data_6knv_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 6knv _Structure_validation_residue.Date_analyzed 2019-10-18 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 ' 211' ' ' LYS . . . . . . . . . . . . . 18.1 mttt . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 110.969 -0.011 . . . . 70.6 110.969 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -59.65 134.15 55.9 Favored 'Trans proline' 0 C--O 1.236 0.41 0 O-C-N 122.715 0.85 . . . . 67.01 113.68 -172.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -105.75 170.48 5.82 Favored Pre-proline 0 C--O 1.249 1.072 0 C-N-CA 127.438 2.295 . . . . 81.87 109.942 178.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -60.67 137.38 72.95 Favored 'Trans proline' 0 C--O 1.233 0.232 0 CA-C-N 119.32 0.793 . . . . 51.42 112.678 -169.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 5.2 p -72.43 170.14 14.9 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.931 0.872 . . . . 75.14 109.344 166.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -63.23 -35.58 80.79 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.584 -0.846 . . . . 81.25 111.571 -175.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -72.15 -25.95 61.91 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 118.768 -1.173 . . . . 100.1 111.346 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' GLU . . . . . 0.501 ' OE2' ' ND1' ' A' ' 405' ' ' HIS . 12.5 mt-10 -77.33 -29.61 53.61 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.56 -0.456 . . . . 64.96 111.995 178.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -63.22 -49.04 75.75 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.806 0.336 . . . . 48.92 110.755 172.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -50.63 -43.63 57.02 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.815 -0.354 . . . . 86.09 110.708 169.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.65 -47.47 78.36 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.118 0.485 . . . . 45.41 111.0 -179.797 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' ILE . . . . . . . . . . . . . 16.7 mt -60.74 -46.47 95.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-O 121.562 0.696 . . . . 47.76 110.761 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -58.02 -44.99 87.6 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 122.043 -0.411 . . . . 73.33 111.584 178.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' THR . . . . . . . . . . . . . 53.3 m -66.42 -45.03 81.27 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.251 -0.58 . . . . 50.58 111.101 -174.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' VAL . . . . . . . . . . . . . 3.0 t -66.87 -41.38 87.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 CA-C-O 121.317 0.579 . . . . 54.69 110.403 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' THR . . . . . . . . . . . . . 59.7 m -60.24 -46.18 90.67 Favored 'General case' 0 CA--C 1.511 -0.527 0 C-N-CA 119.542 -0.863 . . . . 47.21 110.659 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -65.34 -36.61 84.54 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.495 -0.482 . . . . 70.54 110.886 -177.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' ALA . . . . . . . . . . . . . . . -56.53 -40.01 74.35 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.582 -0.847 . . . . 39.82 111.019 173.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -73.06 -44.06 61.1 Favored 'General case' 0 C--O 1.238 0.447 0 N-CA-C 113.258 0.836 . . . . 42.0 113.258 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' VAL . . . . . . . . . . . . . 19.6 t -64.53 -40.72 90.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 119.833 -0.747 . . . . 47.03 109.914 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' ALA . . . . . . . . . . . . . . . -62.21 -16.35 52.7 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 113.61 0.967 . . . . 44.17 113.61 178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' THR . . . . . . . . . . . . . 9.8 p -123.74 2.82 8.87 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 113.68 0.993 . . . . 33.86 113.68 -172.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -85.61 122.96 30.47 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.658 0.783 . . . . 67.43 109.052 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.74 133.11 52.93 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.585 0.587 . . . . 45.87 112.585 -168.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 53.28 24.65 3.9 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.357 -0.838 . . . . 79.8 111.755 -179.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' GLY . . . . . . . . . . . . . . . 32.44 -107.28 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 N-CA-C 116.543 1.377 . . . . 70.37 116.543 173.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' SER . . . . . . . . . . . . . 1.3 m -96.52 -13.91 22.68 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 113.413 0.894 . . . . 88.51 113.413 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HIS . . . . . . . . . . . . . 36.9 m170 -80.68 -3.64 51.39 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.112 0.782 . . . . 89.83 113.112 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' TRP . . . . . . . . . . . . . 50.7 p-90 -56.73 -30.85 63.95 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 118.633 0.651 . . . . 75.36 112.708 -162.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -82.27 -6.86 59.53 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.297 0.499 . . . . 77.47 112.219 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -103.0 -42.42 5.81 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.465 0.543 . . . . 102.74 112.465 174.421 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.24 -15.59 63.78 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.245 -0.582 . . . . 83.41 111.83 173.138 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' ARG . . . . . . . . . . . . . 7.8 ptt180 -77.31 147.56 36.14 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 122.078 0.942 . . . . 64.06 111.945 -167.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 333' ' ' GLU . 4.4 mmtm -129.23 141.05 51.24 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 114.233 -1.349 . . . . 80.73 107.447 -176.824 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -85.87 127.88 34.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.131 -0.486 . . . . 72.06 110.142 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.34 137.2 75.53 Favored Pre-proline 0 C--O 1.235 0.326 0 N-CA-C 109.394 -0.595 . . . . 70.37 109.394 173.657 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.31 -0.43 1.34 Allowed 'Trans proline' 0 C--N 1.354 0.866 0 N-CA-C 119.146 2.71 . . . . 109.34 119.146 -161.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 77.68 -21.17 0.34 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 120.124 1.329 . . . . 105.46 113.522 169.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.3 -31.97 68.07 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.636 -0.826 . . . . 100.05 110.102 160.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' ILE . . . . . . . . . . . . . 9.2 mt -77.38 136.0 25.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 109.199 -0.667 . . . . 87.19 109.199 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' GLY . . . . . . . . . . . . . . . 88.32 39.32 6.86 Favored Glycine 0 C--N 1.336 0.53 0 N-CA-C 115.421 0.928 . . . . 59.36 115.421 174.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -103.34 172.4 6.83 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.626 0.727 . . . . 99.23 109.953 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' ALA . . . . . . . . . . . . . . . -70.31 118.23 62.17 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.296 -0.866 . . . . 92.34 110.734 -172.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.23 155.41 60.84 Favored 'Trans proline' 0 C--N 1.331 -0.38 0 CA-C-N 119.326 0.795 . . . . 100.61 110.116 172.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' ILE . . . . . . . . . . . . . 1.4 mt . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.405 -0.816 . . . . 90.35 111.222 -174.155 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.261 0 CA-C-O 121.312 0.577 . . . . 91.47 112.022 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' VAL . . . . . . . . . . . . . 24.5 t -141.74 129.3 21.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 107.908 -1.145 . . . . 95.27 107.908 -174.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -68.38 131.83 46.0 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.607 -0.516 . . . . 93.85 109.607 169.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' LEU . . . . . . . . . . . . . 4.2 tp -86.28 -23.55 26.29 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 119.142 -1.023 . . . . 87.63 112.715 -175.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -74.71 -44.78 48.24 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.545 -0.862 . . . . 100.15 111.065 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 268' ' ' ALA . . . . . . . . . . . . . . . -54.97 -47.23 74.83 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.028 -0.669 . . . . 70.2 110.298 170.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -60.21 -37.15 79.39 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 116.255 -0.43 . . . . 61.36 111.346 -176.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' SER . . . . . . . . . . . . . 33.8 m -63.44 -34.22 77.27 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.158 -0.617 . . . . 69.05 111.909 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' HIS . . . . . . . . . . . . . 50.2 m80 -72.37 -36.89 68.84 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 120.264 -0.575 . . . . 64.07 111.723 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -72.3 -37.15 69.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.345 0.498 . . . . 63.38 112.345 -175.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 273' ' ' THR . . . . . . . . . . . . . 31.5 p -64.75 -23.87 67.38 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 119.814 -0.754 . . . . 51.14 111.859 169.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 274' ' ' LYS . . . . . . . . . . . . . 28.7 mmtm -73.14 -28.87 62.49 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.312 -0.555 . . . . 63.99 111.744 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 275' ' ' ILE . . . . . . . . . . . . . 24.7 pt -107.26 -8.55 10.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.631 0 CA-C-O 118.713 -0.66 . . . . 68.57 112.77 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 276' ' ' ILE . . . . . . . . . . . . . 4.9 tp -63.35 -38.75 82.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 C-N-CA 119.685 -0.806 . . . . 51.08 110.431 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 277' ' ' THR . . . . . . . . . . . . . 24.1 m -72.55 -45.88 9.82 Favored Pre-proline 0 C--O 1.252 1.216 0 C-N-CA 118.448 -1.301 . . . . 47.94 111.924 -170.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -60.12 -24.25 76.23 Favored 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 122.12 1.793 . . . . 42.9 113.226 173.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' ALA . . . . . . . . . . . . . . . -79.61 -48.48 13.71 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 111.375 0.139 . . . . 53.96 111.375 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 280' ' ' ILE . . . . . . . . . . . . . 86.8 mt -51.22 -42.83 26.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.095 0.474 . . . . 43.08 110.046 169.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 281' ' ' THR . . . . . . . . . . . . . 2.6 m -60.74 -40.65 93.2 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.968 -0.457 . . . . 53.41 111.572 -174.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -61.54 -39.7 92.02 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.786 0.327 . . . . 67.99 111.498 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 71.2 t -60.88 -39.06 80.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 O-C-N 122.163 -0.336 . . . . 56.67 110.581 176.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 284' ' ' VAL . . . . . . . . . . . . . 67.7 t -66.04 -39.77 85.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 121.15 0.5 . . . . 35.96 110.337 176.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 285' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.99 -30.87 71.23 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 118.74 -1.184 . . . . 82.03 112.236 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 286' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -69.29 -48.41 61.72 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 121.976 -0.452 . . . . 43.44 111.537 -179.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -67.37 -31.88 72.42 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 120.399 -0.52 . . . . 36.56 111.508 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -73.76 -14.38 61.11 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.885 0.698 . . . . 47.75 112.885 -179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 289' ' ' LYS . . . . . 0.447 ' NZ ' ' O ' ' A' ' 613' ' ' HOH . 13.4 mttp -90.08 8.94 30.18 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 113.105 0.78 . . . . 40.25 113.105 172.252 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 290' ' ' LEU . . . . . . . . . . . . . 74.4 mt -108.69 114.84 58.37 Favored Pre-proline 0 C--O 1.243 0.726 0 N-CA-C 108.363 -0.977 . . . . 59.34 108.363 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 291' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.19 -28.21 60.33 Favored 'Trans proline' 0 C--O 1.24 0.609 0 CA-C-N 119.487 0.852 . . . . 51.11 112.729 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 45.2 mtt -65.76 -42.22 91.13 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.87 -0.332 . . . . 91.36 111.029 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 293' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -71.53 -36.09 70.89 Favored 'General case' 0 C--N 1.347 0.48 0 CA-C-O 120.576 0.227 . . . . 52.49 111.042 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 294' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.01 -23.11 63.08 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.842 1.053 . . . . 69.09 113.842 -171.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 295' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -89.58 9.33 27.18 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.301 0.955 . . . . 86.31 113.518 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 296' ' ' LEU . . . . . . . . . . . . . 36.0 mt -81.82 151.64 67.92 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 118.853 0.751 . . . . 50.11 110.557 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 297' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -58.86 149.84 75.62 Favored 'Trans proline' 0 C--N 1.324 -0.753 0 N-CA-C 110.154 -0.748 . . . . 55.62 110.154 171.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 298' ' ' CYS . . . . . . . . . . . . . 2.1 t -59.57 -37.87 79.62 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.795 -0.762 . . . . 115.49 111.175 -172.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -60.43 -39.26 86.83 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.062 -0.655 . . . . 94.05 111.65 179.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -68.02 -41.6 81.95 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.444 -0.502 . . . . 81.92 111.551 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -58.86 -37.1 75.75 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 120.675 0.274 . . . . 63.93 111.619 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' ILE . . . . . . . . . . . . . 31.0 mt -65.93 -48.82 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.103 0.477 . . . . 55.71 110.248 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' ILE . . . . . . . . . . . . . 3.0 mt -59.43 -47.92 88.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 C-N-CA 119.803 -0.759 . . . . 46.31 110.014 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' LEU . . . . . . . . . . . . . 7.4 mt -56.16 -32.33 64.2 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.164 0.431 . . . . 41.71 112.164 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' LEU . . . . . . . . . . . . . 1.2 tp -85.29 -36.36 20.91 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.557 0.577 . . . . 45.67 112.557 -171.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' LYS . . . . . 0.464 ' NZ ' ' OD1' ' C' ' 742' ' ' ASN . 3.8 mtpp -64.1 -26.61 68.62 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 121.098 -0.241 . . . . 59.96 111.593 171.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' GLY . . . . . . . . . . . . . . . -85.99 -24.06 42.8 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 115.638 1.015 . . . . 42.46 115.638 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' CYS . . . . . . . . . . . . . 21.4 p -113.21 -7.43 13.58 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 113.247 0.832 . . . . 40.5 113.247 -174.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -62.02 -55.75 26.06 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 118.31 0.505 . . . . 83.26 112.167 -170.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' MET . . . . . . . . . . . . . 6.6 tpp -53.89 -49.32 68.82 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.6 -0.273 . . . . 90.02 110.885 173.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -51.94 -47.72 64.58 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.045 0.45 . . . . 76.11 112.113 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' ILE . . . . . . . . . . . . . 81.9 mt -73.46 -40.32 55.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 O-C-N 121.55 -0.719 . . . . 45.7 110.999 -172.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' MET . . . . . . . . . . . . . 27.0 mtm -61.99 -41.08 97.65 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.746 0.307 . . . . 64.14 111.302 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' SER . . . . . . . . . . . . . 67.0 m -59.52 -43.69 93.37 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.203 -0.599 . . . . 45.25 111.351 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' LEU . . . . . . . . . . . . . 54.4 tp -61.23 -50.8 71.59 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.858 0.361 . . . . 39.78 111.115 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -64.33 -30.93 71.97 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.708 0.633 . . . . 46.8 112.708 -178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' ALA . . . . . . . . . . . . . . . -71.02 -35.38 72.0 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.125 -0.63 . . . . 43.4 111.215 174.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -76.23 -29.12 57.44 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.362 0.875 . . . . 40.37 113.362 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' VAL . . . . . . . . . . . . . 34.8 m -72.92 -8.43 11.52 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 C-N-CA 118.15 -1.42 . . . . 53.64 110.415 175.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' ARG . . . . . 0.616 ' NH1' ' O ' ' A' ' 608' ' ' HOH . 91.9 mtt180 -107.45 37.2 2.47 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 122.4 1.095 . . . . 54.65 111.011 179.065 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -77.6 137.28 38.48 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 114.675 -1.148 . . . . 58.64 109.661 171.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 326' ' ' GLU . 42.9 t0 -123.76 101.74 36.01 Favored Pre-proline 0 C--O 1.246 0.898 0 N-CA-C 108.173 -1.047 . . . . 53.78 108.173 176.229 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -63.99 -29.57 66.53 Favored 'Trans proline' 0 N--CA 1.476 0.459 0 N-CA-C 114.788 1.034 . . . . 61.08 114.788 179.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.97 -22.78 64.8 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.459 1.027 . . . . 116.44 111.92 175.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' SER . . . . . . . . . . . . . 2.6 t -117.54 -22.18 8.24 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 114.415 1.265 . . . . 77.7 114.415 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 322' ' ' ASP . 31.9 mt-10 66.66 44.76 2.15 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.841 0.829 . . . . 104.11 110.077 -177.72 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' THR . . . . . . . . . . . . . 24.4 p -132.73 149.91 52.22 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.118 -0.946 . . . . 59.0 110.03 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' LEU . . . . . . . . . . . . . 34.4 mt -103.75 153.78 20.31 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.541 -1.209 . . . . 50.19 107.882 162.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 84.8 m -113.38 122.55 47.69 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.025 -0.534 . . . . 61.43 109.573 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 35.4 mt -104.2 133.63 48.79 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.14 0.976 . . . . 59.78 109.38 -177.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' ASN . . . . . . . . . . . . . 1.8 m120 63.25 18.82 11.27 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.102 0.961 . . . . 64.81 113.282 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' GLY . . . . . . . . . . . . . . . 72.77 11.62 77.91 Favored Glycine 0 C--N 1.331 0.292 0 N-CA-C 116.643 1.417 . . . . 43.19 116.643 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 244' ' ' LYS . 26.0 pt-20 -149.77 -19.89 0.26 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.101 1.45 . . . . 106.88 114.906 -169.869 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' MET . . . . . . . . . . . . . 29.8 ttm -115.09 105.21 12.68 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.663 0.665 . . . . 63.09 110.171 -175.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' ALA . . . . . . . . . . . . . . . -81.57 129.52 34.71 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 109.38 -0.6 . . . . 48.79 109.38 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 49.2 t -133.45 135.99 55.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.263 -0.643 . . . . 47.13 109.263 -173.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' THR . . . . . . . . . . . . . 37.6 p -82.43 168.77 17.14 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-O 121.666 0.746 . . . . 43.4 110.305 177.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' ARG . . . . . 0.736 ' NH2' ' O ' ' A' ' 606' ' ' HOH . 8.4 ttm105 -62.92 -36.07 82.17 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.686 -0.806 . . . . 96.34 111.351 -176.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' GLY . . . . . . . . . . . . . . . -72.19 -40.4 56.02 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 120.054 -1.07 . . . . 47.47 112.725 -176.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -57.12 -49.92 74.4 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.884 0.342 . . . . 61.18 111.196 176.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' LEU . . . . . . . . . . . . . 34.6 tp -66.44 -35.6 80.69 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.409 -0.516 . . . . 46.08 111.648 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' LYS . . . . . . . . . . . . . 17.8 tttp -65.84 -46.61 77.9 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.348 -0.941 . . . . 68.04 110.66 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -78.51 -14.35 59.4 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 113.453 0.908 . . . . 64.45 113.453 -176.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' GLY . . . . . . . . . . . . . . . -76.63 -5.2 82.79 Favored Glycine 0 C--N 1.337 0.596 0 C-N-CA 120.444 -0.884 . . . . 49.41 114.56 173.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' GLY . . . . . . . . . . . . . . . 138.3 -20.54 3.16 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-O 119.084 -0.842 . . . . 48.9 114.629 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.98 -37.97 69.77 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 118.959 1.379 . . . . 52.79 112.591 -173.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' GLY . . . . . . . . . . . . . . . 69.11 -134.44 27.09 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 119.431 -1.366 . . . . 49.23 110.864 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' VAL . . . . . . . . . . . . . 5.5 p -63.06 -24.31 35.63 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 112.166 0.432 . . . . 47.89 112.166 -176.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.19 -27.59 43.05 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 O-C-N 121.601 -0.687 . . . . 42.71 110.154 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.4 t -60.15 -47.7 84.82 Favored 'General case' 0 C--O 1.239 0.51 0 O-C-N 121.817 -0.552 . . . . 44.9 112.352 171.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -62.63 -33.11 74.36 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.467 -0.893 . . . . 79.54 110.801 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' ALA . . . . . . . . . . . . . . . -63.76 -48.1 78.34 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.716 0.293 . . . . 39.85 111.382 177.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' ILE . . . . . . . . . . . . . 91.2 mt -68.66 -44.83 82.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.405 0.621 . . . . 39.28 110.751 -177.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.51 -27.97 69.63 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.6 -0.44 . . . . 46.01 111.785 177.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -70.4 -38.88 74.75 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 119.6 -0.84 . . . . 48.36 111.246 174.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' LEU . . . . . . . . . . . . . 8.5 tp -61.36 -48.02 83.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.808 -0.357 . . . . 42.17 110.832 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' GLY . . . . . . . . . . . . . . . -63.61 -39.86 98.04 Favored Glycine 0 C--N 1.338 0.676 0 C-N-CA 120.659 -0.781 . . . . 50.77 113.178 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' MET . . . . . 0.546 ' SD ' ' O ' ' A' ' 606' ' ' HOH . 29.7 mtp -62.81 -39.88 95.66 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.568 -0.853 . . . . 66.81 111.316 174.942 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 359' ' ' SER . . . . . . . . . . . . . 60.6 p -82.26 -17.88 44.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.377 -0.929 . . . . 69.68 112.936 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 10.7 mt -77.97 -15.98 58.52 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.176 0.806 . . . . 66.23 113.176 179.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 8.8 t -71.69 -12.91 61.56 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 118.99 -1.084 . . . . 105.58 112.96 -174.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 362' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.59 -19.72 32.58 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 118.568 0.622 . . . . 78.17 111.834 171.694 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 363' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -85.51 -23.58 27.68 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.469 0.707 . . . . 65.14 112.86 -174.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 364' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 56.34 47.81 18.32 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.449 0.7 . . . . 72.29 111.228 170.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' LEU . . . . . . . . . . . . . 23.1 mt -69.87 133.58 47.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.958 -0.565 . . . . 52.2 110.556 -178.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' ASP . . . . . . . . . . . . . 30.1 p30 -94.57 -178.07 4.43 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.76 0.791 . . . . 63.24 110.289 173.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' ASP . . . . . 0.658 ' OD2' ' O ' ' A' ' 604' ' ' HOH . 60.3 m-20 -55.84 -39.99 72.21 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.001 -1.0 . . . . 87.74 112.262 -175.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 368' ' ' THR . . . . . . . . . . . . . 1.8 p -74.99 -35.4 62.03 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 116.822 -1.951 . . . . 58.83 111.521 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 369' ' ' GLU . . . . . 0.518 ' OE2' ' NE2' ' A' ' 412' ' ' HIS . 29.3 mt-10 -65.88 -40.1 91.29 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 120.625 0.25 . . . . 54.35 111.328 177.418 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 370' ' ' VAL . . . . . . . . . . . . . 53.7 t -65.71 -35.26 74.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 C-N-CA 119.557 -0.857 . . . . 40.38 109.724 174.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 371' ' ' ALA . . . . . . . . . . . . . . . -70.17 -42.15 72.85 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 120.659 -0.416 . . . . 32.55 110.791 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 47.4 mt -69.47 -37.11 77.13 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 118.967 -1.093 . . . . 39.61 111.248 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 373' ' ' LEU . . . . . . . . . . . . . 8.6 mt -50.15 -56.46 10.9 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 121.331 0.586 . . . . 40.27 111.021 168.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 374' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -55.46 -33.55 63.73 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.219 -0.446 . . . . 43.4 112.169 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 375' ' ' ALA . . . . . . . . . . . . . . . -72.23 -38.52 68.93 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 119.86 -0.736 . . . . 42.46 111.54 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 376' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.23 -36.84 78.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 C-N-CA 119.752 -0.779 . . . . 53.86 110.883 179.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 15.7 mt -73.31 -36.85 66.32 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 121.92 -0.488 . . . . 39.4 111.826 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 378' ' ' LEU . . . . . . . . . . . . . 62.3 tp -64.09 -44.91 90.89 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 121.917 -0.489 . . . . 37.13 111.278 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 379' ' ' MET . . . . . . . . . . . . . 22.8 mmt -89.03 71.71 8.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.313 1.054 . . . . 70.34 110.585 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 380' ' ' SER . . . . . 0.797 ' OG ' ' NH1' ' A' ' 429' ' ' ARG . 16.0 m -111.62 101.7 10.07 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 107.74 -1.207 . . . . 54.51 107.74 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 6.8 p -63.33 -5.01 3.0 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.618 -0.433 . . . . 66.97 112.096 170.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 382' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.48 -34.99 79.16 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 112.328 0.492 . . . . 95.77 112.328 -179.67 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 383' ' ' ARG . . . . . 0.668 ' O ' ' O ' ' A' ' 603' ' ' HOH . 10.5 mmt85 -61.24 144.08 91.89 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 117.979 0.354 . . . . 90.5 111.221 -168.284 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 384' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -78.7 140.18 16.38 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 120.209 0.606 . . . . 62.91 112.274 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 99.86 8.68 50.96 Favored Glycine 0 C--N 1.335 0.501 0 N-CA-C 116.284 1.273 . . . . 54.23 116.284 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 63.3 mt -81.41 130.41 35.03 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 118.708 1.254 . . . . 72.51 111.842 -172.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 387' ' ' ALA . . . . . . . . . . . . . . . -80.74 -35.25 33.62 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.182 -0.463 . . . . 71.8 112.151 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 388' ' ' CYS . . . . . . . . . . . . . 80.1 m -107.56 41.84 1.44 Allowed 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 123.087 0.555 . . . . 104.01 111.599 -172.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 389' ' ' VAL . . . . . . . . . . . . . 78.8 t -46.86 -47.09 8.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.777 -0.647 . . . . 59.3 111.102 -177.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 390' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -66.19 -44.92 82.59 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.07 -0.652 . . . . 108.81 111.184 -176.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 391' ' ' ARG . . . . . . . . . . . . . 23.0 ttm180 -58.64 -44.54 90.08 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 119.845 -0.742 . . . . 94.68 110.256 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 392' ' ' ILE . . . . . . . . . . . . . 4.3 mt -61.61 -37.09 77.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-O 120.869 0.366 . . . . 61.25 110.566 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 393' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -67.61 -29.01 68.24 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.045 -1.062 . . . . 100.09 112.129 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 394' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.85 -44.42 63.86 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 118.229 -1.388 . . . . 70.76 111.493 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 395' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -56.96 -44.82 82.97 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 120.591 -0.444 . . . . 71.8 111.756 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 396' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -63.65 -32.17 73.57 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.213 -0.595 . . . . 52.68 111.928 -178.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.38 -35.24 68.42 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.666 -0.813 . . . . 108.0 111.127 178.315 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 398' ' ' SER . . . . . . . . . . . . . 3.1 m -54.98 -48.84 72.75 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.122 0.487 . . . . 62.02 110.842 169.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -66.49 -46.42 76.35 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.4 -0.52 . . . . 47.23 111.032 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 4.4 mt -57.69 -46.23 84.6 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.807 -0.357 . . . . 53.18 111.421 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' LEU . . . . . . . . . . . . . 3.1 mt -60.36 -54.56 44.15 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 120.874 0.369 . . . . 54.99 111.6 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' ALA . . . . . . . . . . . . . . . -58.1 -31.73 67.41 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 111.875 0.324 . . . . 42.66 111.875 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -69.51 -46.13 67.26 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 120.883 0.373 . . . . 55.02 111.078 179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -61.0 -55.78 28.9 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.991 -0.684 . . . . 75.37 110.424 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HIS . . . . . 0.501 ' ND1' ' OE2' ' A' ' 218' ' ' GLU . 44.0 m170 -49.57 -38.0 29.55 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.64 -0.424 . . . . 63.29 111.41 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -67.88 -37.8 82.23 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 119.474 -0.891 . . . . 51.77 111.224 174.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' ILE . . . . . . . . . . . . . 1.4 mm -63.98 -42.0 94.31 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 C-N-CA 119.776 -0.77 . . . . 60.65 110.261 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -55.56 -60.45 3.41 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.436 -0.506 . . . . 67.22 110.736 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -55.15 -39.06 69.06 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.589 -0.444 . . . . 73.48 111.721 -179.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 3.6 mmm180 -68.05 -21.47 65.0 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 113.32 0.859 . . . . 81.92 113.32 -176.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 48.15 60.61 3.49 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 122.112 0.958 . . . . 72.77 111.029 171.464 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' HIS . . . . . 0.518 ' NE2' ' OE2' ' A' ' 369' ' ' GLU . 84.5 m-70 -63.25 146.82 52.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.138 -0.937 . . . . 76.18 109.949 170.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' HIS . . . . . . . . . . . . . 15.2 m80 -94.47 47.78 1.19 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.539 -0.755 . . . . 102.47 111.684 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' VAL . . . . . . . . . . . . . 39.3 t . . . . . 0 C--O 1.238 0.459 0 O-C-N 121.987 -0.446 . . . . 69.7 109.812 -176.473 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.56 0 N-CA-C 113.322 0.86 . . . . 72.26 113.322 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' PHE . . . . . 0.8 ' O ' ' O ' ' A' ' 601' ' ' HOH . 1.0 OUTLIER -55.28 141.23 36.42 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.149 -0.478 . . . . 82.28 110.09 175.615 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 110.04 -58.45 0.0 OUTLIER Pre-proline 0 C--O 1.237 0.41 0 C-N-CA 129.646 3.178 . . . . 60.42 109.995 171.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -54.74 -42.17 71.07 Favored 'Trans proline' 0 CA--C 1.513 -0.573 0 CA-C-N 120.711 1.29 . . . . 62.2 112.25 165.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -64.39 -42.96 95.84 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.805 0.336 . . . . 69.16 111.259 176.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 2.9 mt -62.15 -40.29 95.47 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 119.715 -0.794 . . . . 60.46 111.339 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 33.2 mt -61.18 -32.58 72.33 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.614 -0.434 . . . . 55.57 112.004 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 7.2 mtt -67.57 -31.96 72.4 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 120.182 -0.607 . . . . 64.72 111.581 174.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' LYS . . . . . . . . . . . . . 27.5 mmtm -69.64 -31.6 69.79 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.224 -0.59 . . . . 54.6 111.649 176.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' VAL . . . . . . . . . . . . . 30.8 t -60.51 -48.31 89.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 CA-C-O 120.946 0.403 . . . . 49.96 109.929 174.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' THR . . . . . . . . . . . . . 27.8 m -55.1 -46.22 75.5 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.499 -0.319 . . . . 56.24 110.773 173.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' ASP . . . . . 0.513 ' OD2' ' O ' ' A' ' 605' ' ' HOH . 81.3 m-20 -50.79 -46.49 59.66 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.221 0.534 . . . . 81.25 111.213 177.325 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' LEU . . . . . . . . . . . . . 16.3 mt -66.55 -41.87 87.99 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 119.816 -0.754 . . . . 38.38 112.63 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' ARG . . . . . 0.797 ' NH1' ' OG ' ' A' ' 380' ' ' SER . 2.1 mtp180 -59.87 -44.06 94.38 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.195 -1.002 . . . . 79.48 111.251 -179.931 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' MET . . . . . . . . . . . . . 50.4 mmm -52.16 -52.18 53.47 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 111.542 0.201 . . . . 46.69 111.542 168.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' ILE . . . . . . . . . . . . . 36.5 mt -49.89 -41.58 17.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 O-C-N 121.945 -0.472 . . . . 43.58 110.528 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' GLY . . . . . . . . . . . . . . . -70.7 -39.0 67.04 Favored Glycine 0 C--N 1.341 0.836 0 N-CA-C 114.785 0.674 . . . . 45.35 114.785 178.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' ALA . . . . . . . . . . . . . . . -67.57 -0.29 3.75 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 114.008 1.114 . . . . 59.58 114.008 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' CYS . . . . . . . . . . . . . 79.6 m -97.45 23.76 7.29 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.071 0.549 . . . . 101.03 112.076 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 47.4 m170 -51.66 -48.84 63.27 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.224 0.535 . . . . 97.8 110.255 171.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' ALA . . . . . . . . . . . . . . . -76.82 -35.42 57.58 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.239 -0.985 . . . . 80.1 112.483 -175.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' SER . . . . . . . . . . . . . 10.5 t -86.8 60.52 6.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 123.394 1.569 . . . . 105.93 110.012 174.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' TRP . . . . . 0.418 ' O ' ' CB ' ' A' ' 439' ' ' PHE . 0.0 OUTLIER -172.25 -59.65 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.888 1 N-CA-C 99.728 -4.175 . . . . 89.89 99.728 -178.577 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' PHE . . . . . 0.418 ' CB ' ' O ' ' A' ' 438' ' ' TRP . 19.9 m-85 . . . . . 0 N--CA 1.485 1.297 0 C-N-CA 126.53 1.932 . . . . 75.99 108.65 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 3.3 m . . . . . 0 C--O 1.224 -0.27 0 N-CA-C 110.056 -0.35 . . . . 101.92 110.056 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' PRO . . . . . 0.484 ' O ' ' N ' ' A' ' 450' ' ' LEU . 83.9 Cg_endo -84.31 152.34 12.21 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 CA-C-O 122.756 1.065 . . . . 100.51 113.318 -178.6 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' THR . . . . . . . . . . . . . 2.4 m -55.02 -33.48 62.67 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 114.072 -1.422 . . . . 74.11 113.542 -170.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.96 -19.93 20.83 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 113.321 0.86 . . . . 98.91 113.321 168.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' LEU . . . . . 0.484 ' N ' ' O ' ' A' ' 447' ' ' PRO . 1.1 mt -75.49 -20.95 58.43 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 118.17 -1.412 . . . . 75.93 112.794 -179.766 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -85.42 136.74 37.19 Favored Pre-proline 0 C--O 1.24 0.597 0 CA-C-N 117.893 0.315 . . . . 52.91 110.535 175.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -55.93 140.76 86.19 Favored 'Trans proline' 0 C--O 1.249 1.036 0 O-C-N 124.744 1.918 . . . . 56.63 110.412 171.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -64.88 -31.04 57.65 Favored 'Trans proline' 0 C--O 1.242 0.698 0 N-CA-C 113.723 0.624 . . . . 69.97 113.723 -173.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 43.3 tp -67.3 -38.17 84.56 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 118.825 -1.15 . . . . 52.28 110.838 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -59.87 -46.04 90.55 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 119.345 -0.942 . . . . 75.01 111.782 170.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' LEU . . . . . . . . . . . . . 75.0 mt -57.91 -26.08 61.71 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 117.768 -1.573 . . . . 70.17 112.07 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -79.4 -20.73 46.89 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.611 -0.835 . . . . 86.02 113.051 -172.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.76 15.94 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 118.624 0.647 . . . . 72.1 111.222 -175.507 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 114.163 1.171 . . . . 86.39 114.163 -179.402 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 741' ' ' GLU . . . . . 0.568 ' O ' ' NH1' ' C' ' 746' ' ' ARG . . . . . . . . 0 C--O 1.238 0.465 0 N-CA-C 110.091 -0.337 . . . . 74.06 110.091 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 742' ' ' ASN . . . . . 0.464 ' OD1' ' NZ ' ' A' ' 306' ' ' LYS . 19.6 m-80 60.23 44.31 12.82 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.778 0.799 . . . . 68.29 111.91 170.923 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 743' ' ' ALA . . . . . . . . . . . . . . . -68.73 -29.86 68.36 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.266 0.839 . . . . 63.84 113.266 -170.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 744' ' ' LEU . . . . . . . . . . . . . 22.0 tp -89.15 -40.35 12.96 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 113.651 0.982 . . . . 60.65 113.651 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 745' ' ' LEU . . . . . . . . . . . . . 14.7 tp -55.6 -41.92 74.1 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.005 0.431 . . . . 52.47 111.23 171.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 746' ' ' ARG . . . . . 0.568 ' NH1' ' O ' ' C' ' 741' ' ' GLU . 12.6 ttp180 -59.11 -42.57 90.84 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.016 -0.427 . . . . 77.46 111.582 174.152 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 747' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -64.68 -42.69 95.17 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.253 -0.579 . . . . 68.2 111.415 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 23.8 mt -63.41 -31.4 72.55 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.809 -0.756 . . . . 67.66 111.583 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 749' ' ' LEU . . . . . . . . . . . . . 77.5 mt -70.0 -36.55 75.22 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.834 0.679 . . . . 71.32 112.834 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 750' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -94.49 7.56 45.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 118.27 0.486 . . . . 102.2 112.012 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 751' ' ' LYS . . . . . . . . . . . . . 12.8 ttpp . . . . . 0 C--N 1.324 -0.522 0 C-N-CA 123.842 0.857 . . . . 75.15 111.986 -174.902 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' 8HO . . . . . 0.683 ' O4 ' ' O ' ' A' ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' HOH . . . . . 0.8 ' O ' ' O ' ' A' ' 417' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' HOH . . . . . 0.683 ' O ' ' O4 ' ' A' ' 501' ' ' 8HO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 603' ' ' HOH . . . . . 0.668 ' O ' ' O ' ' A' ' 383' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' HOH . . . . . 0.658 ' O ' ' OD2' ' A' ' 367' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 605' ' ' HOH . . . . . 0.513 ' O ' ' OD2' ' A' ' 427' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 606' ' ' HOH . . . . . 0.736 ' O ' ' NH2' ' A' ' 338' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' HOH . . . . . 0.616 ' O ' ' NH1' ' A' ' 320' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 610' ' ' HOH . . . . . 0.557 ' O ' ' NH2' ' A' ' 429' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 613' ' ' HOH . . . . . 0.447 ' O ' ' NZ ' ' A' ' 289' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 628' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 632' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 633' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 634' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 635' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 636' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 638' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 639' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 640' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 641' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 642' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 643' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 645' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 646' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 649' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 650' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 651' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 653' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 654' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 655' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 656' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 657' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 658' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 801' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 802' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' LYS . . . . . . . . . . . . . 18.1 mttt . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 110.969 -0.011 . . . . 70.6 110.969 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -59.65 134.15 55.9 Favored 'Trans proline' 0 C--O 1.236 0.41 0 O-C-N 122.715 0.85 . . . . 67.01 113.68 -172.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 213' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -105.75 170.48 5.82 Favored Pre-proline 0 C--O 1.249 1.072 0 C-N-CA 127.438 2.295 . . . . 81.87 109.942 178.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -60.67 137.38 72.95 Favored 'Trans proline' 0 C--O 1.233 0.232 0 CA-C-N 119.32 0.793 . . . . 51.42 112.678 -169.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 215' ' ' THR . . . . . 0.516 ' OG1' ' HG3' ' A' ' 218' ' ' GLU . 5.2 p -72.43 170.14 14.9 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.931 0.872 . . . . 75.14 109.344 166.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -63.23 -35.58 80.79 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.584 -0.846 . . . . 81.25 111.571 -175.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -72.15 -25.95 61.91 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 118.768 -1.173 . . . . 100.1 111.346 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 218' ' ' GLU . . . . . 0.516 ' HG3' ' OG1' ' A' ' 215' ' ' THR . 12.5 mt-10 -77.33 -29.61 53.61 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.56 -0.456 . . . . 64.96 111.995 178.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 219' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -63.22 -49.04 75.75 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.806 0.336 . . . . 48.92 110.755 172.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -50.63 -43.63 57.02 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.815 -0.354 . . . . 86.09 110.708 169.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.65 -47.47 78.36 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.118 0.485 . . . . 45.41 111.0 -179.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 222' ' ' ILE . . . . . . . . . . . . . 16.7 mt -60.74 -46.47 95.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-O 121.562 0.696 . . . . 47.76 110.761 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 223' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 227' ' ' GLU . 14.2 tttt -58.02 -44.99 87.6 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 122.043 -0.411 . . . . 73.33 111.584 178.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 224' ' ' THR . . . . . . . . . . . . . 53.3 m -66.42 -45.03 81.27 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.251 -0.58 . . . . 50.58 111.101 -174.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 225' ' ' VAL . . . . . 0.536 HG21 ' CE1' ' A' ' 399' ' ' PHE . 3.0 t -66.87 -41.38 87.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 CA-C-O 121.317 0.579 . . . . 54.69 110.403 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 226' ' ' THR . . . . . . . . . . . . . 59.7 m -60.24 -46.18 90.67 Favored 'General case' 0 CA--C 1.511 -0.527 0 C-N-CA 119.542 -0.863 . . . . 47.21 110.659 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 227' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 223' ' ' LYS . 86.4 mt-10 -65.34 -36.61 84.54 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.495 -0.482 . . . . 70.54 110.886 -177.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 228' ' ' ALA . . . . . . . . . . . . . . . -56.53 -40.01 74.35 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.582 -0.847 . . . . 39.82 111.019 173.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -73.06 -44.06 61.1 Favored 'General case' 0 C--O 1.238 0.447 0 N-CA-C 113.258 0.836 . . . . 42.0 113.258 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 230' ' ' VAL . . . . . . . . . . . . . 19.6 t -64.53 -40.72 90.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 119.833 -0.747 . . . . 47.03 109.914 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 231' ' ' ALA . . . . . . . . . . . . . . . -62.21 -16.35 52.7 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 113.61 0.967 . . . . 44.17 113.61 178.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 232' ' ' THR . . . . . . . . . . . . . 9.8 p -123.74 2.82 8.87 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 113.68 0.993 . . . . 33.86 113.68 -172.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 233' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -85.61 122.96 30.47 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.658 0.783 . . . . 67.43 109.052 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.74 133.11 52.93 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.585 0.587 . . . . 45.87 112.585 -168.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 235' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 644' ' ' HOH . 97.0 mm-40 53.28 24.65 3.9 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.357 -0.838 . . . . 79.8 111.755 -179.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 236' ' ' GLY . . . . . . . . . . . . . . . 32.44 -107.28 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 N-CA-C 116.543 1.377 . . . . 70.37 116.543 173.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 237' ' ' SER . . . . . . . . . . . . . 1.3 m -96.52 -13.91 22.68 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 113.413 0.894 . . . . 88.51 113.413 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HIS . . . . . . . . . . . . . 36.9 m170 -80.68 -3.64 51.39 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.112 0.782 . . . . 89.83 113.112 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 239' ' ' TRP . . . . . 0.616 ' O ' ' HB3' ' A' ' 243' ' ' ARG . 50.7 p-90 -56.73 -30.85 63.95 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 118.633 0.651 . . . . 75.36 112.708 -162.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 240' ' ' LYS . . . . . 0.454 ' HE2' ' HB2' ' A' ' 240' ' ' LYS . 7.4 ttpt -82.27 -6.86 59.53 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.297 0.499 . . . . 77.47 112.219 -179.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -103.0 -42.42 5.81 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.465 0.543 . . . . 102.74 112.465 174.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 242' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.24 -15.59 63.78 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.245 -0.582 . . . . 83.41 111.83 173.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 243' ' ' ARG . . . . . 0.616 ' HB3' ' O ' ' A' ' 239' ' ' TRP . 7.8 ptt180 -77.31 147.56 36.14 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 122.078 0.942 . . . . 64.06 111.945 -167.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 244' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -129.23 141.05 51.24 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 114.233 -1.349 . . . . 80.73 107.447 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 245' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -85.87 127.88 34.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.131 -0.486 . . . . 72.06 110.142 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 246' ' ' LEU . . . . . 0.643 ' HB3' HE22 ' A' ' 340' ' ' GLN . 0.0 OUTLIER -56.34 137.2 75.53 Favored Pre-proline 0 C--O 1.235 0.326 0 N-CA-C 109.394 -0.595 . . . . 70.37 109.394 173.657 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 247' ' ' PRO . . . . . 0.629 ' HD2' HD12 ' A' ' 250' ' ' ILE . 39.7 Cg_exo -61.31 -0.43 1.34 Allowed 'Trans proline' 0 C--N 1.354 0.866 0 N-CA-C 119.146 2.71 . . . . 109.34 119.146 -161.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 77.68 -21.17 0.34 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 120.124 1.329 . . . . 105.46 113.522 169.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 249' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.3 -31.97 68.07 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.636 -0.826 . . . . 100.05 110.102 160.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 250' ' ' ILE . . . . . 0.629 HD12 ' HD2' ' A' ' 247' ' ' PRO . 9.2 mt -77.38 136.0 25.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 109.199 -0.667 . . . . 87.19 109.199 177.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 251' ' ' GLY . . . . . . . . . . . . . . . 88.32 39.32 6.86 Favored Glycine 0 C--N 1.336 0.53 0 N-CA-C 115.421 0.928 . . . . 59.36 115.421 174.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 252' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -103.34 172.4 6.83 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.626 0.727 . . . . 99.23 109.953 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 253' ' ' ALA . . . . . . . . . . . . . . . -70.31 118.23 62.17 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.296 -0.866 . . . . 92.34 110.734 -172.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 254' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.23 155.41 60.84 Favored 'Trans proline' 0 C--N 1.331 -0.38 0 CA-C-N 119.326 0.795 . . . . 100.61 110.116 172.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 255' ' ' ILE . . . . . . . . . . . . . 1.4 mt . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.405 -0.816 . . . . 90.35 111.222 -174.155 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' LYS . . . . . 0.513 ' HG3' ' H ' ' A' ' 264' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.261 0 CA-C-O 121.312 0.577 . . . . 91.47 112.022 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 264' ' ' VAL . . . . . 0.513 ' H ' ' HG3' ' A' ' 263' ' ' LYS . 24.5 t -141.74 129.3 21.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 107.908 -1.145 . . . . 95.27 107.908 -174.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 265' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -68.38 131.83 46.0 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.607 -0.516 . . . . 93.85 109.607 169.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 266' ' ' LEU . . . . . . . . . . . . . 4.2 tp -86.28 -23.55 26.29 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 119.142 -1.023 . . . . 87.63 112.715 -175.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -74.71 -44.78 48.24 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.545 -0.862 . . . . 100.15 111.065 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 268' ' ' ALA . . . . . . . . . . . . . . . -54.97 -47.23 74.83 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.028 -0.669 . . . . 70.2 110.298 170.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 269' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -60.21 -37.15 79.39 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 116.255 -0.43 . . . . 61.36 111.346 -176.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 270' ' ' SER . . . . . . . . . . . . . 33.8 m -63.44 -34.22 77.27 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.158 -0.617 . . . . 69.05 111.909 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 271' ' ' HIS . . . . . . . . . . . . . 50.2 m80 -72.37 -36.89 68.84 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 120.264 -0.575 . . . . 64.07 111.723 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 272' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -72.3 -37.15 69.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.345 0.498 . . . . 63.38 112.345 -175.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 273' ' ' THR . . . . . . . . . . . . . 31.5 p -64.75 -23.87 67.38 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 119.814 -0.754 . . . . 51.14 111.859 169.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 274' ' ' LYS . . . . . . . . . . . . . 28.7 mmtm -73.14 -28.87 62.49 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.312 -0.555 . . . . 63.99 111.744 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 275' ' ' ILE . . . . . . . . . . . . . 24.7 pt -107.26 -8.55 10.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.631 0 CA-C-O 118.713 -0.66 . . . . 68.57 112.77 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 276' ' ' ILE . . . . . 0.427 HG12 ' CD1' ' A' ' 455' ' ' PHE . 4.9 tp -63.35 -38.75 82.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 C-N-CA 119.685 -0.806 . . . . 51.08 110.431 -178.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 277' ' ' THR . . . . . 0.431 ' N ' ' HD2' ' A' ' 278' ' ' PRO . 24.1 m -72.55 -45.88 9.82 Favored Pre-proline 0 C--O 1.252 1.216 0 C-N-CA 118.448 -1.301 . . . . 47.94 111.924 -170.687 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 278' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 277' ' ' THR . 41.2 Cg_endo -60.12 -24.25 76.23 Favored 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 122.12 1.793 . . . . 42.9 113.226 173.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 279' ' ' ALA . . . . . . . . . . . . . . . -79.61 -48.48 13.71 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 111.375 0.139 . . . . 53.96 111.375 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 280' ' ' ILE . . . . . . . . . . . . . 86.8 mt -51.22 -42.83 26.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.095 0.474 . . . . 43.08 110.046 169.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 281' ' ' THR . . . . . . . . . . . . . 2.6 m -60.74 -40.65 93.2 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.968 -0.457 . . . . 53.41 111.572 -174.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -61.54 -39.7 92.02 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.786 0.327 . . . . 67.99 111.498 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 71.2 t -60.88 -39.06 80.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 O-C-N 122.163 -0.336 . . . . 56.67 110.581 176.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 284' ' ' VAL . . . . . . . . . . . . . 67.7 t -66.04 -39.77 85.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 121.15 0.5 . . . . 35.96 110.337 176.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 285' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.99 -30.87 71.23 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 118.74 -1.184 . . . . 82.03 112.236 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 286' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -69.29 -48.41 61.72 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 121.976 -0.452 . . . . 43.44 111.537 -179.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -67.37 -31.88 72.42 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 120.399 -0.52 . . . . 36.56 111.508 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -73.76 -14.38 61.11 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.885 0.698 . . . . 47.75 112.885 -179.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -90.08 8.94 30.18 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 113.105 0.78 . . . . 40.25 113.105 172.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 290' ' ' LEU . . . . . . . . . . . . . 74.4 mt -108.69 114.84 58.37 Favored Pre-proline 0 C--O 1.243 0.726 0 N-CA-C 108.363 -0.977 . . . . 59.34 108.363 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 291' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.19 -28.21 60.33 Favored 'Trans proline' 0 C--O 1.24 0.609 0 CA-C-N 119.487 0.852 . . . . 51.11 112.729 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 45.2 mtt -65.76 -42.22 91.13 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.87 -0.332 . . . . 91.36 111.029 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 293' ' ' PHE . . . . . 0.516 ' CZ ' ' HB3' ' A' ' 301' ' ' GLN . 62.5 t80 -71.53 -36.09 70.89 Favored 'General case' 0 C--N 1.347 0.48 0 CA-C-O 120.576 0.227 . . . . 52.49 111.042 179.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 294' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.01 -23.11 63.08 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.842 1.053 . . . . 69.09 113.842 -171.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 295' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -89.58 9.33 27.18 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.301 0.955 . . . . 86.31 113.518 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 296' ' ' LEU . . . . . . . . . . . . . 36.0 mt -81.82 151.64 67.92 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 118.853 0.751 . . . . 50.11 110.557 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 297' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -58.86 149.84 75.62 Favored 'Trans proline' 0 C--N 1.324 -0.753 0 N-CA-C 110.154 -0.748 . . . . 55.62 110.154 171.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 298' ' ' CYS . . . . . . . . . . . . . 2.1 t -59.57 -37.87 79.62 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.795 -0.762 . . . . 115.49 111.175 -172.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -60.43 -39.26 86.83 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.062 -0.655 . . . . 94.05 111.65 179.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 300' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -68.02 -41.6 81.95 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.444 -0.502 . . . . 81.92 111.551 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' GLN . . . . . 0.516 ' HB3' ' CZ ' ' A' ' 293' ' ' PHE . 71.4 mt-30 -58.86 -37.1 75.75 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 120.675 0.274 . . . . 63.93 111.619 179.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 302' ' ' ILE . . . . . . . . . . . . . 31.0 mt -65.93 -48.82 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.103 0.477 . . . . 55.71 110.248 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' ILE . . . . . . . . . . . . . 3.0 mt -59.43 -47.92 88.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 C-N-CA 119.803 -0.759 . . . . 46.31 110.014 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 304' ' ' LEU . . . . . . . . . . . . . 7.4 mt -56.16 -32.33 64.2 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.164 0.431 . . . . 41.71 112.164 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 305' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 305' ' ' LEU . 1.2 tp -85.29 -36.36 20.91 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.557 0.577 . . . . 45.67 112.557 -171.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 306' ' ' LYS . . . . . 0.464 ' NZ ' ' OD1' ' C' ' 742' ' ' ASN . 3.8 mtpp -64.1 -26.61 68.62 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 121.098 -0.241 . . . . 59.96 111.593 171.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 307' ' ' GLY . . . . . 0.436 ' HA3' ' HD2' ' A' ' 383' ' ' ARG . . . -85.99 -24.06 42.8 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 115.638 1.015 . . . . 42.46 115.638 -173.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 308' ' ' CYS . . . . . . . . . . . . . 21.4 p -113.21 -7.43 13.58 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 113.247 0.832 . . . . 40.5 113.247 -174.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 309' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -62.02 -55.75 26.06 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 118.31 0.505 . . . . 83.26 112.167 -170.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 310' ' ' MET . . . . . . . . . . . . . 6.6 tpp -53.89 -49.32 68.82 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.6 -0.273 . . . . 90.02 110.885 173.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 311' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -51.94 -47.72 64.58 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.045 0.45 . . . . 76.11 112.113 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 312' ' ' ILE . . . . . . . . . . . . . 81.9 mt -73.46 -40.32 55.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 O-C-N 121.55 -0.719 . . . . 45.7 110.999 -172.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 313' ' ' MET . . . . . . . . . . . . . 27.0 mtm -61.99 -41.08 97.65 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.746 0.307 . . . . 64.14 111.302 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 314' ' ' SER . . . . . . . . . . . . . 67.0 m -59.52 -43.69 93.37 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.203 -0.599 . . . . 45.25 111.351 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 315' ' ' LEU . . . . . . . . . . . . . 54.4 tp -61.23 -50.8 71.59 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.858 0.361 . . . . 39.78 111.115 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 316' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -64.33 -30.93 71.97 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.708 0.633 . . . . 46.8 112.708 -178.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 317' ' ' ALA . . . . . . . . . . . . . . . -71.02 -35.38 72.0 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.125 -0.63 . . . . 43.4 111.215 174.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 318' ' ' ALA . . . . . 0.418 ' HA ' HD22 ' A' ' 328' ' ' LEU . . . -76.23 -29.12 57.44 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.362 0.875 . . . . 40.37 113.362 -176.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 319' ' ' VAL . . . . . . . . . . . . . 34.8 m -72.92 -8.43 11.52 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 C-N-CA 118.15 -1.42 . . . . 53.64 110.415 175.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 320' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -107.45 37.2 2.47 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 122.4 1.095 . . . . 54.65 111.011 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 321' ' ' TYR . . . . . 0.47 ' CE2' ' HG2' ' A' ' 358' ' ' MET . 19.4 t80 -77.6 137.28 38.48 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 114.675 -1.148 . . . . 58.64 109.661 171.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 322' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -123.76 101.74 36.01 Favored Pre-proline 0 C--O 1.246 0.898 0 N-CA-C 108.173 -1.047 . . . . 53.78 108.173 176.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 323' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -63.99 -29.57 66.53 Favored 'Trans proline' 0 N--CA 1.476 0.459 0 N-CA-C 114.788 1.034 . . . . 61.08 114.788 179.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 324' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.97 -22.78 64.8 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.459 1.027 . . . . 116.44 111.92 175.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 325' ' ' SER . . . . . . . . . . . . . 2.6 t -117.54 -22.18 8.24 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 114.415 1.265 . . . . 77.7 114.415 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 66.66 44.76 2.15 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.841 0.829 . . . . 104.11 110.077 -177.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 327' ' ' THR . . . . . . . . . . . . . 24.4 p -132.73 149.91 52.22 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.118 -0.946 . . . . 59.0 110.03 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 328' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' A' ' 318' ' ' ALA . 34.4 mt -103.75 153.78 20.31 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.541 -1.209 . . . . 50.19 107.882 162.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 84.8 m -113.38 122.55 47.69 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.025 -0.534 . . . . 61.43 109.573 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 35.4 mt -104.2 133.63 48.79 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.14 0.976 . . . . 59.78 109.38 -177.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 331' ' ' ASN . . . . . . . . . . . . . 1.8 m120 63.25 18.82 11.27 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.102 0.961 . . . . 64.81 113.282 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 332' ' ' GLY . . . . . . . . . . . . . . . 72.77 11.62 77.91 Favored Glycine 0 C--N 1.331 0.292 0 N-CA-C 116.643 1.417 . . . . 43.19 116.643 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 333' ' ' GLU . . . . . 0.506 ' HA ' ' HA ' ' A' ' 243' ' ' ARG . 26.0 pt-20 -149.77 -19.89 0.26 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.101 1.45 . . . . 106.88 114.906 -169.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 334' ' ' MET . . . . . . . . . . . . . 29.8 ttm -115.09 105.21 12.68 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.663 0.665 . . . . 63.09 110.171 -175.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 335' ' ' ALA . . . . . . . . . . . . . . . -81.57 129.52 34.71 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 109.38 -0.6 . . . . 48.79 109.38 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 49.2 t -133.45 135.99 55.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.263 -0.643 . . . . 47.13 109.263 -173.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 337' ' ' THR . . . . . . . . . . . . . 37.6 p -82.43 168.77 17.14 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-O 121.666 0.746 . . . . 43.4 110.305 177.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 338' ' ' ARG . . . . . 0.46 ' HD3' ' OD1' ' A' ' 351' ' ' ASP . 8.4 ttm105 -62.92 -36.07 82.17 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.686 -0.806 . . . . 96.34 111.351 -176.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 339' ' ' GLY . . . . . . . . . . . . . . . -72.19 -40.4 56.02 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 120.054 -1.07 . . . . 47.47 112.725 -176.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 340' ' ' GLN . . . . . 0.643 HE22 ' HB3' ' A' ' 246' ' ' LEU . 79.5 mt-30 -57.12 -49.92 74.4 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.884 0.342 . . . . 61.18 111.196 176.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 341' ' ' LEU . . . . . . . . . . . . . 34.6 tp -66.44 -35.6 80.69 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.409 -0.516 . . . . 46.08 111.648 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 342' ' ' LYS . . . . . . . . . . . . . 17.8 tttp -65.84 -46.61 77.9 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.348 -0.941 . . . . 68.04 110.66 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 343' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -78.51 -14.35 59.4 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 113.453 0.908 . . . . 64.45 113.453 -176.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 344' ' ' GLY . . . . . . . . . . . . . . . -76.63 -5.2 82.79 Favored Glycine 0 C--N 1.337 0.596 0 C-N-CA 120.444 -0.884 . . . . 49.41 114.56 173.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 345' ' ' GLY . . . . . . . . . . . . . . . 138.3 -20.54 3.16 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-O 119.084 -0.842 . . . . 48.9 114.629 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.98 -37.97 69.77 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 118.959 1.379 . . . . 52.79 112.591 -173.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 347' ' ' GLY . . . . . . . . . . . . . . . 69.11 -134.44 27.09 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 119.431 -1.366 . . . . 49.23 110.864 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 348' ' ' VAL . . . . . . . . . . . . . 5.5 p -63.06 -24.31 35.63 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 112.166 0.432 . . . . 47.89 112.166 -176.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 349' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.19 -27.59 43.05 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 O-C-N 121.601 -0.687 . . . . 42.71 110.154 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.4 t -60.15 -47.7 84.82 Favored 'General case' 0 C--O 1.239 0.51 0 O-C-N 121.817 -0.552 . . . . 44.9 112.352 171.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 351' ' ' ASP . . . . . 0.46 ' OD1' ' HD3' ' A' ' 338' ' ' ARG . 70.8 m-20 -62.63 -33.11 74.36 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.467 -0.893 . . . . 79.54 110.801 177.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 352' ' ' ALA . . . . . . . . . . . . . . . -63.76 -48.1 78.34 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.716 0.293 . . . . 39.85 111.382 177.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 353' ' ' ILE . . . . . . . . . . . . . 91.2 mt -68.66 -44.83 82.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.405 0.621 . . . . 39.28 110.751 -177.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 354' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.51 -27.97 69.63 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.6 -0.44 . . . . 46.01 111.785 177.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 355' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -70.4 -38.88 74.75 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 119.6 -0.84 . . . . 48.36 111.246 174.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 356' ' ' LEU . . . . . . . . . . . . . 8.5 tp -61.36 -48.02 83.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.808 -0.357 . . . . 42.17 110.832 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 357' ' ' GLY . . . . . . . . . . . . . . . -63.61 -39.86 98.04 Favored Glycine 0 C--N 1.338 0.676 0 C-N-CA 120.659 -0.781 . . . . 50.77 113.178 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 358' ' ' MET . . . . . 0.546 ' SD ' ' O ' ' A' ' 606' ' ' HOH . 29.7 mtp -62.81 -39.88 95.66 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.568 -0.853 . . . . 66.81 111.316 174.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 359' ' ' SER . . . . . . . . . . . . . 60.6 p -82.26 -17.88 44.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.377 -0.929 . . . . 69.68 112.936 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 10.7 mt -77.97 -15.98 58.52 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.176 0.806 . . . . 66.23 113.176 179.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 8.8 t -71.69 -12.91 61.56 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 118.99 -1.084 . . . . 105.58 112.96 -174.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 362' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.59 -19.72 32.58 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 118.568 0.622 . . . . 78.17 111.834 171.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 363' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -85.51 -23.58 27.68 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.469 0.707 . . . . 65.14 112.86 -174.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 364' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 56.34 47.81 18.32 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.449 0.7 . . . . 72.29 111.228 170.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 365' ' ' LEU . . . . . . . . . . . . . 23.1 mt -69.87 133.58 47.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.958 -0.565 . . . . 52.2 110.556 -178.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 366' ' ' ASP . . . . . . . . . . . . . 30.1 p30 -94.57 -178.07 4.43 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.76 0.791 . . . . 63.24 110.289 173.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 367' ' ' ASP . . . . . 0.658 ' OD2' ' O ' ' A' ' 604' ' ' HOH . 60.3 m-20 -55.84 -39.99 72.21 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.001 -1.0 . . . . 87.74 112.262 -175.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 368' ' ' THR . . . . . . . . . . . . . 1.8 p -74.99 -35.4 62.03 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 116.822 -1.951 . . . . 58.83 111.521 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -65.88 -40.1 91.29 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 120.625 0.25 . . . . 54.35 111.328 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 370' ' ' VAL . . . . . . . . . . . . . 53.7 t -65.71 -35.26 74.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 C-N-CA 119.557 -0.857 . . . . 40.38 109.724 174.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 371' ' ' ALA . . . . . . . . . . . . . . . -70.17 -42.15 72.85 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 120.659 -0.416 . . . . 32.55 110.791 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 47.4 mt -69.47 -37.11 77.13 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 118.967 -1.093 . . . . 39.61 111.248 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 373' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 373' ' ' LEU . 8.6 mt -50.15 -56.46 10.9 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 121.331 0.586 . . . . 40.27 111.021 168.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 374' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -55.46 -33.55 63.73 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.219 -0.446 . . . . 43.4 112.169 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 375' ' ' ALA . . . . . . . . . . . . . . . -72.23 -38.52 68.93 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 119.86 -0.736 . . . . 42.46 111.54 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 376' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.23 -36.84 78.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 C-N-CA 119.752 -0.779 . . . . 53.86 110.883 179.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 15.7 mt -73.31 -36.85 66.32 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 121.92 -0.488 . . . . 39.4 111.826 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 378' ' ' LEU . . . . . . . . . . . . . 62.3 tp -64.09 -44.91 90.89 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 121.917 -0.489 . . . . 37.13 111.278 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 379' ' ' MET . . . . . . . . . . . . . 22.8 mmt -89.03 71.71 8.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.313 1.054 . . . . 70.34 110.585 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 380' ' ' SER . . . . . 0.797 ' OG ' ' NH1' ' A' ' 429' ' ' ARG . 16.0 m -111.62 101.7 10.07 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 107.74 -1.207 . . . . 54.51 107.74 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 381' ' ' SER . . . . . 0.61 ' HB2' HG13 ' A' ' 389' ' ' VAL . 6.8 p -63.33 -5.01 3.0 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.618 -0.433 . . . . 66.97 112.096 170.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 382' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.48 -34.99 79.16 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 112.328 0.492 . . . . 95.77 112.328 -179.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 383' ' ' ARG . . . . . 0.668 ' O ' ' O ' ' A' ' 603' ' ' HOH . 10.5 mmt85 -61.24 144.08 91.89 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 117.979 0.354 . . . . 90.5 111.221 -168.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 384' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -78.7 140.18 16.38 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 120.209 0.606 . . . . 62.91 112.274 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 99.86 8.68 50.96 Favored Glycine 0 C--N 1.335 0.501 0 N-CA-C 116.284 1.273 . . . . 54.23 116.284 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 63.3 mt -81.41 130.41 35.03 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 118.708 1.254 . . . . 72.51 111.842 -172.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 387' ' ' ALA . . . . . . . . . . . . . . . -80.74 -35.25 33.62 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.182 -0.463 . . . . 71.8 112.151 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 388' ' ' CYS . . . . . . . . . . . . . 80.1 m -107.56 41.84 1.44 Allowed 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 123.087 0.555 . . . . 104.01 111.599 -172.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 389' ' ' VAL . . . . . 0.61 HG13 ' HB2' ' A' ' 381' ' ' SER . 78.8 t -46.86 -47.09 8.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.777 -0.647 . . . . 59.3 111.102 -177.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 390' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -66.19 -44.92 82.59 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.07 -0.652 . . . . 108.81 111.184 -176.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 391' ' ' ARG . . . . . . . . . . . . . 23.0 ttm180 -58.64 -44.54 90.08 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 119.845 -0.742 . . . . 94.68 110.256 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 392' ' ' ILE . . . . . . . . . . . . . 4.3 mt -61.61 -37.09 77.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-O 120.869 0.366 . . . . 61.25 110.566 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 393' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -67.61 -29.01 68.24 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.045 -1.062 . . . . 100.09 112.129 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 394' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.85 -44.42 63.86 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 118.229 -1.388 . . . . 70.76 111.493 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 395' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -56.96 -44.82 82.97 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 120.591 -0.444 . . . . 71.8 111.756 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 396' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -63.65 -32.17 73.57 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.213 -0.595 . . . . 52.68 111.928 -178.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.38 -35.24 68.42 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.666 -0.813 . . . . 108.0 111.127 178.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 398' ' ' SER . . . . . . . . . . . . . 3.1 m -54.98 -48.84 72.75 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.122 0.487 . . . . 62.02 110.842 169.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 399' ' ' PHE . . . . . 0.536 ' CE1' HG21 ' A' ' 225' ' ' VAL . 44.1 m-85 -66.49 -46.42 76.35 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.4 -0.52 . . . . 47.23 111.032 178.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 4.4 mt -57.69 -46.23 84.6 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.807 -0.357 . . . . 53.18 111.421 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 401' ' ' LEU . . . . . 0.502 HD22 ' CE1' ' A' ' 405' ' ' HIS . 3.1 mt -60.36 -54.56 44.15 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 120.874 0.369 . . . . 54.99 111.6 175.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 402' ' ' ALA . . . . . . . . . . . . . . . -58.1 -31.73 67.41 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 111.875 0.324 . . . . 42.66 111.875 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 403' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -69.51 -46.13 67.26 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 120.883 0.373 . . . . 55.02 111.078 179.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 404' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -61.0 -55.78 28.9 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.991 -0.684 . . . . 75.37 110.424 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HIS . . . . . 0.502 ' CE1' HD22 ' A' ' 401' ' ' LEU . 44.0 m170 -49.57 -38.0 29.55 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.64 -0.424 . . . . 63.29 111.41 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 406' ' ' TYR . . . . . 0.404 ' CE2' ' HG3' ' A' ' 410' ' ' ARG . 48.8 t80 -67.88 -37.8 82.23 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 119.474 -0.891 . . . . 51.77 111.224 174.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 407' ' ' ILE . . . . . . . . . . . . . 1.4 mm -63.98 -42.0 94.31 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 C-N-CA 119.776 -0.77 . . . . 60.65 110.261 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 408' ' ' ASN . . . . . 0.658 ' O ' ' HD3' ' A' ' 411' ' ' LYS . 99.1 m-20 -55.56 -60.45 3.41 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.436 -0.506 . . . . 67.22 110.736 176.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 409' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -55.15 -39.06 69.06 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.589 -0.444 . . . . 73.48 111.721 -179.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 410' ' ' ARG . . . . . 0.404 ' HG3' ' CE2' ' A' ' 406' ' ' TYR . 3.6 mmm180 -68.05 -21.47 65.0 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 113.32 0.859 . . . . 81.92 113.32 -176.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 411' ' ' LYS . . . . . 0.658 ' HD3' ' O ' ' A' ' 408' ' ' ASN . 0.6 OUTLIER 48.15 60.61 3.49 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 122.112 0.958 . . . . 72.77 111.029 171.464 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 412' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -63.25 146.82 52.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.138 -0.937 . . . . 76.18 109.949 170.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 413' ' ' HIS . . . . . . . . . . . . . 15.2 m80 -94.47 47.78 1.19 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.539 -0.755 . . . . 102.47 111.684 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 414' ' ' VAL . . . . . 0.532 ' HB ' ' HD1' ' A' ' 417' ' ' PHE . 39.3 t . . . . . 0 C--O 1.238 0.459 0 O-C-N 121.987 -0.446 . . . . 69.7 109.812 -176.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HIS . . . . . 0.689 ' N ' ' HZ1' ' A' ' 420' ' ' LYS . . . . . . . . 0 CA--C 1.54 0.56 0 N-CA-C 113.322 0.86 . . . . 72.26 113.322 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 417' ' ' PHE . . . . . 0.8 ' O ' ' O ' ' A' ' 601' ' ' HOH . 1.0 OUTLIER -55.28 141.23 36.42 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.149 -0.478 . . . . 82.28 110.09 175.615 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 418' ' ' TRP . . . . . 0.53 ' HB3' ' HD3' ' A' ' 419' ' ' PRO . 75.5 t-105 110.04 -58.45 0.0 OUTLIER Pre-proline 0 C--O 1.237 0.41 0 C-N-CA 129.646 3.178 . . . . 60.42 109.995 171.107 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 419' ' ' PRO . . . . . 0.53 ' HD3' ' HB3' ' A' ' 418' ' ' TRP . 74.9 Cg_exo -54.74 -42.17 71.07 Favored 'Trans proline' 0 CA--C 1.513 -0.573 0 CA-C-N 120.711 1.29 . . . . 62.2 112.25 165.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 420' ' ' LYS . . . . . 0.689 ' HZ1' ' N ' ' A' ' 416' ' ' HIS . 11.6 mttp -64.39 -42.96 95.84 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.805 0.336 . . . . 69.16 111.259 176.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 2.9 mt -62.15 -40.29 95.47 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 119.715 -0.794 . . . . 60.46 111.339 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 33.2 mt -61.18 -32.58 72.33 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.614 -0.434 . . . . 55.57 112.004 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 7.2 mtt -67.57 -31.96 72.4 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 120.182 -0.607 . . . . 64.72 111.581 174.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 424' ' ' LYS . . . . . . . . . . . . . 27.5 mmtm -69.64 -31.6 69.79 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.224 -0.59 . . . . 54.6 111.649 176.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 425' ' ' VAL . . . . . 0.564 ' O ' ' HG3' ' A' ' 429' ' ' ARG . 30.8 t -60.51 -48.31 89.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 CA-C-O 120.946 0.403 . . . . 49.96 109.929 174.02 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 426' ' ' THR . . . . . . . . . . . . . 27.8 m -55.1 -46.22 75.5 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.499 -0.319 . . . . 56.24 110.773 173.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 427' ' ' ASP . . . . . 0.513 ' OD2' ' O ' ' A' ' 605' ' ' HOH . 81.3 m-20 -50.79 -46.49 59.66 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.221 0.534 . . . . 81.25 111.213 177.325 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 428' ' ' LEU . . . . . . . . . . . . . 16.3 mt -66.55 -41.87 87.99 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 119.816 -0.754 . . . . 38.38 112.63 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 429' ' ' ARG . . . . . 0.797 ' NH1' ' OG ' ' A' ' 380' ' ' SER . 2.1 mtp180 -59.87 -44.06 94.38 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.195 -1.002 . . . . 79.48 111.251 -179.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 430' ' ' MET . . . . . . . . . . . . . 50.4 mmm -52.16 -52.18 53.47 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 111.542 0.201 . . . . 46.69 111.542 168.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 431' ' ' ILE . . . . . . . . . . . . . 36.5 mt -49.89 -41.58 17.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 O-C-N 121.945 -0.472 . . . . 43.58 110.528 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 432' ' ' GLY . . . . . . . . . . . . . . . -70.7 -39.0 67.04 Favored Glycine 0 C--N 1.341 0.836 0 N-CA-C 114.785 0.674 . . . . 45.35 114.785 178.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 433' ' ' ALA . . . . . . . . . . . . . . . -67.57 -0.29 3.75 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 114.008 1.114 . . . . 59.58 114.008 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 434' ' ' CYS . . . . . . . . . . . . . 79.6 m -97.45 23.76 7.29 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.071 0.549 . . . . 101.03 112.076 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 47.4 m170 -51.66 -48.84 63.27 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.224 0.535 . . . . 97.8 110.255 171.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 436' ' ' ALA . . . . . . . . . . . . . . . -76.82 -35.42 57.58 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.239 -0.985 . . . . 80.1 112.483 -175.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 437' ' ' SER . . . . . . . . . . . . . 10.5 t -86.8 60.52 6.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 123.394 1.569 . . . . 105.93 110.012 174.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 438' ' ' TRP . . . . . 0.567 ' O ' ' HE3' ' A' ' 438' ' ' TRP . 0.0 OUTLIER -172.25 -59.65 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.888 1 N-CA-C 99.728 -4.175 . . . . 89.89 99.728 -178.577 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 439' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 438' ' ' TRP . 19.9 m-85 . . . . . 0 N--CA 1.485 1.297 0 C-N-CA 126.53 1.932 . . . . 75.99 108.65 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 3.3 m . . . . . 0 C--O 1.224 -0.27 0 N-CA-C 110.056 -0.35 . . . . 101.92 110.056 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 447' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.31 152.34 12.21 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 CA-C-O 122.756 1.065 . . . . 100.51 113.318 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 448' ' ' THR . . . . . . . . . . . . . 2.4 m -55.02 -33.48 62.67 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 114.072 -1.422 . . . . 74.11 113.542 -170.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 449' ' ' GLU . . . . . 0.403 ' H ' ' HG3' ' A' ' 449' ' ' GLU . 1.4 mt-10 -56.96 -19.93 20.83 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 113.321 0.86 . . . . 98.91 113.321 168.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 450' ' ' LEU . . . . . . . . . . . . . 1.1 mt -75.49 -20.95 58.43 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 118.17 -1.412 . . . . 75.93 112.794 -179.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 451' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 452' ' ' PRO . 64.7 m-85 -85.42 136.74 37.19 Favored Pre-proline 0 C--O 1.24 0.597 0 CA-C-N 117.893 0.315 . . . . 52.91 110.535 175.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 452' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 451' ' ' PHE . 19.1 Cg_exo -55.93 140.76 86.19 Favored 'Trans proline' 0 C--O 1.249 1.036 0 O-C-N 124.744 1.918 . . . . 56.63 110.412 171.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -64.88 -31.04 57.65 Favored 'Trans proline' 0 C--O 1.242 0.698 0 N-CA-C 113.723 0.624 . . . . 69.97 113.723 -173.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 43.3 tp -67.3 -38.17 84.56 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 118.825 -1.15 . . . . 52.28 110.838 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 455' ' ' PHE . . . . . 0.427 ' CD1' HG12 ' A' ' 276' ' ' ILE . 73.4 t80 -59.87 -46.04 90.55 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 119.345 -0.942 . . . . 75.01 111.782 170.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 456' ' ' LEU . . . . . . . . . . . . . 75.0 mt -57.91 -26.08 61.71 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 117.768 -1.573 . . . . 70.17 112.07 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -79.4 -20.73 46.89 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.611 -0.835 . . . . 86.02 113.051 -172.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 458' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.76 15.94 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 118.624 0.647 . . . . 72.1 111.222 -175.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 459' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 114.163 1.171 . . . . 86.39 114.163 -179.402 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 741' ' ' GLU . . . . . 0.568 ' O ' ' NH1' ' C' ' 746' ' ' ARG . . . . . . . . 0 C--O 1.238 0.465 0 N-CA-C 110.091 -0.337 . . . . 74.06 110.091 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 742' ' ' ASN . . . . . 0.464 ' OD1' ' NZ ' ' A' ' 306' ' ' LYS . 19.6 m-80 60.23 44.31 12.82 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.778 0.799 . . . . 68.29 111.91 170.923 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 743' ' ' ALA . . . . . . . . . . . . . . . -68.73 -29.86 68.36 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.266 0.839 . . . . 63.84 113.266 -170.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 744' ' ' LEU . . . . . . . . . . . . . 22.0 tp -89.15 -40.35 12.96 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 113.651 0.982 . . . . 60.65 113.651 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 745' ' ' LEU . . . . . . . . . . . . . 14.7 tp -55.6 -41.92 74.1 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.005 0.431 . . . . 52.47 111.23 171.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 746' ' ' ARG . . . . . 0.568 ' NH1' ' O ' ' C' ' 741' ' ' GLU . 12.6 ttp180 -59.11 -42.57 90.84 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.016 -0.427 . . . . 77.46 111.582 174.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 747' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -64.68 -42.69 95.17 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.253 -0.579 . . . . 68.2 111.415 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 23.8 mt -63.41 -31.4 72.55 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.809 -0.756 . . . . 67.66 111.583 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 749' ' ' LEU . . . . . . . . . . . . . 77.5 mt -70.0 -36.55 75.22 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.834 0.679 . . . . 71.32 112.834 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 750' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -94.49 7.56 45.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 118.27 0.486 . . . . 102.2 112.012 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 751' ' ' LYS . . . . . . . . . . . . . 12.8 ttpp . . . . . 0 C--N 1.324 -0.522 0 C-N-CA 123.842 0.857 . . . . 75.15 111.986 -174.902 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' 8HO . . . . . 0.683 ' O4 ' ' O ' ' A' ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 601' ' ' HOH . . . . . 0.8 ' O ' ' O ' ' A' ' 417' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 602' ' ' HOH . . . . . 0.683 ' O ' ' O4 ' ' A' ' 501' ' ' 8HO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 603' ' ' HOH . . . . . 0.668 ' O ' ' O ' ' A' ' 383' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 604' ' ' HOH . . . . . 0.658 ' O ' ' OD2' ' A' ' 367' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 605' ' ' HOH . . . . . 0.513 ' O ' ' OD2' ' A' ' 427' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 606' ' ' HOH . . . . . 0.546 ' O ' ' SD ' ' A' ' 358' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 610' ' ' HOH . . . . . 0.557 ' O ' ' NH2' ' A' ' 429' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 628' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 632' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 633' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 634' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 635' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 636' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 638' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 639' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 640' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 641' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 642' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 643' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 644' ' ' HOH . . . . . 0.456 ' O ' ' HG2' ' A' ' 235' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 645' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 646' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 649' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 650' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 651' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 653' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 654' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 655' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 656' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 657' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 658' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 801' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 802' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' LYS . . . . . . . . . . . . . 18.1 mttt . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 110.969 -0.011 . . . . 70.6 110.969 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -59.65 134.15 55.9 Favored 'Trans proline' 0 C--O 1.236 0.41 0 O-C-N 122.715 0.85 . . . . 67.01 113.68 -172.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -105.75 170.48 5.82 Favored Pre-proline 0 C--O 1.249 1.072 0 C-N-CA 127.438 2.295 . . . . 81.87 109.942 178.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -60.67 137.38 72.95 Favored 'Trans proline' 0 C--O 1.233 0.232 0 CA-C-N 119.32 0.793 . . . . 51.42 112.678 -169.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' THR . . . . . 0.516 ' OG1' ' HG3' ' A' ' 218' ' ' GLU . 5.2 p -72.43 170.14 14.9 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.931 0.872 . . . . 75.14 109.344 166.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -63.23 -35.58 80.79 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.584 -0.846 . . . . 81.25 111.571 -175.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -72.15 -25.95 61.91 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 118.768 -1.173 . . . . 100.1 111.346 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' GLU . . . . . 0.516 ' HG3' ' OG1' ' A' ' 215' ' ' THR . 12.5 mt-10 -77.33 -29.61 53.61 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.56 -0.456 . . . . 64.96 111.995 178.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -63.22 -49.04 75.75 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.806 0.336 . . . . 48.92 110.755 172.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -50.63 -43.63 57.02 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.815 -0.354 . . . . 86.09 110.708 169.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.65 -47.47 78.36 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.118 0.485 . . . . 45.41 111.0 -179.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' ILE . . . . . . . . . . . . . 16.7 mt -60.74 -46.47 95.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-O 121.562 0.696 . . . . 47.76 110.761 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 227' ' ' GLU . 14.2 tttt -58.02 -44.99 87.6 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 122.043 -0.411 . . . . 73.33 111.584 178.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' THR . . . . . . . . . . . . . 53.3 m -66.42 -45.03 81.27 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.251 -0.58 . . . . 50.58 111.101 -174.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' VAL . . . . . 0.536 HG21 ' CE1' ' A' ' 399' ' ' PHE . 3.0 t -66.87 -41.38 87.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 CA-C-O 121.317 0.579 . . . . 54.69 110.403 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' THR . . . . . . . . . . . . . 59.7 m -60.24 -46.18 90.67 Favored 'General case' 0 CA--C 1.511 -0.527 0 C-N-CA 119.542 -0.863 . . . . 47.21 110.659 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 223' ' ' LYS . 86.4 mt-10 -65.34 -36.61 84.54 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.495 -0.482 . . . . 70.54 110.886 -177.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' ALA . . . . . . . . . . . . . . . -56.53 -40.01 74.35 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.582 -0.847 . . . . 39.82 111.019 173.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -73.06 -44.06 61.1 Favored 'General case' 0 C--O 1.238 0.447 0 N-CA-C 113.258 0.836 . . . . 42.0 113.258 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' VAL . . . . . . . . . . . . . 19.6 t -64.53 -40.72 90.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 119.833 -0.747 . . . . 47.03 109.914 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' ALA . . . . . . . . . . . . . . . -62.21 -16.35 52.7 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 113.61 0.967 . . . . 44.17 113.61 178.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' THR . . . . . . . . . . . . . 9.8 p -123.74 2.82 8.87 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 113.68 0.993 . . . . 33.86 113.68 -172.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -85.61 122.96 30.47 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.658 0.783 . . . . 67.43 109.052 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.74 133.11 52.93 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.585 0.587 . . . . 45.87 112.585 -168.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 644' ' ' HOH . 97.0 mm-40 53.28 24.65 3.9 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.357 -0.838 . . . . 79.8 111.755 -179.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' GLY . . . . . . . . . . . . . . . 32.44 -107.28 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 N-CA-C 116.543 1.377 . . . . 70.37 116.543 173.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' SER . . . . . . . . . . . . . 1.3 m -96.52 -13.91 22.68 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 113.413 0.894 . . . . 88.51 113.413 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HIS . . . . . . . . . . . . . 36.9 m170 -80.68 -3.64 51.39 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.112 0.782 . . . . 89.83 113.112 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' TRP . . . . . 0.616 ' O ' ' HB3' ' A' ' 243' ' ' ARG . 50.7 p-90 -56.73 -30.85 63.95 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 118.633 0.651 . . . . 75.36 112.708 -162.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' LYS . . . . . 0.454 ' HE2' ' HB2' ' A' ' 240' ' ' LYS . 7.4 ttpt -82.27 -6.86 59.53 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 118.297 0.499 . . . . 77.47 112.219 -179.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -103.0 -42.42 5.81 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.465 0.543 . . . . 102.74 112.465 174.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.24 -15.59 63.78 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.245 -0.582 . . . . 83.41 111.83 173.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' ARG . . . . . 0.616 ' HB3' ' O ' ' A' ' 239' ' ' TRP . 7.8 ptt180 -77.31 147.56 36.14 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 122.078 0.942 . . . . 64.06 111.945 -167.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -129.23 141.05 51.24 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 114.233 -1.349 . . . . 80.73 107.447 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -85.87 127.88 34.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.131 -0.486 . . . . 72.06 110.142 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' LEU . . . . . 0.643 ' HB3' HE22 ' A' ' 340' ' ' GLN . 0.0 OUTLIER -56.34 137.2 75.53 Favored Pre-proline 0 C--O 1.235 0.326 0 N-CA-C 109.394 -0.595 . . . . 70.37 109.394 173.657 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' PRO . . . . . 0.629 ' HD2' HD12 ' A' ' 250' ' ' ILE . 39.7 Cg_exo -61.31 -0.43 1.34 Allowed 'Trans proline' 0 C--N 1.354 0.866 0 N-CA-C 119.146 2.71 . . . . 109.34 119.146 -161.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 77.68 -21.17 0.34 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 120.124 1.329 . . . . 105.46 113.522 169.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.3 -31.97 68.07 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.636 -0.826 . . . . 100.05 110.102 160.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' ILE . . . . . 0.629 HD12 ' HD2' ' A' ' 247' ' ' PRO . 9.2 mt -77.38 136.0 25.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 109.199 -0.667 . . . . 87.19 109.199 177.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' GLY . . . . . . . . . . . . . . . 88.32 39.32 6.86 Favored Glycine 0 C--N 1.336 0.53 0 N-CA-C 115.421 0.928 . . . . 59.36 115.421 174.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -103.34 172.4 6.83 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.626 0.727 . . . . 99.23 109.953 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' ALA . . . . . . . . . . . . . . . -70.31 118.23 62.17 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.296 -0.866 . . . . 92.34 110.734 -172.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.23 155.41 60.84 Favored 'Trans proline' 0 C--N 1.331 -0.38 0 CA-C-N 119.326 0.795 . . . . 100.61 110.116 172.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' ILE . . . . . . . . . . . . . 1.4 mt . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.405 -0.816 . . . . 90.35 111.222 -174.155 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.513 ' HG3' ' H ' ' A' ' 264' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.261 0 CA-C-O 121.312 0.577 . . . . 91.47 112.022 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' VAL . . . . . 0.513 ' H ' ' HG3' ' A' ' 263' ' ' LYS . 24.5 t -141.74 129.3 21.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 107.908 -1.145 . . . . 95.27 107.908 -174.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -68.38 131.83 46.0 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.607 -0.516 . . . . 93.85 109.607 169.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' LEU . . . . . . . . . . . . . 4.2 tp -86.28 -23.55 26.29 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 119.142 -1.023 . . . . 87.63 112.715 -175.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -74.71 -44.78 48.24 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.545 -0.862 . . . . 100.15 111.065 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 268' ' ' ALA . . . . . . . . . . . . . . . -54.97 -47.23 74.83 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.028 -0.669 . . . . 70.2 110.298 170.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -60.21 -37.15 79.39 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 116.255 -0.43 . . . . 61.36 111.346 -176.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' SER . . . . . . . . . . . . . 33.8 m -63.44 -34.22 77.27 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.158 -0.617 . . . . 69.05 111.909 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' HIS . . . . . . . . . . . . . 50.2 m80 -72.37 -36.89 68.84 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 120.264 -0.575 . . . . 64.07 111.723 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -72.3 -37.15 69.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.345 0.498 . . . . 63.38 112.345 -175.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 273' ' ' THR . . . . . . . . . . . . . 31.5 p -64.75 -23.87 67.38 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 119.814 -0.754 . . . . 51.14 111.859 169.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 274' ' ' LYS . . . . . . . . . . . . . 28.7 mmtm -73.14 -28.87 62.49 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.312 -0.555 . . . . 63.99 111.744 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 275' ' ' ILE . . . . . . . . . . . . . 24.7 pt -107.26 -8.55 10.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.631 0 CA-C-O 118.713 -0.66 . . . . 68.57 112.77 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 276' ' ' ILE . . . . . 0.427 HG12 ' CD1' ' A' ' 455' ' ' PHE . 4.9 tp -63.35 -38.75 82.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 C-N-CA 119.685 -0.806 . . . . 51.08 110.431 -178.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 277' ' ' THR . . . . . 0.431 ' N ' ' HD2' ' A' ' 278' ' ' PRO . 24.1 m -72.55 -45.88 9.82 Favored Pre-proline 0 C--O 1.252 1.216 0 C-N-CA 118.448 -1.301 . . . . 47.94 111.924 -170.687 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 277' ' ' THR . 41.2 Cg_endo -60.12 -24.25 76.23 Favored 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 122.12 1.793 . . . . 42.9 113.226 173.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' ALA . . . . . . . . . . . . . . . -79.61 -48.48 13.71 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 111.375 0.139 . . . . 53.96 111.375 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 280' ' ' ILE . . . . . . . . . . . . . 86.8 mt -51.22 -42.83 26.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.095 0.474 . . . . 43.08 110.046 169.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 281' ' ' THR . . . . . . . . . . . . . 2.6 m -60.74 -40.65 93.2 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.968 -0.457 . . . . 53.41 111.572 -174.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 282' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -61.54 -39.7 92.02 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.786 0.327 . . . . 67.99 111.498 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 283' ' ' VAL . . . . . . . . . . . . . 71.2 t -60.88 -39.06 80.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 O-C-N 122.163 -0.336 . . . . 56.67 110.581 176.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 284' ' ' VAL . . . . . . . . . . . . . 67.7 t -66.04 -39.77 85.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 121.15 0.5 . . . . 35.96 110.337 176.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 285' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -61.99 -30.87 71.23 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 118.74 -1.184 . . . . 82.03 112.236 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 286' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -69.29 -48.41 61.72 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 121.976 -0.452 . . . . 43.44 111.537 -179.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -67.37 -31.88 72.42 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 120.399 -0.52 . . . . 36.56 111.508 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -73.76 -14.38 61.11 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.885 0.698 . . . . 47.75 112.885 -179.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 289' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -90.08 8.94 30.18 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 113.105 0.78 . . . . 40.25 113.105 172.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 290' ' ' LEU . . . . . . . . . . . . . 74.4 mt -108.69 114.84 58.37 Favored Pre-proline 0 C--O 1.243 0.726 0 N-CA-C 108.363 -0.977 . . . . 59.34 108.363 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 291' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.19 -28.21 60.33 Favored 'Trans proline' 0 C--O 1.24 0.609 0 CA-C-N 119.487 0.852 . . . . 51.11 112.729 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 45.2 mtt -65.76 -42.22 91.13 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.87 -0.332 . . . . 91.36 111.029 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 293' ' ' PHE . . . . . 0.516 ' CZ ' ' HB3' ' A' ' 301' ' ' GLN . 62.5 t80 -71.53 -36.09 70.89 Favored 'General case' 0 C--N 1.347 0.48 0 CA-C-O 120.576 0.227 . . . . 52.49 111.042 179.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 294' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.01 -23.11 63.08 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.842 1.053 . . . . 69.09 113.842 -171.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 295' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -89.58 9.33 27.18 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.301 0.955 . . . . 86.31 113.518 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 296' ' ' LEU . . . . . . . . . . . . . 36.0 mt -81.82 151.64 67.92 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 118.853 0.751 . . . . 50.11 110.557 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 297' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -58.86 149.84 75.62 Favored 'Trans proline' 0 C--N 1.324 -0.753 0 N-CA-C 110.154 -0.748 . . . . 55.62 110.154 171.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 298' ' ' CYS . . . . . . . . . . . . . 2.1 t -59.57 -37.87 79.62 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.795 -0.762 . . . . 115.49 111.175 -172.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 299' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -60.43 -39.26 86.83 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.062 -0.655 . . . . 94.05 111.65 179.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -68.02 -41.6 81.95 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.444 -0.502 . . . . 81.92 111.551 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' GLN . . . . . 0.516 ' HB3' ' CZ ' ' A' ' 293' ' ' PHE . 71.4 mt-30 -58.86 -37.1 75.75 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 120.675 0.274 . . . . 63.93 111.619 179.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' ILE . . . . . . . . . . . . . 31.0 mt -65.93 -48.82 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.103 0.477 . . . . 55.71 110.248 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' ILE . . . . . . . . . . . . . 3.0 mt -59.43 -47.92 88.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 C-N-CA 119.803 -0.759 . . . . 46.31 110.014 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' LEU . . . . . . . . . . . . . 7.4 mt -56.16 -32.33 64.2 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.164 0.431 . . . . 41.71 112.164 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 305' ' ' LEU . 1.2 tp -85.29 -36.36 20.91 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.557 0.577 . . . . 45.67 112.557 -171.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' LYS . . . . . 0.464 ' NZ ' ' OD1' ' C' ' 742' ' ' ASN . 3.8 mtpp -64.1 -26.61 68.62 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 121.098 -0.241 . . . . 59.96 111.593 171.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' GLY . . . . . 0.436 ' HA3' ' HD2' ' A' ' 383' ' ' ARG . . . -85.99 -24.06 42.8 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 115.638 1.015 . . . . 42.46 115.638 -173.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' CYS . . . . . . . . . . . . . 21.4 p -113.21 -7.43 13.58 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 113.247 0.832 . . . . 40.5 113.247 -174.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -62.02 -55.75 26.06 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 118.31 0.505 . . . . 83.26 112.167 -170.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' MET . . . . . . . . . . . . . 6.6 tpp -53.89 -49.32 68.82 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.6 -0.273 . . . . 90.02 110.885 173.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -51.94 -47.72 64.58 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.045 0.45 . . . . 76.11 112.113 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' ILE . . . . . . . . . . . . . 81.9 mt -73.46 -40.32 55.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 O-C-N 121.55 -0.719 . . . . 45.7 110.999 -172.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' MET . . . . . . . . . . . . . 27.0 mtm -61.99 -41.08 97.65 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.746 0.307 . . . . 64.14 111.302 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' SER . . . . . . . . . . . . . 67.0 m -59.52 -43.69 93.37 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.203 -0.599 . . . . 45.25 111.351 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' LEU . . . . . . . . . . . . . 54.4 tp -61.23 -50.8 71.59 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.858 0.361 . . . . 39.78 111.115 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -64.33 -30.93 71.97 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.708 0.633 . . . . 46.8 112.708 -178.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' ALA . . . . . . . . . . . . . . . -71.02 -35.38 72.0 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.125 -0.63 . . . . 43.4 111.215 174.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.418 ' HA ' HD22 ' A' ' 328' ' ' LEU . . . -76.23 -29.12 57.44 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.362 0.875 . . . . 40.37 113.362 -176.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' VAL . . . . . . . . . . . . . 34.8 m -72.92 -8.43 11.52 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 C-N-CA 118.15 -1.42 . . . . 53.64 110.415 175.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -107.45 37.2 2.47 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 122.4 1.095 . . . . 54.65 111.011 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' TYR . . . . . 0.47 ' CE2' ' HG2' ' A' ' 358' ' ' MET . 19.4 t80 -77.6 137.28 38.48 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 114.675 -1.148 . . . . 58.64 109.661 171.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -123.76 101.74 36.01 Favored Pre-proline 0 C--O 1.246 0.898 0 N-CA-C 108.173 -1.047 . . . . 53.78 108.173 176.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -63.99 -29.57 66.53 Favored 'Trans proline' 0 N--CA 1.476 0.459 0 N-CA-C 114.788 1.034 . . . . 61.08 114.788 179.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.97 -22.78 64.8 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 119.459 1.027 . . . . 116.44 111.92 175.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' SER . . . . . . . . . . . . . 2.6 t -117.54 -22.18 8.24 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 114.415 1.265 . . . . 77.7 114.415 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 66.66 44.76 2.15 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.841 0.829 . . . . 104.11 110.077 -177.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' THR . . . . . . . . . . . . . 24.4 p -132.73 149.91 52.22 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.118 -0.946 . . . . 59.0 110.03 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' A' ' 318' ' ' ALA . 34.4 mt -103.75 153.78 20.31 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.541 -1.209 . . . . 50.19 107.882 162.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' THR . . . . . . . . . . . . . 84.8 m -113.38 122.55 47.69 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.025 -0.534 . . . . 61.43 109.573 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' LEU . . . . . . . . . . . . . 35.4 mt -104.2 133.63 48.79 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.14 0.976 . . . . 59.78 109.38 -177.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' ASN . . . . . . . . . . . . . 1.8 m120 63.25 18.82 11.27 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.102 0.961 . . . . 64.81 113.282 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' GLY . . . . . . . . . . . . . . . 72.77 11.62 77.91 Favored Glycine 0 C--N 1.331 0.292 0 N-CA-C 116.643 1.417 . . . . 43.19 116.643 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' GLU . . . . . 0.506 ' HA ' ' HA ' ' A' ' 243' ' ' ARG . 26.0 pt-20 -149.77 -19.89 0.26 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.101 1.45 . . . . 106.88 114.906 -169.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' MET . . . . . . . . . . . . . 29.8 ttm -115.09 105.21 12.68 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.663 0.665 . . . . 63.09 110.171 -175.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' ALA . . . . . . . . . . . . . . . -81.57 129.52 34.71 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 109.38 -0.6 . . . . 48.79 109.38 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 49.2 t -133.45 135.99 55.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.263 -0.643 . . . . 47.13 109.263 -173.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' THR . . . . . . . . . . . . . 37.6 p -82.43 168.77 17.14 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-O 121.666 0.746 . . . . 43.4 110.305 177.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' ARG . . . . . 0.46 ' HD3' ' OD1' ' A' ' 351' ' ' ASP . 8.4 ttm105 -62.92 -36.07 82.17 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.686 -0.806 . . . . 96.34 111.351 -176.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' GLY . . . . . . . . . . . . . . . -72.19 -40.4 56.02 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 120.054 -1.07 . . . . 47.47 112.725 -176.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' GLN . . . . . 0.643 HE22 ' HB3' ' A' ' 246' ' ' LEU . 79.5 mt-30 -57.12 -49.92 74.4 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.884 0.342 . . . . 61.18 111.196 176.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' LEU . . . . . . . . . . . . . 34.6 tp -66.44 -35.6 80.69 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.409 -0.516 . . . . 46.08 111.648 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' LYS . . . . . . . . . . . . . 17.8 tttp -65.84 -46.61 77.9 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.348 -0.941 . . . . 68.04 110.66 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -78.51 -14.35 59.4 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 113.453 0.908 . . . . 64.45 113.453 -176.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' GLY . . . . . . . . . . . . . . . -76.63 -5.2 82.79 Favored Glycine 0 C--N 1.337 0.596 0 C-N-CA 120.444 -0.884 . . . . 49.41 114.56 173.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' GLY . . . . . . . . . . . . . . . 138.3 -20.54 3.16 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-O 119.084 -0.842 . . . . 48.9 114.629 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.98 -37.97 69.77 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-N 118.959 1.379 . . . . 52.79 112.591 -173.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' GLY . . . . . . . . . . . . . . . 69.11 -134.44 27.09 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 119.431 -1.366 . . . . 49.23 110.864 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' VAL . . . . . . . . . . . . . 5.5 p -63.06 -24.31 35.63 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 112.166 0.432 . . . . 47.89 112.166 -176.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.19 -27.59 43.05 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 O-C-N 121.601 -0.687 . . . . 42.71 110.154 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.4 t -60.15 -47.7 84.82 Favored 'General case' 0 C--O 1.239 0.51 0 O-C-N 121.817 -0.552 . . . . 44.9 112.352 171.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' ASP . . . . . 0.46 ' OD1' ' HD3' ' A' ' 338' ' ' ARG . 70.8 m-20 -62.63 -33.11 74.36 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.467 -0.893 . . . . 79.54 110.801 177.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' ALA . . . . . . . . . . . . . . . -63.76 -48.1 78.34 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.716 0.293 . . . . 39.85 111.382 177.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' ILE . . . . . . . . . . . . . 91.2 mt -68.66 -44.83 82.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.405 0.621 . . . . 39.28 110.751 -177.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.51 -27.97 69.63 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.6 -0.44 . . . . 46.01 111.785 177.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -70.4 -38.88 74.75 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 119.6 -0.84 . . . . 48.36 111.246 174.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' LEU . . . . . . . . . . . . . 8.5 tp -61.36 -48.02 83.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.808 -0.357 . . . . 42.17 110.832 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' GLY . . . . . . . . . . . . . . . -63.61 -39.86 98.04 Favored Glycine 0 C--N 1.338 0.676 0 C-N-CA 120.659 -0.781 . . . . 50.77 113.178 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' MET . . . . . 0.546 ' SD ' ' O ' ' A' ' 606' ' ' HOH . 29.7 mtp -62.81 -39.88 95.66 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.568 -0.853 . . . . 66.81 111.316 174.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' SER . . . . . . . . . . . . . 60.6 p -82.26 -17.88 44.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.377 -0.929 . . . . 69.68 112.936 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 10.7 mt -77.97 -15.98 58.52 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.176 0.806 . . . . 66.23 113.176 179.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 8.8 t -71.69 -12.91 61.56 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 118.99 -1.084 . . . . 105.58 112.96 -174.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 362' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.59 -19.72 32.58 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 118.568 0.622 . . . . 78.17 111.834 171.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 363' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -85.51 -23.58 27.68 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.469 0.707 . . . . 65.14 112.86 -174.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 364' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 56.34 47.81 18.32 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.449 0.7 . . . . 72.29 111.228 170.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' LEU . . . . . . . . . . . . . 23.1 mt -69.87 133.58 47.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.958 -0.565 . . . . 52.2 110.556 -178.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' ASP . . . . . . . . . . . . . 30.1 p30 -94.57 -178.07 4.43 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.76 0.791 . . . . 63.24 110.289 173.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.658 ' OD2' ' O ' ' A' ' 604' ' ' HOH . 60.3 m-20 -55.84 -39.99 72.21 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.001 -1.0 . . . . 87.74 112.262 -175.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 368' ' ' THR . . . . . . . . . . . . . 1.8 p -74.99 -35.4 62.03 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 116.822 -1.951 . . . . 58.83 111.521 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -65.88 -40.1 91.29 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 120.625 0.25 . . . . 54.35 111.328 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 370' ' ' VAL . . . . . . . . . . . . . 53.7 t -65.71 -35.26 74.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 C-N-CA 119.557 -0.857 . . . . 40.38 109.724 174.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 371' ' ' ALA . . . . . . . . . . . . . . . -70.17 -42.15 72.85 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 120.659 -0.416 . . . . 32.55 110.791 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 47.4 mt -69.47 -37.11 77.13 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 118.967 -1.093 . . . . 39.61 111.248 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 373' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 373' ' ' LEU . 8.6 mt -50.15 -56.46 10.9 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 121.331 0.586 . . . . 40.27 111.021 168.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 374' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -55.46 -33.55 63.73 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.219 -0.446 . . . . 43.4 112.169 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 375' ' ' ALA . . . . . . . . . . . . . . . -72.23 -38.52 68.93 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 119.86 -0.736 . . . . 42.46 111.54 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 376' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.23 -36.84 78.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 C-N-CA 119.752 -0.779 . . . . 53.86 110.883 179.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 15.7 mt -73.31 -36.85 66.32 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 121.92 -0.488 . . . . 39.4 111.826 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 378' ' ' LEU . . . . . . . . . . . . . 62.3 tp -64.09 -44.91 90.89 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 121.917 -0.489 . . . . 37.13 111.278 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 379' ' ' MET . . . . . . . . . . . . . 22.8 mmt -89.03 71.71 8.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.313 1.054 . . . . 70.34 110.585 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 380' ' ' SER . . . . . 0.797 ' OG ' ' NH1' ' A' ' 429' ' ' ARG . 16.0 m -111.62 101.7 10.07 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 107.74 -1.207 . . . . 54.51 107.74 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 381' ' ' SER . . . . . 0.61 ' HB2' HG13 ' A' ' 389' ' ' VAL . 6.8 p -63.33 -5.01 3.0 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.618 -0.433 . . . . 66.97 112.096 170.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 382' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.48 -34.99 79.16 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 112.328 0.492 . . . . 95.77 112.328 -179.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 383' ' ' ARG . . . . . 0.668 ' O ' ' O ' ' A' ' 603' ' ' HOH . 10.5 mmt85 -61.24 144.08 91.89 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 117.979 0.354 . . . . 90.5 111.221 -168.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 384' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -78.7 140.18 16.38 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 120.209 0.606 . . . . 62.91 112.274 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 385' ' ' GLY . . . . . . . . . . . . . . . 99.86 8.68 50.96 Favored Glycine 0 C--N 1.335 0.501 0 N-CA-C 116.284 1.273 . . . . 54.23 116.284 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 386' ' ' LEU . . . . . . . . . . . . . 63.3 mt -81.41 130.41 35.03 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 118.708 1.254 . . . . 72.51 111.842 -172.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 387' ' ' ALA . . . . . . . . . . . . . . . -80.74 -35.25 33.62 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.182 -0.463 . . . . 71.8 112.151 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 388' ' ' CYS . . . . . . . . . . . . . 80.1 m -107.56 41.84 1.44 Allowed 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 123.087 0.555 . . . . 104.01 111.599 -172.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 389' ' ' VAL . . . . . 0.61 HG13 ' HB2' ' A' ' 381' ' ' SER . 78.8 t -46.86 -47.09 8.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.777 -0.647 . . . . 59.3 111.102 -177.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 390' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -66.19 -44.92 82.59 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.07 -0.652 . . . . 108.81 111.184 -176.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 391' ' ' ARG . . . . . . . . . . . . . 23.0 ttm180 -58.64 -44.54 90.08 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 119.845 -0.742 . . . . 94.68 110.256 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 392' ' ' ILE . . . . . . . . . . . . . 4.3 mt -61.61 -37.09 77.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-O 120.869 0.366 . . . . 61.25 110.566 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 393' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -67.61 -29.01 68.24 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.045 -1.062 . . . . 100.09 112.129 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 394' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.85 -44.42 63.86 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 118.229 -1.388 . . . . 70.76 111.493 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 395' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -56.96 -44.82 82.97 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 120.591 -0.444 . . . . 71.8 111.756 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 396' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -63.65 -32.17 73.57 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.213 -0.595 . . . . 52.68 111.928 -178.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.38 -35.24 68.42 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.666 -0.813 . . . . 108.0 111.127 178.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 398' ' ' SER . . . . . . . . . . . . . 3.1 m -54.98 -48.84 72.75 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.122 0.487 . . . . 62.02 110.842 169.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 399' ' ' PHE . . . . . 0.536 ' CE1' HG21 ' A' ' 225' ' ' VAL . 44.1 m-85 -66.49 -46.42 76.35 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.4 -0.52 . . . . 47.23 111.032 178.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 4.4 mt -57.69 -46.23 84.6 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.807 -0.357 . . . . 53.18 111.421 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' LEU . . . . . 0.502 HD22 ' CE1' ' A' ' 405' ' ' HIS . 3.1 mt -60.36 -54.56 44.15 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 120.874 0.369 . . . . 54.99 111.6 175.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' ALA . . . . . . . . . . . . . . . -58.1 -31.73 67.41 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 111.875 0.324 . . . . 42.66 111.875 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -69.51 -46.13 67.26 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 120.883 0.373 . . . . 55.02 111.078 179.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -61.0 -55.78 28.9 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.991 -0.684 . . . . 75.37 110.424 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HIS . . . . . 0.502 ' CE1' HD22 ' A' ' 401' ' ' LEU . 44.0 m170 -49.57 -38.0 29.55 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.64 -0.424 . . . . 63.29 111.41 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' TYR . . . . . 0.404 ' CE2' ' HG3' ' A' ' 410' ' ' ARG . 48.8 t80 -67.88 -37.8 82.23 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 119.474 -0.891 . . . . 51.77 111.224 174.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' ILE . . . . . . . . . . . . . 1.4 mm -63.98 -42.0 94.31 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 C-N-CA 119.776 -0.77 . . . . 60.65 110.261 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' ASN . . . . . 0.658 ' O ' ' HD3' ' A' ' 411' ' ' LYS . 99.1 m-20 -55.56 -60.45 3.41 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.436 -0.506 . . . . 67.22 110.736 176.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -55.15 -39.06 69.06 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.589 -0.444 . . . . 73.48 111.721 -179.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' ARG . . . . . 0.404 ' HG3' ' CE2' ' A' ' 406' ' ' TYR . 3.6 mmm180 -68.05 -21.47 65.0 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 113.32 0.859 . . . . 81.92 113.32 -176.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' LYS . . . . . 0.658 ' HD3' ' O ' ' A' ' 408' ' ' ASN . 0.6 OUTLIER 48.15 60.61 3.49 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 122.112 0.958 . . . . 72.77 111.029 171.464 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -63.25 146.82 52.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.138 -0.937 . . . . 76.18 109.949 170.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' HIS . . . . . . . . . . . . . 15.2 m80 -94.47 47.78 1.19 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.539 -0.755 . . . . 102.47 111.684 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' VAL . . . . . 0.532 ' HB ' ' HD1' ' A' ' 417' ' ' PHE . 39.3 t . . . . . 0 C--O 1.238 0.459 0 O-C-N 121.987 -0.446 . . . . 69.7 109.812 -176.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HIS . . . . . 0.689 ' N ' ' HZ1' ' A' ' 420' ' ' LYS . . . . . . . . 0 CA--C 1.54 0.56 0 N-CA-C 113.322 0.86 . . . . 72.26 113.322 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' PHE . . . . . 0.8 ' O ' ' O ' ' A' ' 601' ' ' HOH . 1.0 OUTLIER -55.28 141.23 36.42 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.149 -0.478 . . . . 82.28 110.09 175.615 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' TRP . . . . . 0.53 ' HB3' ' HD3' ' A' ' 419' ' ' PRO . 75.5 t-105 110.04 -58.45 0.0 OUTLIER Pre-proline 0 C--O 1.237 0.41 0 C-N-CA 129.646 3.178 . . . . 60.42 109.995 171.107 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' PRO . . . . . 0.53 ' HD3' ' HB3' ' A' ' 418' ' ' TRP . 74.9 Cg_exo -54.74 -42.17 71.07 Favored 'Trans proline' 0 CA--C 1.513 -0.573 0 CA-C-N 120.711 1.29 . . . . 62.2 112.25 165.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' LYS . . . . . 0.689 ' HZ1' ' N ' ' A' ' 416' ' ' HIS . 11.6 mttp -64.39 -42.96 95.84 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.805 0.336 . . . . 69.16 111.259 176.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' LEU . . . . . . . . . . . . . 2.9 mt -62.15 -40.29 95.47 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 119.715 -0.794 . . . . 60.46 111.339 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 33.2 mt -61.18 -32.58 72.33 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.614 -0.434 . . . . 55.57 112.004 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' MET . . . . . . . . . . . . . 7.2 mtt -67.57 -31.96 72.4 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 120.182 -0.607 . . . . 64.72 111.581 174.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' LYS . . . . . . . . . . . . . 27.5 mmtm -69.64 -31.6 69.79 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.224 -0.59 . . . . 54.6 111.649 176.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' VAL . . . . . 0.564 ' O ' ' HG3' ' A' ' 429' ' ' ARG . 30.8 t -60.51 -48.31 89.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 CA-C-O 120.946 0.403 . . . . 49.96 109.929 174.02 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' THR . . . . . . . . . . . . . 27.8 m -55.1 -46.22 75.5 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.499 -0.319 . . . . 56.24 110.773 173.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' ASP . . . . . 0.513 ' OD2' ' O ' ' A' ' 605' ' ' HOH . 81.3 m-20 -50.79 -46.49 59.66 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.221 0.534 . . . . 81.25 111.213 177.325 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' LEU . . . . . . . . . . . . . 16.3 mt -66.55 -41.87 87.99 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 119.816 -0.754 . . . . 38.38 112.63 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' ARG . . . . . 0.797 ' NH1' ' OG ' ' A' ' 380' ' ' SER . 2.1 mtp180 -59.87 -44.06 94.38 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.195 -1.002 . . . . 79.48 111.251 -179.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' MET . . . . . . . . . . . . . 50.4 mmm -52.16 -52.18 53.47 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 111.542 0.201 . . . . 46.69 111.542 168.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' ILE . . . . . . . . . . . . . 36.5 mt -49.89 -41.58 17.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 O-C-N 121.945 -0.472 . . . . 43.58 110.528 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' GLY . . . . . . . . . . . . . . . -70.7 -39.0 67.04 Favored Glycine 0 C--N 1.341 0.836 0 N-CA-C 114.785 0.674 . . . . 45.35 114.785 178.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' ALA . . . . . . . . . . . . . . . -67.57 -0.29 3.75 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 114.008 1.114 . . . . 59.58 114.008 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' CYS . . . . . . . . . . . . . 79.6 m -97.45 23.76 7.29 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.071 0.549 . . . . 101.03 112.076 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 47.4 m170 -51.66 -48.84 63.27 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.224 0.535 . . . . 97.8 110.255 171.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' ALA . . . . . . . . . . . . . . . -76.82 -35.42 57.58 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.239 -0.985 . . . . 80.1 112.483 -175.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' SER . . . . . . . . . . . . . 10.5 t -86.8 60.52 6.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 123.394 1.569 . . . . 105.93 110.012 174.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' TRP . . . . . 0.567 ' O ' ' HE3' ' A' ' 438' ' ' TRP . 0.0 OUTLIER -172.25 -59.65 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.888 1 N-CA-C 99.728 -4.175 . . . . 89.89 99.728 -178.577 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 438' ' ' TRP . 19.9 m-85 . . . . . 0 N--CA 1.485 1.297 0 C-N-CA 126.53 1.932 . . . . 75.99 108.65 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' CYS . . . . . . . . . . . . . 3.3 m . . . . . 0 C--O 1.224 -0.27 0 N-CA-C 110.056 -0.35 . . . . 101.92 110.056 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.31 152.34 12.21 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 CA-C-O 122.756 1.065 . . . . 100.51 113.318 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' THR . . . . . . . . . . . . . 2.4 m -55.02 -33.48 62.67 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 114.072 -1.422 . . . . 74.11 113.542 -170.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' GLU . . . . . 0.403 ' H ' ' HG3' ' A' ' 449' ' ' GLU . 1.4 mt-10 -56.96 -19.93 20.83 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 113.321 0.86 . . . . 98.91 113.321 168.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' LEU . . . . . . . . . . . . . 1.1 mt -75.49 -20.95 58.43 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 118.17 -1.412 . . . . 75.93 112.794 -179.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' PHE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 452' ' ' PRO . 64.7 m-85 -85.42 136.74 37.19 Favored Pre-proline 0 C--O 1.24 0.597 0 CA-C-N 117.893 0.315 . . . . 52.91 110.535 175.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 451' ' ' PHE . 19.1 Cg_exo -55.93 140.76 86.19 Favored 'Trans proline' 0 C--O 1.249 1.036 0 O-C-N 124.744 1.918 . . . . 56.63 110.412 171.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -64.88 -31.04 57.65 Favored 'Trans proline' 0 C--O 1.242 0.698 0 N-CA-C 113.723 0.624 . . . . 69.97 113.723 -173.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 43.3 tp -67.3 -38.17 84.56 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 118.825 -1.15 . . . . 52.28 110.838 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' PHE . . . . . 0.427 ' CD1' HG12 ' A' ' 276' ' ' ILE . 73.4 t80 -59.87 -46.04 90.55 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 119.345 -0.942 . . . . 75.01 111.782 170.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' LEU . . . . . . . . . . . . . 75.0 mt -57.91 -26.08 61.71 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 117.768 -1.573 . . . . 70.17 112.07 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -79.4 -20.73 46.89 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.611 -0.835 . . . . 86.02 113.051 -172.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.76 15.94 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 118.624 0.647 . . . . 72.1 111.222 -175.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 114.163 1.171 . . . . 86.39 114.163 -179.402 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 741' ' ' GLU . . . . . 0.568 ' O ' ' NH1' ' C' ' 746' ' ' ARG . . . . . . . . 0 C--O 1.238 0.465 0 N-CA-C 110.091 -0.337 . . . . 74.06 110.091 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 742' ' ' ASN . . . . . 0.464 ' OD1' ' NZ ' ' A' ' 306' ' ' LYS . 19.6 m-80 60.23 44.31 12.82 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.778 0.799 . . . . 68.29 111.91 170.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 743' ' ' ALA . . . . . . . . . . . . . . . -68.73 -29.86 68.36 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.266 0.839 . . . . 63.84 113.266 -170.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 744' ' ' LEU . . . . . . . . . . . . . 22.0 tp -89.15 -40.35 12.96 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 113.651 0.982 . . . . 60.65 113.651 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 745' ' ' LEU . . . . . . . . . . . . . 14.7 tp -55.6 -41.92 74.1 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.005 0.431 . . . . 52.47 111.23 171.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 746' ' ' ARG . . . . . 0.568 ' NH1' ' O ' ' C' ' 741' ' ' GLU . 12.6 ttp180 -59.11 -42.57 90.84 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 122.016 -0.427 . . . . 77.46 111.582 174.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 747' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -64.68 -42.69 95.17 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.253 -0.579 . . . . 68.2 111.415 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 748' ' ' LEU . . . . . . . . . . . . . 23.8 mt -63.41 -31.4 72.55 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.809 -0.756 . . . . 67.66 111.583 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 749' ' ' LEU . . . . . . . . . . . . . 77.5 mt -70.0 -36.55 75.22 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.834 0.679 . . . . 71.32 112.834 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 750' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -94.49 7.56 45.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 118.27 0.486 . . . . 102.2 112.012 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 751' ' ' LYS . . . . . . . . . . . . . 12.8 ttpp . . . . . 0 C--N 1.324 -0.522 0 C-N-CA 123.842 0.857 . . . . 75.15 111.986 -174.902 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' 8HO . . . . . 0.683 ' O4 ' ' O ' ' A' ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' HOH . . . . . 0.8 ' O ' ' O ' ' A' ' 417' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' HOH . . . . . 0.683 ' O ' ' O4 ' ' A' ' 501' ' ' 8HO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 603' ' ' HOH . . . . . 0.668 ' O ' ' O ' ' A' ' 383' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' HOH . . . . . 0.658 ' O ' ' OD2' ' A' ' 367' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 605' ' ' HOH . . . . . 0.513 ' O ' ' OD2' ' A' ' 427' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 606' ' ' HOH . . . . . 0.546 ' O ' ' SD ' ' A' ' 358' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 610' ' ' HOH . . . . . 0.557 ' O ' ' NH2' ' A' ' 429' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 628' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 632' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 633' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 634' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 635' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 636' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 638' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 639' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 640' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 641' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 642' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 643' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 644' ' ' HOH . . . . . 0.456 ' O ' ' HG2' ' A' ' 235' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 645' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 646' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 649' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 650' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 651' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 653' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 654' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 655' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 656' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 657' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 658' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 801' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 802' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_