 112.833 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 64.0 p-90 -84.83 -22.23 29.55 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 114.863 1.431 . . . . 42.5 114.863 -174.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PHE . . . . . 0.602 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 0.4 OUTLIER -57.38 -46.31 99.81 Favored Pre-proline 0 C--O 1.246 0.898 0 CA-C-O 118.355 -0.831 . . . . 53.81 112.09 177.169 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -48.18 -42.51 33.01 Favored 'Trans proline' 0 C--O 1.238 0.483 0 CA-C-N 121.123 1.437 . . . . 50.22 115.2 170.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.4 mt -66.7 -47.89 70.98 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 119.347 0.976 . . . . 53.07 110.962 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . 0.642 ' HG ' HD22 ' A' ' 11' ' ' LEU . 1.6 tm? -49.75 -46.72 50.84 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.771 0.32 . . . . 52.28 110.801 173.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.4 mt -70.8 -16.96 62.78 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 113.393 0.886 . . . . 55.19 113.393 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -94.15 6.65 47.94 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.102 0.864 . . . . 59.38 112.747 173.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 62.22 34.86 15.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.207 0.527 . . . . 61.16 112.048 -176.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -103.58 141.66 35.64 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.92 -0.77 . . . . 66.07 108.92 175.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -94.24 146.73 23.81 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 123.565 0.746 . . . . 54.7 109.0 175.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -147.1 161.11 41.52 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 119.123 -1.031 . . . . 47.4 112.093 -167.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HIS . . . . . 0.507 ' NE2' ' HB2' ' A' ' 157' ' ' LEU . 63.6 m170 -120.95 138.91 53.9 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.912 1.285 . . . . 61.21 107.9 162.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -145.44 158.0 27.52 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.193 -1.003 . . . . 43.71 111.419 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -141.74 134.33 28.36 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 106.992 -1.484 . . . . 61.85 106.992 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -136.23 119.28 16.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.418 -0.586 . . . . 49.58 109.418 -178.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -93.94 118.59 31.69 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 123.669 0.606 . . . . 70.14 109.381 174.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -105.25 150.64 24.96 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.021 0.929 . . . . 61.26 111.188 -171.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLN . . . . . 0.41 ' HB2' ' HG ' ' A' ' 146' ' ' LEU . 34.2 tt0 -126.82 110.89 13.56 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 106.591 -1.633 . . . . 70.44 106.591 171.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . 65.04 -158.55 45.01 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 114.93 -3.51 . . . . 69.88 112.449 -170.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -84.4 -42.97 15.15 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 113.495 0.924 . . . . 75.44 113.495 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -96.78 3.6 52.21 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 114.878 1.436 . . . . 78.98 114.878 -164.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 8.5 m -129.41 112.19 13.56 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 119.701 1.137 . . . . 63.24 111.668 -165.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 75.3 mt -79.74 121.02 32.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 108.255 -1.017 . . . . 48.72 108.255 168.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' LEU . . . . . 0.41 ' HG ' ' HB2' ' A' ' 140' ' ' GLN . 20.5 mt -80.35 -46.6 15.81 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 111.91 0.337 . . . . 59.23 111.91 174.044 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -155.06 160.65 41.18 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 107.863 -1.162 . . . . 67.91 107.863 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -159.57 160.32 34.31 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 118.867 -1.133 . . . . 58.18 110.218 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 1.4 p -137.98 146.16 42.81 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.091 -0.959 . . . . 64.16 108.611 166.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 16.0 tp -147.52 137.25 22.79 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.499 -1.297 . . . . 54.93 107.499 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -144.32 136.11 25.99 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 123.518 0.511 . . . . 78.26 110.313 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -69.72 157.28 37.61 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.579 0.704 . . . . 81.1 109.225 167.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 14.5 m -144.56 158.94 14.78 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 108.332 -0.988 . . . . 61.51 108.332 178.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -79.09 -59.17 2.88 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.73 -0.668 . . . . 72.37 111.662 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 26.8 p -116.34 155.34 28.62 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.796 -0.816 . . . . 62.58 108.796 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 57.5 t -99.13 106.31 18.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 C-N-CA 119.339 -0.945 . . . . 61.69 111.695 -174.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' LEU . . . . . 0.507 ' HB2' ' NE2' ' A' ' 134' ' ' HIS . 0.3 OUTLIER 34.99 77.69 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 119.743 3.238 . . . . 64.03 119.743 130.731 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -81.69 128.67 34.21 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 120.04 1.291 . . . . 56.59 110.253 169.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HIS . . . . . 0.468 ' CD2' HD22 ' A' ' 157' ' ' LEU . 48.4 m170 -92.82 -15.03 26.99 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 114.28 1.215 . . . . 44.71 114.28 179.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 53.4 m80 53.83 50.56 16.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.592 0.711 . . . . 47.75 112.322 -179.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -69.04 120.0 14.22 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 106.756 -1.572 . . . . 47.54 106.756 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -95.45 -2.32 49.05 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 117.291 -1.764 . . . . 47.86 113.563 -173.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -99.51 -0.48 40.54 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.887 0.699 . . . . 43.36 112.887 165.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 . . . . . 0 C--N 1.324 -0.512 0 C-N-CA 119.815 -0.754 . . . . 42.1 111.871 -177.602 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.443 ' O ' ' NE2' ' A' ' 69' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.491 0 CA-C-O 120.683 0.278 . . . . 69.650000000000006 110.635 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.0 p -127.48 160.64 30.88 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 108.729 -0.841 . . . . 53.520000000000003 108.729 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.556 ' HB2' ' HE1' ' A' ' 7' ' ' TYR . 8.6 mmm180 -119.63 139.98 51.34 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.687 -1.227 . . . . 75.090000000000003 107.687 174.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 62.9 tp -100.94 124.28 46.4 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.13 -0.322 . . . . 40.5 110.13 -170.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.556 ' HE1' ' HB2' ' A' ' 5' ' ' ARG . 82.3 m-85 -133.37 160.83 36.21 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.726 0.774 . . . . 54.869999999999997 111.246 -175.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.0 p -124.78 153.55 42.31 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.471 -0.786 . . . . 38.32 109.703 173.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.5 tp -141.83 131.99 24.81 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 106.717 -1.586 . . . . 36.219999999999999 106.717 172.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.3 t -126.56 124.35 65.05 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 108.91 -0.774 . . . . 34.590000000000003 108.91 -173.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.642 HD22 ' HG ' ' A' ' 127' ' ' LEU . 7.7 mp -106.85 122.31 46.15 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.835 -0.802 . . . . 47.899999999999999 108.835 176.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 70.2 t -93.55 107.93 19.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 105.4 -2.074 . . . . 42.979999999999997 105.4 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 tp -129.43 117.89 21.27 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.109 -1.441 . . . . 51.539999999999999 107.109 -161.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -117.55 165.98 14.46 Favored Pre-proline 0 C--O 1.243 0.738 0 N-CA-C 108.218 -1.03 . . . . 53.25 108.218 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -48.76 -48.24 18.41 Favored 'Trans proline' 0 C--O 1.239 0.554 0 N-CA-C 115.688 1.38 . . . . 52.770000000000003 115.688 -167.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -102.71 -1.7 29.55 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 115.129 1.529 . . . . 70.180000000000007 115.129 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 36.5 ptt180 -150.87 158.1 43.73 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 118.889 -1.124 . . . . 43.649999999999999 112.136 -166.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.3 p -131.83 135.3 58.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.171 -0.922 . . . . 36.869999999999997 108.782 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.8 tp -90.18 117.67 29.12 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.821 -1.177 . . . . 36.630000000000003 107.821 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.8 mt -111.77 175.42 5.43 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 107.895 -1.15 . . . . 39.299999999999997 107.895 172.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.36 145.88 17.47 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.358 -1.401 . . . . 38.119999999999997 110.493 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 8.2 tpp -96.99 122.36 39.89 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.156 -2.164 . . . . 57.640000000000001 105.156 -173.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.3 tptp -69.51 118.98 13.07 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.71 -1.219 . . . . 60.280000000000001 107.71 178.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -83.82 -32.13 25.47 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.428 0.529 . . . . 61.909999999999997 112.428 -171.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -151.87 165.62 33.99 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 107.244 -1.391 . . . . 73.980000000000004 107.244 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.65 -161.19 28.27 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-O 122.766 1.203 . . . . 68.680000000000007 112.668 174.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -63.86 137.56 58.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.333 -0.934 . . . . 66.390000000000001 110.723 178.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 65.4 22.92 69.83 Favored Glycine 0 C--N 1.333 0.413 0 N-CA-C 114.708 0.643 . . . . 59.359999999999999 114.708 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.9 139.49 51.45 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 117.871 0.836 . . . . 54.299999999999997 110.036 178.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.56 -0.25 73.87 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.207 -0.997 . . . . 49.130000000000003 115.183 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -104.76 149.36 25.68 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 118.32 1.06 . . . . 59.5 109.525 175.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -95.06 139.11 31.87 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 107.712 -1.218 . . . . 43.170000000000002 107.712 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -154.36 178.98 9.43 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 119.618 -0.833 . . . . 53.810000000000002 110.707 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.64 179.72 40.23 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 109.746 -1.341 . . . . 38.18 109.746 171.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -101.28 143.21 31.62 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.822 -0.807 . . . . 39.07 108.822 -176.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 155.14 -160.57 29.86 Favored Glycine 0 C--O 1.224 -0.473 0 C-N-CA 118.843 -1.646 . . . . 43.649999999999999 110.933 175.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 159.45 -162.48 32.89 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 110.355 -1.098 . . . . 40.060000000000002 110.355 -176.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.2 tttm -74.6 135.49 42.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.583 -0.808 . . . . 63.259999999999998 110.284 -172.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 42.4 t -77.18 125.14 36.72 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.251 0 N-CA-C 105.78 -1.933 . . . . 42.340000000000003 105.78 172.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -88.82 168.61 12.31 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 116.739 -1.984 . . . . 61.659999999999997 110.249 -176.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -68.28 142.2 55.64 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 118.896 -1.122 . . . . 46.460000000000001 108.581 174.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.07 3.49 82.64 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 116.314 1.286 . . . . 53.009999999999998 116.314 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -132.04 150.62 52.11 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 119.296 1.548 . . . . 45.990000000000002 110.213 175.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 70.4 p -77.13 160.72 28.8 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.895 0.855 . . . . 41.670000000000002 110.174 174.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 70.4 mt -57.73 -46.84 86.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.242 -0.89 . . . . 41.299999999999997 109.922 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -32.03 70.37 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 119.431 -0.908 . . . . 69.670000000000002 112.373 -174.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -71.2 -36.87 72.08 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.458 -0.897 . . . . 58.049999999999997 111.455 173.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -64.26 -38.69 96.24 Favored Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.018 -1.087 . . . . 38.969999999999999 112.004 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -45.92 91.16 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.371 -0.488 . . . . 41.030000000000001 110.874 174.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 73.7 mtt-85 -64.45 -40.11 95.11 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.256 -0.978 . . . . 61.07 110.796 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.2 ttp85 -61.2 -52.64 63.94 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 120.654 -0.419 . . . . 54.649999999999999 111.296 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -60.32 -38.95 85.3 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.04 -1.064 . . . . 60.409999999999997 111.445 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.4 -43.47 94.33 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.142 -1.023 . . . . 43.640000000000001 111.244 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -61.25 -45.84 92.85 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.882 -0.511 . . . . 57.329999999999998 111.587 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -66.37 -42.9 87.34 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 119.655 -0.818 . . . . 57.549999999999997 111.559 -178.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -82.42 -37.17 25.89 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.673 0.62 . . . . 50.07 112.673 -169.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 83.3 p -111.82 -10.47 14.01 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 115.821 1.786 . . . . 45.130000000000003 115.821 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 72.62 14.68 77.71 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 115.932 1.133 . . . . 49.799999999999997 115.932 -169.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 95.4 mt -105.46 147.69 28.01 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 118.928 1.364 . . . . 45.359999999999999 111.614 -173.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 88.7 m -110.53 148.91 31.16 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.719 -1.215 . . . . 50.359999999999999 107.719 172.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.485 HG11 HG21 ' A' ' 88' ' ' THR . 3.2 m -126.53 142.51 42.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 N-CA-C 109.379 -0.6 . . . . 52.090000000000003 109.379 -177.784 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -77.53 -41.52 38.86 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.462 0.476 . . . . 71.349999999999994 111.39 174.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.58 149.81 41.24 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.57 -0.53 . . . . 49.420000000000002 109.57 -177.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 70.8 mt -120.69 136.56 54.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.665 -1.235 . . . . 44.5 107.665 169.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -105.84 132.04 52.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.849 -1.167 . . . . 49.399999999999999 107.849 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -76.57 112.84 13.54 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 104.999 -2.223 . . . . 61.590000000000003 104.999 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.417 HG21 HD21 ' A' ' 127' ' ' LEU . 2.0 m -106.16 -11.16 10.17 Favored 'Isoleucine or valine' 0 C--O 1.247 0.935 0 N-CA-C 114.157 1.169 . . . . 48.32 114.157 -179.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 173.8 168.59 35.0 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 116.065 -2.969 . . . . 40.009999999999998 114.113 -172.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.456 ' HG3' HD13 ' A' ' 157' ' ' LEU . 48.4 mm-40 -135.11 131.83 37.37 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 105.63 -1.989 . . . . 56.0 105.63 -179.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 53.2 mt -128.79 138.01 55.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 107.52 -1.289 . . . . 44.789999999999999 107.52 173.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 94.4 t -110.72 130.97 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.354 -0.98 . . . . 42.450000000000003 108.354 171.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.47 ' HB2' ' HB2' ' A' ' 81' ' ' MET . 17.0 m-85 -109.09 131.69 54.83 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.648 -0.871 . . . . 48.689999999999998 108.648 174.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -121.91 135.46 54.88 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 123.547 0.739 . . . . 70.269999999999996 109.075 172.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -116.33 158.08 23.99 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.289 -1.004 . . . . 68.959999999999994 108.289 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.6 m -92.41 127.89 44.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-N 115.618 -0.719 . . . . 76.209999999999994 109.2 176.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 97.19 -22.34 41.3 Favored Glycine 0 N--CA 1.44 -1.094 0 CA-C-O 119.155 -0.803 . . . . 82.159999999999997 114.513 -172.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.408 ' HB3' ' HG2' ' A' ' 79' ' ' GLU . 1.1 mt-10 -108.14 122.41 40.72 Favored Pre-proline 0 C--O 1.242 0.664 0 CA-C-N 118.333 1.066 . . . . 83.450000000000003 109.579 179.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.78 -15.99 33.27 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 120.212 0.608 . . . . 71.060000000000002 113.563 173.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.408 ' HG2' ' HB3' ' A' ' 77' ' ' GLU . 1.1 pt-20 -68.3 133.82 49.37 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.019 0.372 . . . . 75.109999999999999 110.803 178.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.3 mt -102.78 149.34 24.57 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.448 -0.945 . . . . 54.0 108.448 165.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' MET . . . . . 0.47 ' HB2' ' HB2' ' A' ' 72' ' ' PHE . 55.2 mtm -105.86 122.57 46.39 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.381 -0.6 . . . . 62.0 109.381 176.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -99.78 104.49 16.19 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 105.606 -1.998 . . . . 37.030000000000001 105.606 176.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 49.0 t -106.09 114.26 44.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.241 -1.022 . . . . 33.979999999999997 108.241 -172.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -92.52 118.98 31.54 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.936 -1.135 . . . . 39.159999999999997 107.936 177.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 42.0 t -98.89 135.44 33.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 N-CA-C 109.17 -0.678 . . . . 37.060000000000002 109.17 -175.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -130.61 156.02 45.57 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.174 -1.047 . . . . 40.590000000000003 108.174 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 27.2 p -130.76 162.48 29.41 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.703 -0.851 . . . . 47.280000000000001 108.703 165.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' THR . . . . . 0.485 HG21 HG11 ' A' ' 61' ' ' VAL . 6.0 t -148.38 136.77 21.32 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.45 -0.796 . . . . 49.0 109.512 179.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -97.41 -19.04 18.72 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 113.824 1.046 . . . . 72.0 113.824 168.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.1 p -111.3 101.33 9.81 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 107.74 -1.207 . . . . 57.359999999999999 107.74 -167.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 28.5 pt -118.79 159.1 19.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 107.708 -1.219 . . . . 52.299999999999997 107.708 -178.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -137.33 144.66 42.68 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.164 -0.925 . . . . 67.25 108.557 173.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 107.02 174.95 22.81 Favored Glycine 0 C--N 1.321 -0.265 0 CA-C-O 122.525 1.07 . . . . 44.850000000000001 111.435 -178.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -113.49 140.3 24.33 Favored Pre-proline 0 N--CA 1.444 -0.743 1 C-N-CA 109.131 -5.028 . . . . 52.450000000000003 109.186 173.743 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -64.53 134.46 41.42 Favored 'Trans proline' 0 C--N 1.331 -0.371 0 N-CA-C 110.583 -0.583 . . . . 43.600000000000001 110.583 -172.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.5 p -146.84 145.38 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 108.124 -1.065 . . . . 43.390000000000001 108.124 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.14 153.83 38.03 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 119.225 -0.99 . . . . 46.439999999999998 111.102 -172.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 60.1 p -103.42 -177.4 3.36 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.34 -1.356 . . . . 46.0 107.34 167.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.518 ' OD2' ' N ' ' A' ' 99' ' ' ASP . 0.1 OUTLIER -61.57 -32.71 72.81 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.324 -0.951 . . . . 79.540000000000006 111.452 172.506 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -83.73 -38.6 21.18 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.277 0.843 . . . . 74.409999999999997 113.277 -174.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.3 mmm -140.8 145.39 36.25 Favored 'General case' 0 C--N 1.343 0.302 0 N-CA-C 112.263 0.468 . . . . 55.869999999999997 112.263 -165.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 45.6 ttm105 -119.67 115.42 33.73 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-O 119.308 -0.377 . . . . 44.390000000000001 111.445 174.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -77.61 144.64 22.53 Favored 'Trans proline' 0 C--O 1.234 0.283 0 CA-C-N 120.165 1.095 . . . . 38.439999999999998 112.138 -177.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 33.3 t -149.69 146.82 27.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.17 -1.048 . . . . 53.700000000000003 108.17 173.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -88.9 144.93 25.86 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 123.575 0.547 . . . . 40.840000000000003 109.706 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -129.43 139.01 51.77 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.881 -0.785 . . . . 38.969999999999999 108.881 175.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -67.58 146.32 54.0 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 117.926 -1.51 . . . . 53.520000000000003 108.878 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 24.8 mt -60.26 -24.33 64.82 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.587 0.958 . . . . 47.969999999999999 113.587 -171.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.6 p30 -92.57 -1.84 56.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 113.279 0.844 . . . . 60.460000000000001 113.279 177.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -106.15 13.04 29.53 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 114.527 1.306 . . . . 57.030000000000001 114.527 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 37.8 mm -51.33 128.52 31.78 Favored Pre-proline 0 C--O 1.24 0.56 0 CA-C-N 119.059 0.845 . . . . 48.670000000000002 109.477 -176.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -87.07 68.76 4.03 Favored 'Trans proline' 0 N--CA 1.483 0.865 0 C-N-CA 122.124 1.883 . . . . 45.600000000000001 112.836 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -59.92 -27.24 66.58 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 119.909 -0.717 . . . . 43.759999999999998 112.144 -174.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.2 pttp -70.87 -23.57 62.33 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 119.234 -0.986 . . . . 65.090000000000003 112.142 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -98.8 11.48 38.58 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.254 1.422 . . . . 57.109999999999999 113.842 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 68.1 mtp -118.72 174.66 6.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.288 0.566 . . . . 43.350000000000001 109.954 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -65.19 145.83 99.03 Favored Pre-proline 0 C--O 1.237 0.399 0 C-N-CA 120.549 -0.461 . . . . 54.659999999999997 110.307 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.92 -33.15 92.89 Favored 'Trans proline' 0 CA--C 1.516 -0.417 0 N-CA-C 114.637 0.976 . . . . 46.520000000000003 114.637 -173.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -64.63 -23.12 67.16 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 118.449 -1.3 . . . . 45.789999999999999 111.611 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.602 ' O ' ' HB2' ' A' ' 124' ' ' PHE . 6.6 m-20 -62.83 -29.29 70.63 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.919 -0.712 . . . . 49.119999999999997 111.475 -175.349 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 58.5 m -60.89 -24.56 66.07 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 112.175 0.435 . . . . 48.159999999999997 112.175 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -85.63 -60.84 1.91 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.833 0.679 . . . . 63.649999999999999 112.833 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 64.0 p-90 -84.83 -22.23 29.55 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 114.863 1.431 . . . . 42.5 114.863 -174.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.602 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 0.4 OUTLIER -57.38 -46.31 99.81 Favored Pre-proline 0 C--O 1.246 0.898 0 CA-C-O 118.355 -0.831 . . . . 53.810000000000002 112.09 177.169 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -48.18 -42.51 33.01 Favored 'Trans proline' 0 C--O 1.238 0.483 0 CA-C-N 121.123 1.437 . . . . 50.219999999999999 115.2 170.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.4 mt -66.7 -47.89 70.98 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 119.347 0.976 . . . . 53.07 110.962 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.642 ' HG ' HD22 ' A' ' 11' ' ' LEU . 1.6 tm? -49.75 -46.72 50.84 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.771 0.32 . . . . 52.280000000000001 110.801 173.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.4 mt -70.8 -16.96 62.78 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 113.393 0.886 . . . . 55.189999999999998 113.393 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -94.15 6.65 47.94 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.102 0.864 . . . . 59.380000000000003 112.747 173.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 62.22 34.86 15.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.207 0.527 . . . . 61.159999999999997 112.048 -176.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -103.58 141.66 35.64 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.92 -0.77 . . . . 66.069999999999993 108.92 175.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -94.24 146.73 23.81 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 123.565 0.746 . . . . 54.700000000000003 109.0 175.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -147.1 161.11 41.52 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 119.123 -1.031 . . . . 47.399999999999999 112.093 -167.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HIS . . . . . 0.507 ' NE2' ' HB2' ' A' ' 157' ' ' LEU . 63.6 m170 -120.95 138.91 53.9 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.912 1.285 . . . . 61.210000000000001 107.9 162.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -145.44 158.0 27.52 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.193 -1.003 . . . . 43.710000000000001 111.419 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -141.74 134.33 28.36 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 106.992 -1.484 . . . . 61.850000000000001 106.992 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -136.23 119.28 16.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.418 -0.586 . . . . 49.579999999999998 109.418 -178.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 16.4 ttpt -93.94 118.59 31.69 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 123.669 0.606 . . . . 70.140000000000001 109.381 174.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -105.25 150.64 24.96 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.021 0.929 . . . . 61.259999999999998 111.188 -171.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.41 ' HB2' ' HG ' ' A' ' 146' ' ' LEU . 34.2 tt0 -126.82 110.89 13.56 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 106.591 -1.633 . . . . 70.439999999999998 106.591 171.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . 65.04 -158.55 45.01 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 114.93 -3.51 . . . . 69.879999999999995 112.449 -170.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -84.4 -42.97 15.15 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 113.495 0.924 . . . . 75.439999999999998 113.495 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -96.78 3.6 52.21 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 114.878 1.436 . . . . 78.980000000000004 114.878 -164.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 8.5 m -129.41 112.19 13.56 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 119.701 1.137 . . . . 63.240000000000002 111.668 -165.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 75.3 mt -79.74 121.02 32.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 108.255 -1.017 . . . . 48.719999999999999 108.255 168.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.41 ' HG ' ' HB2' ' A' ' 140' ' ' GLN . 20.5 mt -80.35 -46.6 15.81 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 111.91 0.337 . . . . 59.229999999999997 111.91 174.044 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -155.06 160.65 41.18 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 107.863 -1.162 . . . . 67.909999999999997 107.863 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -159.57 160.32 34.31 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 118.867 -1.133 . . . . 58.18 110.218 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 1.4 p -137.98 146.16 42.81 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.091 -0.959 . . . . 64.159999999999997 108.611 166.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 16.0 tp -147.52 137.25 22.79 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.499 -1.297 . . . . 54.93 107.499 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -144.32 136.11 25.99 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 123.518 0.511 . . . . 78.260000000000005 110.313 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -69.72 157.28 37.61 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.579 0.704 . . . . 81.099999999999994 109.225 167.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 14.5 m -144.56 158.94 14.78 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 108.332 -0.988 . . . . 61.509999999999998 108.332 178.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -79.09 -59.17 2.88 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.73 -0.668 . . . . 72.370000000000005 111.662 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 26.8 p -116.34 155.34 28.62 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.796 -0.816 . . . . 62.579999999999998 108.796 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 57.5 t -99.13 106.31 18.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 C-N-CA 119.339 -0.945 . . . . 61.689999999999998 111.695 -174.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.507 ' HB2' ' NE2' ' A' ' 134' ' ' HIS . 0.3 OUTLIER 34.99 77.69 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 119.743 3.238 . . . . 64.030000000000001 119.743 130.731 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -81.69 128.67 34.21 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 120.04 1.291 . . . . 56.590000000000003 110.253 169.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HIS . . . . . 0.468 ' CD2' HD22 ' A' ' 157' ' ' LEU . 48.4 m170 -92.82 -15.03 26.99 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 114.28 1.215 . . . . 44.710000000000001 114.28 179.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 53.4 m80 53.83 50.56 16.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.592 0.711 . . . . 47.75 112.322 -179.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -69.04 120.0 14.22 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 106.756 -1.572 . . . . 47.539999999999999 106.756 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -95.45 -2.32 49.05 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 117.291 -1.764 . . . . 47.859999999999999 113.563 -173.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -99.51 -0.48 40.54 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.887 0.699 . . . . 43.359999999999999 112.887 165.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 . . . . . 0 C--N 1.324 -0.512 0 C-N-CA 119.815 -0.754 . . . . 42.100000000000001 111.871 -177.602 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.443 ' O ' ' NE2' ' A' ' 69' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_