data_6h5z_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 6h5z _Structure_validation_residue.Date_analyzed 2019-04-05 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo . . . . . 0 N--CA 1.506 2.265 0 N-CA-C 108.466 -1.398 . . . . 63.42 108.466 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -62.69 -33.73 75.67 Favored 'General case' 0 C--N 1.35 0.596 0 O-C-N 125.599 1.812 . . . . 85.02 109.741 174.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.6 m -63.41 -34.04 76.87 Favored 'General case' 0 C--O 1.215 -0.727 0 C-N-CA 119.268 -0.973 . . . . 70.61 112.171 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . 1.115 ' CG ' ' NH2' ' A' ' 10' ' ' ARG . 12.9 tp10 -70.39 -37.27 74.48 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.407 1.083 . . . . 56.75 112.613 171.477 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.33 -41.94 76.86 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.402 0.281 . . . . 55.03 111.709 173.915 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 25.1 mt -68.2 -52.2 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.102 0 O-C-N 123.609 0.568 . . . . 55.3 110.346 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . 1.115 ' NH2' ' CG ' ' A' ' 7' ' ' GLU . 43.0 mtt85 -48.75 -50.41 34.01 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.232 1.197 . . . . 61.84 114.232 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -74.07 -33.22 63.59 Favored 'General case' 0 C--O 1.257 1.493 0 C-N-CA 126.262 1.825 . . . . 62.85 111.479 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.6 p -70.85 -38.39 73.18 Favored 'General case' 0 C--O 1.271 2.202 0 CA-C-O 123.335 1.541 . . . . 47.43 112.747 -176.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TRP . . . . . 0.55 ' NE1' ' OG ' ' A' ' 17' ' ' SER . 65.1 t-105 -66.59 -27.7 67.92 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 114.035 -1.439 . . . . 47.04 110.376 -178.659 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -63.02 -42.06 99.7 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 123.474 1.607 . . . . 61.92 109.862 -175.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -53.75 -53.65 24.95 Favored 'Isoleucine or valine' 0 C--O 1.257 1.495 0 CA-C-N 113.339 -1.755 . . . . 76.84 112.089 -178.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 1.2 m -77.02 -31.19 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 121.371 0.605 . . . . 58.96 112.43 -173.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . 0.55 ' OG ' ' NE1' ' A' ' 13' ' ' TRP . 84.7 p -64.5 -18.96 65.27 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.489 -0.778 . . . . 50.99 112.841 -176.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 -78.73 -21.93 47.32 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.94 1.296 . . . . 62.91 111.806 -178.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . 0.785 ' OG ' ' CE1' ' A' ' 23' ' ' HIS . 65.4 m -134.45 71.48 71.58 Favored Pre-proline 0 C--O 1.212 -0.912 0 N-CA-C 107.926 -1.138 . . . . 53.59 107.926 178.634 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.87 -30.01 33.95 Favored 'Trans proline' 0 N--CA 1.445 -1.336 0 O-C-N 123.682 1.359 . . . . 38.92 113.742 -169.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 56.2 tp -73.17 -43.12 61.94 Favored 'General case' 0 C--O 1.195 -1.78 0 C-N-CA 118.961 -1.095 . . . . 36.93 110.929 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -60.93 -43.09 99.11 Favored 'General case' 0 CA--C 1.494 -1.21 0 CA-C-O 121.931 0.872 . . . . 57.83 111.676 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HIS . . . . . 0.785 ' CE1' ' OG ' ' A' ' 19' ' ' SER . 43.0 m80 -70.91 -43.57 68.0 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 115.047 -0.978 . . . . 38.47 112.574 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.56 -27.86 71.58 Favored Glycine 0 C--N 1.336 0.552 0 CA-C-O 122.872 1.262 . . . . 24.74 114.41 177.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.0 m -63.08 -43.64 97.97 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 113.463 -1.368 . . . . 25.81 110.396 174.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 65.8 t -54.63 -49.46 67.19 Favored 'Isoleucine or valine' 0 C--N 1.349 0.565 0 CA-C-N 118.286 0.493 . . . . 27.17 111.959 168.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 tt -54.21 -51.43 64.45 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.848 -0.596 . . . . 29.27 111.542 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.279 42.1 m-85 -69.52 -40.54 76.87 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 114.808 1.41 . . . . 30.41 114.808 -177.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.54 -45.72 81.03 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 113.152 0.797 . . . . 23.01 113.152 171.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -60.21 -44.08 95.43 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 112.235 0.457 . . . . 25.4 112.235 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.3 tp -58.29 -44.94 88.74 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 113.29 0.848 . . . . 30.38 113.29 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -74.83 -28.76 60.83 Favored 'General case' 0 N--CA 1.39 -3.462 0 CA-C-N 118.481 0.582 . . . . 24.69 112.212 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.58 -38.3 90.61 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 122.148 0.975 . . . . 26.93 112.296 172.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 98.6 mt -78.19 -41.71 33.75 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 113.918 1.081 . . . . 30.53 113.918 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -139.6 79.81 23.4 Favored Pre-proline 0 N--CA 1.466 0.337 0 CA-C-O 123.971 1.843 . . . . 42.71 108.254 -172.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -61.6 -23.51 76.56 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 CA-C-N 115.196 -0.68 . . . . 28.85 113.088 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 88.4 p -67.75 -11.31 58.14 Favored 'General case' 0 C--O 1.252 1.217 0 N-CA-C 114.086 1.143 . . . . 27.5 114.086 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.0 mt -72.35 -23.04 61.08 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 116.36 1.985 . . . . 30.86 116.36 167.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.53 -44.93 95.8 Favored Pre-proline 0 C--O 1.185 -2.326 0 O-C-N 121.575 -0.703 . . . . 35.25 112.82 -176.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.33 -9.16 25.51 Favored 'Trans proline' 0 C--N 1.374 1.887 0 N-CA-C 117.749 2.173 . . . . 30.54 117.749 -177.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . 0.449 ' CB ' ' CBC' ' A' ' 201' ' ' HEM . 33.7 mt -72.41 -15.76 61.84 Favored 'General case' 0 N--CA 1.424 -1.733 0 N-CA-C 112.95 0.722 . . . . 36.49 112.95 -178.431 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -95.44 98.69 10.74 Favored 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 124.298 1.039 . . . . 53.24 112.821 174.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -117.79 53.96 0.92 Allowed 'General case' 0 N--CA 1.432 -1.338 0 O-C-N 128.552 3.657 . . . . 58.63 106.017 -177.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -67.79 126.72 30.29 Favored 'General case' 0 N--CA 1.41 -2.435 0 N-CA-C 103.207 -2.886 . . . . 42.13 103.207 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m120 72.05 29.83 2.28 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 115.643 -0.708 . . . . 83.63 111.182 -176.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 64.84 12.68 54.73 Favored Glycine 0 N--CA 1.477 1.368 0 CA-C-O 118.784 -1.009 . . . . 53.47 114.606 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -108.77 152.17 25.22 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.735 0.779 . . . . 66.65 112.156 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -104.88 134.95 47.14 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 107.167 -1.42 . . . . 42.1 107.167 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -66.2 135.02 53.91 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 108.048 -1.093 . . . . 26.68 108.048 169.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.2 m -77.3 -45.88 24.81 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.149 -0.969 . . . . 32.37 112.868 173.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.8 p -128.11 157.48 73.98 Favored Pre-proline 0 C--O 1.256 1.414 0 O-C-N 122.054 -0.403 . . . . 25.11 110.82 -175.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -54.13 -37.84 87.36 Favored 'Trans proline' 0 C--O 1.203 -1.26 0 N-CA-C 114.365 0.871 . . . . 34.67 114.365 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 22.8 pm0 -67.6 -24.03 65.44 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 117.661 -1.616 . . . . 25.65 111.26 -177.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -58.24 -37.92 75.85 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 113.037 0.754 . . . . 28.37 113.037 174.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 72.2 p -61.62 -38.78 88.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 122.025 0.917 . . . . 27.28 110.433 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.46 -11.71 61.05 Favored 'General case' 0 C--O 1.201 -1.495 0 N-CA-C 114.537 1.31 . . . . 32.46 114.537 -175.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.1 p -97.27 0.31 47.89 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 125.391 1.476 . . . . 29.9 111.66 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.5 t -95.34 118.15 66.43 Favored Pre-proline 0 C--O 1.211 -0.959 0 N-CA-C 112.625 0.602 . . . . 26.56 112.625 -174.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -62.28 -31.84 81.99 Favored 'Trans proline' 0 C--O 1.242 0.707 0 C-N-CA 120.783 0.989 . . . . 36.75 113.007 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -66.22 -40.03 90.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 114.777 -1.101 . . . . 51.36 111.32 -176.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -66.55 -41.05 89.28 Favored 'General case' 0 N--CA 1.418 -2.036 0 CA-C-O 120.786 0.327 . . . . 27.57 111.77 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.9 mt -67.02 -35.41 79.86 Favored 'General case' 0 C--O 1.268 2.052 0 N-CA-C 108.411 -0.959 . . . . 30.75 108.411 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -61.18 -40.16 92.89 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 119.951 -0.7 . . . . 42.57 111.541 175.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HIS . . . . . 0.458 ' CD2' ' NA ' ' A' ' 201' ' ' HEM . 36.7 t-80 -63.59 -39.65 94.93 Favored 'General case' 0 N--CA 1.42 -1.937 0 N-CA-C 112.461 0.541 . . . . 29.2 112.461 176.151 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.8 mt -51.65 -49.33 35.0 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 C-N-CA 118.754 -1.178 . . . . 31.41 113.756 169.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -55.66 -41.47 73.68 Favored 'General case' 0 C--O 1.254 1.326 0 N-CA-C 112.664 0.616 . . . . 46.12 112.664 175.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LYS . . . . . 0.498 ' NZ ' ' O1A' ' A' ' 201' ' ' HEM . 82.5 mttt -61.96 -45.21 94.68 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 123.566 0.542 . . . . 36.23 110.593 176.562 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 51.5 t -58.38 -46.93 89.14 Favored 'Isoleucine or valine' 0 C--O 1.243 0.753 0 CA-C-O 120.532 0.206 . . . . 31.23 110.62 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 87.0 mmm -69.75 -35.62 75.1 Favored 'General case' 0 N--CA 1.415 -2.212 0 N-CA-C 108.763 -0.829 . . . . 35.42 108.763 -174.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.9 tt -67.51 -34.18 76.59 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.683 0.754 . . . . 50.45 112.237 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 70.4 t -66.6 -44.33 89.99 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 O-C-N 120.957 -1.09 . . . . 39.04 113.083 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 94.9 mt -55.22 -48.0 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.197 0 C-N-CA 119.402 -0.919 . . . . 37.56 111.608 172.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -55.83 -37.69 69.02 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-O 121.606 0.717 . . . . 39.21 111.193 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.84 -41.39 95.75 Favored 'General case' 0 C--O 1.211 -0.927 0 O-C-N 121.716 -0.615 . . . . 46.53 111.109 178.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.65 -40.97 98.71 Favored 'General case' 0 C--O 1.253 1.281 0 N-CA-C 113.429 0.9 . . . . 42.81 113.429 174.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 76.3 t -61.28 -46.98 95.53 Favored 'Isoleucine or valine' 0 C--O 1.25 1.115 0 CA-C-N 115.864 -0.607 . . . . 49.53 109.617 176.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 8.0 m -53.05 -42.67 66.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.992 -0.549 . . . . 62.18 110.732 176.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -102.85 23.89 11.48 Favored 'General case' 0 C--O 1.253 1.256 0 N-CA-C 115.157 1.54 . . . . 55.57 115.157 -177.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 10.9 p -54.14 -35.72 30.2 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.641 0 N-CA-C 113.358 0.873 . . . . 52.35 113.358 -173.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . 0.989 ' OE1' ' OD1' ' A' ' 81' ' ' ASP . 1.8 pm0 -71.17 -24.95 62.34 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.889 -1.05 . . . . 75.16 112.191 178.517 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASP . . . . . 0.989 ' OD1' ' OE1' ' A' ' 80' ' ' GLU . 0.0 OUTLIER -157.21 104.36 2.05 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.056 0.455 . . . . 81.22 110.263 177.953 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tp -89.89 -10.81 43.86 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.271 -0.877 . . . . 86.51 112.62 163.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.3 p -54.54 -29.0 49.56 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 106.095 -1.817 . . . . 74.49 106.095 161.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.5 t -62.04 -18.38 60.43 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 113.253 -1.794 . . . . 63.88 113.577 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.2 mt -100.55 1.63 41.12 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 120.504 -1.373 . . . . 58.81 113.168 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -50.84 -48.92 59.81 Favored 'General case' 0 C--O 1.26 1.612 0 CA-C-N 114.864 -1.062 . . . . 66.44 112.289 -174.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 58.4 mp0 -75.21 -41.57 57.45 Favored 'General case' 0 C--O 1.26 1.632 0 CA-C-N 114.893 -1.049 . . . . 85.21 109.397 -171.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -55.45 -43.92 75.9 Favored 'General case' 0 N--CA 1.518 2.961 0 CA-C-N 114.623 -1.171 . . . . 47.69 111.539 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 86.3 mt -74.07 -34.96 64.2 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 109.753 -0.462 . . . . 46.6 109.753 -177.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.7 m -60.34 -40.13 89.59 Favored 'General case' 0 C--O 1.271 2.225 0 C-N-CA 117.536 -1.665 . . . . 52.61 110.914 179.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 91.5 p -73.64 -37.8 65.21 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 114.331 -1.304 . . . . 53.31 111.77 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.5 tp -56.8 -40.3 75.68 Favored 'General case' 0 C--O 1.249 1.027 0 O-C-N 124.369 1.043 . . . . 41.21 111.421 171.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.79 -41.68 99.81 Favored Glycine 0 C--O 1.29 3.635 0 C-N-CA 120.458 -0.877 . . . . 48.42 114.485 174.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -64.82 -40.14 94.73 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 108.649 -0.871 . . . . 56.11 108.649 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -55.47 -47.0 76.81 Favored 'General case' 0 C--O 1.199 -1.572 0 CA-C-O 121.884 0.849 . . . . 54.4 112.423 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . 0.826 ' CE1' ' C1B' ' A' ' 201' ' ' HEM . 61.3 m80 -71.39 -31.13 66.93 Favored 'General case' 0 C--O 1.273 2.299 0 N-CA-C 113.066 0.765 . . . . 41.49 113.066 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.0 ttt-85 -60.31 -43.74 96.08 Favored 'General case' 0 C--O 1.265 1.905 0 N-CA-C 107.095 -1.446 . . . . 94.83 107.095 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.59 -35.21 80.24 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.91 -1.95 . . . . 48.06 114.238 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.7 m -83.33 -15.72 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.65 0 CA-C-O 122.094 0.949 . . . . 53.03 110.933 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.44 15.48 8.21 Favored Glycine 0 C--O 1.272 2.511 0 O-C-N 121.411 -0.806 . . . . 44.17 113.381 165.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 47.9 t -79.48 131.86 33.3 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 N-CA-C 108.953 -0.758 . . . . 46.61 108.953 174.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ARG . . . . . 0.681 ' NH2' ' O ' ' A' ' 302' ' ' HOH . 1.2 mtt85 -83.88 142.97 30.2 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 107.925 -1.139 . . . . 69.33 107.925 174.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -34.3 73.4 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 121.185 -0.947 . . . . 55.59 108.672 -178.52 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.8 p -52.38 -34.76 49.33 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 115.443 -0.798 . . . . 51.93 112.056 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 65.7 m -67.85 -11.95 59.65 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.064 1.505 . . . . 41.48 115.064 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.9 -38.13 78.19 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.296 -0.878 . . . . 41.74 112.792 177.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 69.2 p -65.6 -38.13 88.59 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.5 -0.75 . . . . 46.85 111.609 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 3.5 m -63.48 -37.7 88.3 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-O 119.086 -0.483 . . . . 43.71 112.104 173.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 84.8 t -62.19 -42.73 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.819 0 CA-C-O 121.203 0.525 . . . . 34.43 111.015 173.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -56.87 -49.44 71.0 Favored Glycine 0 CA--C 1.508 -0.404 0 CA-C-N 115.219 -0.9 . . . . 32.22 113.19 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -61.35 -34.95 76.14 Favored 'General case' 0 C--O 1.262 1.735 0 CA-C-N 114.258 -0.971 . . . . 52.99 110.508 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 54.4 m -70.86 -40.77 72.13 Favored 'General case' 0 CA--C 1.561 1.393 0 CA-C-O 123.445 1.593 . . . . 26.4 111.907 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 tp -58.01 -48.77 79.05 Favored 'General case' 0 N--CA 1.427 -1.581 0 O-C-N 120.383 -1.448 . . . . 31.76 113.949 171.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.7 mt -63.86 -36.93 85.55 Favored 'General case' 0 C--O 1.255 1.37 0 CA-C-N 114.542 -1.208 . . . . 48.82 107.962 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -62.31 -48.45 79.78 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 122.118 0.961 . . . . 31.38 110.064 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 18.7 tmm? -62.42 -41.55 98.78 Favored 'General case' 0 N--CA 1.44 -0.925 0 O-C-N 121.578 -0.702 . . . . 32.92 110.6 -177.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.6 mt -63.7 -45.74 88.62 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.081 -0.387 . . . . 34.83 111.379 176.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -58.32 -48.63 79.91 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-O 118.309 -0.853 . . . . 58.79 109.472 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -65.62 -34.41 78.15 Favored 'General case' 0 C--O 1.195 -1.806 0 CA-C-O 117.679 -1.153 . . . . 42.26 111.343 -177.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.2 m -77.03 -37.74 54.29 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.002 0.814 . . . . 38.39 112.183 -178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 70.8 mt -91.79 -20.0 21.97 Favored 'General case' 0 C--O 1.262 1.739 0 N-CA-C 113.833 1.049 . . . . 40.2 113.833 -173.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 54.29 -127.92 40.27 Favored Glycine 0 C--O 1.247 0.961 0 CA-C-O 118.827 -0.985 . . . . 53.53 110.925 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -48.9 -37.59 36.8 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 O-C-N 123.26 1.137 . . . . 59.19 112.925 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -67.23 -9.06 36.6 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 118.281 2.697 . . . . 68.72 118.281 -176.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -86.91 72.7 10.08 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 124.257 1.979 . . . . 47.73 107.905 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 63.8 p -72.63 162.11 75.84 Favored Pre-proline 0 C--O 1.248 1.01 0 CA-C-N 113.011 -1.904 . . . . 53.41 111.051 -178.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -62.54 -24.13 75.12 Favored 'Trans proline' 0 CA--C 1.569 2.247 0 C-N-CA 116.059 -2.161 . . . . 54.14 115.288 -178.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -72.38 -30.75 64.97 Favored 'General case' 0 C--O 1.244 0.804 0 N-CA-C 106.493 -1.669 . . . . 47.66 106.493 177.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.6 m -68.85 -46.58 68.14 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 115.169 -0.923 . . . . 52.13 109.669 179.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 54.4 ttt-85 -55.73 -46.17 77.81 Favored 'General case' 0 C--O 1.272 2.246 0 O-C-N 121.504 -0.748 . . . . 83.13 112.782 173.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 55.1 m -63.88 -43.24 96.63 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-N 114.069 -1.423 . . . . 47.06 111.113 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -58.16 -49.72 76.03 Favored 'General case' 0 C--O 1.268 2.027 0 O-C-N 124.07 0.856 . . . . 42.63 112.483 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 61.7 m95 -66.16 -34.51 78.2 Favored 'General case' 0 C--O 1.257 1.453 0 CA-C-N 114.676 -1.147 . . . . 38.41 113.087 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 m -63.72 -40.91 97.93 Favored 'General case' 0 C--O 1.279 2.621 0 N-CA-C 108.35 -0.982 . . . . 41.01 108.35 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . 0.324 2.7 mtp-105 -67.04 -46.65 73.78 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 116.885 -1.926 . . . . 55.56 111.389 -176.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 24.3 tp -59.95 -52.86 63.59 Favored 'General case' 0 C--O 1.195 -1.788 0 N-CA-C 114.047 1.128 . . . . 44.19 114.047 171.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -59.59 -39.88 85.6 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 108.021 -1.103 . . . . 41.35 108.021 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -63.92 -35.72 92.36 Favored Glycine 0 N--CA 1.465 0.59 0 N-CA-C 110.38 -1.088 . . . . 42.06 110.38 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.13 -42.05 89.67 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 114.801 -0.7 . . . . 51.83 112.035 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 49.5 t -60.98 -46.28 96.9 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-N 116.024 -0.535 . . . . 39.0 110.773 176.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.92 -37.17 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 N-CA-C 113.4 0.889 . . . . 41.68 113.4 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -44.35 95.83 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 107.97 -1.122 . . . . 65.95 107.97 175.846 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.5 92.79 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 115.555 -0.748 . . . . 45.61 112.264 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 86.9 mtp -69.08 -30.32 68.62 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.503 0.192 . . . . 42.99 110.487 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 83.9 p -66.52 -29.86 70.05 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.12 0.568 . . . . 60.23 110.736 -170.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.5 mtp-105 -53.03 -37.85 61.9 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 125.679 1.862 . . . . 65.31 108.444 174.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -66.63 -5.38 30.19 Favored Glycine 0 CA--C 1.531 1.092 0 N-CA-C 118.145 2.018 . . . . 61.38 118.145 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -93.51 -1.29 55.76 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.716 1.258 . . . . 84.57 114.115 174.276 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 19.8 p30 . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 116.131 1.9 . . . . 128.33 116.131 175.406 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HEM . . . . . 0.923 ' CHD' ' CBC' ' A' ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' DIO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.678 ' O ' ' NE ' ' A' ' 10' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.681 ' O ' ' NH2' ' A' ' 102' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . 0.454 ' O ' ' NH1' ' A' ' 102' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . 0.415 ' O ' ' NH1' ' A' ' 102' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo . . . . . 0 N--CA 1.506 2.265 0 N-CA-C 108.466 -1.398 . . . . 63.42 108.466 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . 0.519 ' HA ' HD23 ' A' ' 8' ' ' LEU . 14.2 pt-20 -62.69 -33.73 75.67 Favored 'General case' 0 C--N 1.35 0.596 0 O-C-N 125.599 1.812 . . . . 85.02 109.741 174.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.6 m -63.41 -34.04 76.87 Favored 'General case' 0 C--O 1.215 -0.727 0 C-N-CA 119.268 -0.973 . . . . 70.61 112.171 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . 1.399 ' HG3' ' NH2' ' A' ' 10' ' ' ARG . 12.9 tp10 -70.39 -37.27 74.48 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.407 1.083 . . . . 57.88 112.613 171.477 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 5' ' ' GLU . 0.3 OUTLIER -56.33 -41.94 76.86 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.402 0.281 . . . . 55.03 111.709 173.915 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 25.1 mt -68.2 -52.2 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.102 0 O-C-N 123.609 0.568 . . . . 55.3 110.346 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . 1.399 ' NH2' ' HG3' ' A' ' 7' ' ' GLU . 43.0 mtt85 -48.75 -50.41 34.01 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.232 1.197 . . . . 82.27 114.232 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 7' ' ' GLU . 9.4 tt0 -74.07 -33.22 63.59 Favored 'General case' 0 C--O 1.257 1.493 0 C-N-CA 126.262 1.825 . . . . 62.85 111.479 179.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . 0.465 ' O ' HG12 ' A' ' 15' ' ' VAL . 10.6 p -70.85 -38.39 73.18 Favored 'General case' 0 C--O 1.271 2.202 0 CA-C-O 123.335 1.541 . . . . 47.43 112.747 -176.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TRP . . . . . 0.495 ' NE1' ' OG ' ' A' ' 17' ' ' SER . 65.1 t-105 -66.59 -27.7 67.92 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 114.035 -1.439 . . . . 47.04 110.376 -178.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -63.02 -42.06 99.7 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 123.474 1.607 . . . . 63.3 109.862 -175.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 12' ' ' SER . 2.9 p -53.75 -53.65 24.95 Favored 'Isoleucine or valine' 0 C--O 1.257 1.495 0 CA-C-N 113.339 -1.755 . . . . 76.84 112.089 -178.255 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 1.2 m -77.02 -31.19 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 121.371 0.605 . . . . 58.96 112.43 -173.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . 0.495 ' OG ' ' NE1' ' A' ' 13' ' ' TRP . 84.7 p -64.5 -18.96 65.27 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.489 -0.778 . . . . 50.99 112.841 -176.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . 0.57 ' HG2' HH21 ' A' ' 18' ' ' ARG . 2.7 mtt-85 -78.73 -21.93 47.32 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.94 1.296 . . . . 64.91 111.806 -178.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . 0.647 ' O ' ' HD2' ' A' ' 23' ' ' HIS . 65.4 m -134.45 71.48 71.58 Favored Pre-proline 0 C--O 1.212 -0.912 0 N-CA-C 107.926 -1.138 . . . . 53.59 107.926 178.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.87 -30.01 33.95 Favored 'Trans proline' 0 N--CA 1.445 -1.336 0 O-C-N 123.682 1.359 . . . . 38.92 113.742 -169.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 56.2 tp -73.17 -43.12 61.94 Favored 'General case' 0 C--O 1.195 -1.78 0 C-N-CA 118.961 -1.095 . . . . 36.93 110.929 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -60.93 -43.09 99.11 Favored 'General case' 0 CA--C 1.494 -1.21 0 CA-C-O 121.931 0.872 . . . . 57.83 111.676 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HIS . . . . . 0.656 ' HB3' ' CE ' ' A' ' 116' ' ' MET . 41.9 m-70 -70.91 -43.57 68.0 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 115.047 -0.978 . . . . 38.47 112.574 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.56 -27.86 71.58 Favored Glycine 0 C--N 1.336 0.552 0 CA-C-O 122.872 1.262 . . . . 24.74 114.41 177.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.0 m -63.08 -43.64 97.97 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 113.463 -1.368 . . . . 25.81 110.396 174.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 65.8 t -54.63 -49.46 67.19 Favored 'Isoleucine or valine' 0 C--N 1.349 0.565 0 CA-C-N 118.286 0.493 . . . . 27.17 111.959 168.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . 0.432 HD23 ' C ' ' A' ' 27' ' ' LEU . 6.0 tt -54.21 -51.43 64.45 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.848 -0.596 . . . . 29.27 111.542 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.279 42.1 m-85 -69.52 -40.54 76.87 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 114.808 1.41 . . . . 30.41 114.808 -177.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.54 -45.72 81.03 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 113.152 0.797 . . . . 23.01 113.152 171.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -60.21 -44.08 95.43 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 112.235 0.457 . . . . 25.4 112.235 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.3 tp -58.29 -44.94 88.74 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 113.29 0.848 . . . . 30.38 113.29 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PHE . . . . . 0.614 ' CZ ' HD23 ' A' ' 39' ' ' LEU . 23.3 m-85 -74.83 -28.76 60.83 Favored 'General case' 0 N--CA 1.39 -3.462 0 CA-C-N 118.481 0.582 . . . . 24.69 112.212 -179.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.58 -38.3 90.61 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 122.148 0.975 . . . . 26.93 112.296 172.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 98.6 mt -78.19 -41.71 33.75 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 113.918 1.081 . . . . 30.53 113.918 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -139.6 79.81 23.4 Favored Pre-proline 0 N--CA 1.466 0.337 0 CA-C-O 123.971 1.843 . . . . 42.71 108.254 -172.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -61.6 -23.51 76.56 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 CA-C-N 115.196 -0.68 . . . . 28.85 113.088 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' SER . . . . . 0.418 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 88.4 p -67.75 -11.31 58.14 Favored 'General case' 0 C--O 1.252 1.217 0 N-CA-C 114.086 1.143 . . . . 27.5 114.086 -179.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.0 mt -72.35 -23.04 61.08 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 116.36 1.985 . . . . 30.86 116.36 167.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . 0.614 HD23 ' CZ ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -52.53 -44.93 95.8 Favored Pre-proline 0 C--O 1.185 -2.326 0 O-C-N 121.575 -0.703 . . . . 35.25 112.82 -176.29 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . 0.418 ' HD2' ' O ' ' A' ' 37' ' ' SER . 13.6 Cg_exo -69.33 -9.16 25.51 Favored 'Trans proline' 0 C--N 1.374 1.887 0 N-CA-C 117.749 2.173 . . . . 30.54 117.749 -177.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . 0.716 ' CB ' HBC1 ' A' ' 201' ' ' HEM . 33.7 mt -72.41 -15.76 61.84 Favored 'General case' 0 N--CA 1.424 -1.733 0 N-CA-C 112.95 0.722 . . . . 36.49 112.95 -178.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . 0.434 ' HE2' ' ND1' ' A' ' 64' ' ' HIS . 65.0 m-85 -95.44 98.69 10.74 Favored 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 124.298 1.039 . . . . 53.24 112.821 174.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -117.79 53.96 0.92 Allowed 'General case' 0 N--CA 1.432 -1.338 0 O-C-N 128.552 3.657 . . . . 63.15 106.017 -177.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -67.79 126.72 30.29 Favored 'General case' 0 N--CA 1.41 -2.435 0 N-CA-C 103.207 -2.886 . . . . 42.13 103.207 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m120 72.05 29.83 2.28 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 115.643 -0.708 . . . . 83.63 111.182 -176.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 64.84 12.68 54.73 Favored Glycine 0 N--CA 1.477 1.368 0 CA-C-O 118.784 -1.009 . . . . 53.47 114.606 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -108.77 152.17 25.22 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.735 0.779 . . . . 69.72 112.156 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -104.88 134.95 47.14 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 107.167 -1.42 . . . . 42.1 107.167 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -66.2 135.02 53.91 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 108.048 -1.093 . . . . 26.68 108.048 169.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.2 m -77.3 -45.88 24.81 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.149 -0.969 . . . . 32.37 112.868 173.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.8 p -128.11 157.48 73.98 Favored Pre-proline 0 C--O 1.256 1.414 0 O-C-N 122.054 -0.403 . . . . 29.27 110.82 -175.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -54.13 -37.84 87.36 Favored 'Trans proline' 0 C--O 1.203 -1.26 0 N-CA-C 114.365 0.871 . . . . 34.67 114.365 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 22.8 pm0 -67.6 -24.03 65.44 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 117.661 -1.616 . . . . 25.65 111.26 -177.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -58.24 -37.92 75.85 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 113.037 0.754 . . . . 28.37 113.037 174.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 72.2 p -61.62 -38.78 88.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 122.025 0.917 . . . . 27.28 110.433 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.46 -11.71 61.05 Favored 'General case' 0 C--O 1.201 -1.495 0 N-CA-C 114.537 1.31 . . . . 32.46 114.537 -175.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.1 p -97.27 0.31 47.89 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 125.391 1.476 . . . . 40.21 111.66 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.5 t -95.34 118.15 66.43 Favored Pre-proline 0 C--O 1.211 -0.959 0 N-CA-C 112.625 0.602 . . . . 26.56 112.625 -174.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -62.28 -31.84 81.99 Favored 'Trans proline' 0 C--O 1.242 0.707 0 C-N-CA 120.783 0.989 . . . . 38.17 113.007 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -66.22 -40.03 90.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 114.777 -1.101 . . . . 51.36 111.32 -176.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -66.55 -41.05 89.28 Favored 'General case' 0 N--CA 1.418 -2.036 0 CA-C-O 120.786 0.327 . . . . 27.57 111.77 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.9 mt -67.02 -35.41 79.86 Favored 'General case' 0 C--O 1.268 2.052 0 N-CA-C 108.411 -0.959 . . . . 30.75 108.411 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -61.18 -40.16 92.89 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 119.951 -0.7 . . . . 42.57 111.541 175.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HIS . . . . . 0.458 ' CD2' ' NA ' ' A' ' 201' ' ' HEM . 36.7 t-80 -63.59 -39.65 94.93 Favored 'General case' 0 N--CA 1.42 -1.937 0 N-CA-C 112.461 0.541 . . . . 29.52 112.461 176.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.8 mt -51.65 -49.33 35.0 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 C-N-CA 118.754 -1.178 . . . . 31.41 113.756 169.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -55.66 -41.47 73.68 Favored 'General case' 0 C--O 1.254 1.326 0 N-CA-C 112.664 0.616 . . . . 46.12 112.664 175.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LYS . . . . . 0.436 ' NZ ' ' O1A' ' A' ' 201' ' ' HEM . 82.5 mttt -61.96 -45.21 94.68 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 123.566 0.542 . . . . 36.23 110.593 176.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . 0.52 HG22 ' C4C' ' A' ' 201' ' ' HEM . 51.5 t -58.38 -46.93 89.14 Favored 'Isoleucine or valine' 0 C--O 1.243 0.753 0 CA-C-O 120.532 0.206 . . . . 31.23 110.62 178.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 87.0 mmm -69.75 -35.62 75.1 Favored 'General case' 0 N--CA 1.415 -2.212 0 N-CA-C 108.763 -0.829 . . . . 35.42 108.763 -174.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.9 tt -67.51 -34.18 76.59 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.683 0.754 . . . . 50.45 112.237 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 70.4 t -66.6 -44.33 89.99 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 O-C-N 120.957 -1.09 . . . . 39.04 113.083 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 94.9 mt -55.22 -48.0 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.197 0 C-N-CA 119.402 -0.919 . . . . 37.56 111.608 172.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -55.83 -37.69 69.02 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-O 121.606 0.717 . . . . 47.05 111.193 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.84 -41.39 95.75 Favored 'General case' 0 C--O 1.211 -0.927 0 O-C-N 121.716 -0.615 . . . . 46.53 111.109 178.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.65 -40.97 98.71 Favored 'General case' 0 C--O 1.253 1.281 0 N-CA-C 113.429 0.9 . . . . 42.81 113.429 174.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 76.3 t -61.28 -46.98 95.53 Favored 'Isoleucine or valine' 0 C--O 1.25 1.115 0 CA-C-N 115.864 -0.607 . . . . 49.53 109.617 176.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 8.0 m -53.05 -42.67 66.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.992 -0.549 . . . . 62.18 110.732 176.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -102.85 23.89 11.48 Favored 'General case' 0 C--O 1.253 1.256 0 N-CA-C 115.157 1.54 . . . . 55.57 115.157 -177.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 10.9 p -54.14 -35.72 30.2 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.641 0 N-CA-C 113.358 0.873 . . . . 52.35 113.358 -173.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . 0.989 ' OE1' ' OD1' ' A' ' 81' ' ' ASP . 1.8 pm0 -71.17 -24.95 62.34 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.889 -1.05 . . . . 75.16 112.191 178.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASP . . . . . 0.989 ' OD1' ' OE1' ' A' ' 80' ' ' GLU . 0.0 OUTLIER -157.21 104.36 2.05 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.056 0.455 . . . . 81.22 110.263 177.953 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . 0.4 ' H ' ' HB2' ' A' ' 81' ' ' ASP . 1.7 tp -89.89 -10.81 43.86 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.271 -0.877 . . . . 86.51 112.62 163.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.3 p -54.54 -29.0 49.56 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 106.095 -1.817 . . . . 74.49 106.095 161.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.5 t -62.04 -18.38 60.43 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 113.253 -1.794 . . . . 63.88 113.577 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.2 mt -100.55 1.63 41.12 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 120.504 -1.373 . . . . 58.81 113.168 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -50.84 -48.92 59.81 Favored 'General case' 0 C--O 1.26 1.612 0 CA-C-N 114.864 -1.062 . . . . 73.26 112.289 -174.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 58.4 mp0 -75.21 -41.57 57.45 Favored 'General case' 0 C--O 1.26 1.632 0 CA-C-N 114.893 -1.049 . . . . 85.21 109.397 -171.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -55.45 -43.92 75.9 Favored 'General case' 0 N--CA 1.518 2.961 0 CA-C-N 114.623 -1.171 . . . . 47.69 111.539 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 86.3 mt -74.07 -34.96 64.2 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 109.753 -0.462 . . . . 46.6 109.753 -177.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.7 m -60.34 -40.13 89.59 Favored 'General case' 0 C--O 1.271 2.225 0 C-N-CA 117.536 -1.665 . . . . 52.61 110.914 179.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 91.5 p -73.64 -37.8 65.21 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 114.331 -1.304 . . . . 53.31 111.77 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . 0.629 HD11 ' C3A' ' A' ' 201' ' ' HEM . 18.5 tp -56.8 -40.3 75.68 Favored 'General case' 0 C--O 1.249 1.027 0 O-C-N 124.369 1.043 . . . . 41.21 111.421 171.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.79 -41.68 99.81 Favored Glycine 0 C--O 1.29 3.635 0 C-N-CA 120.458 -0.877 . . . . 48.42 114.485 174.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -64.82 -40.14 94.73 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 108.649 -0.871 . . . . 67.19 108.649 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -55.47 -47.0 76.81 Favored 'General case' 0 C--O 1.199 -1.572 0 CA-C-O 121.884 0.849 . . . . 54.4 112.423 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . 0.826 ' CE1' ' C1B' ' A' ' 201' ' ' HEM . 61.3 m80 -71.39 -31.13 66.93 Favored 'General case' 0 C--O 1.273 2.299 0 N-CA-C 113.066 0.765 . . . . 41.49 113.066 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 148' ' ' TRP . 11.0 ttt-85 -60.31 -43.74 96.08 Favored 'General case' 0 C--O 1.265 1.905 0 N-CA-C 107.095 -1.446 . . . . 94.83 107.095 176.538 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.59 -35.21 80.24 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.91 -1.95 . . . . 48.06 114.238 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.7 m -83.33 -15.72 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.65 0 CA-C-O 122.094 0.949 . . . . 53.03 110.933 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.44 15.48 8.21 Favored Glycine 0 C--O 1.272 2.511 0 O-C-N 121.411 -0.806 . . . . 44.17 113.381 165.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 96' ' ' HIS . 47.9 t -79.48 131.86 33.3 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 N-CA-C 108.953 -0.758 . . . . 65.13 108.953 174.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ARG . . . . . 0.454 ' NH1' ' O ' ' A' ' 309' ' ' HOH . 1.2 mtt85 -83.88 142.97 30.2 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 107.925 -1.139 . . . . 69.33 107.925 174.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . 0.484 HD12 ' CG ' ' A' ' 148' ' ' TRP . 0.8 OUTLIER -60.18 -34.3 73.4 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 121.185 -0.947 . . . . 55.59 108.672 -178.52 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.8 p -52.38 -34.76 49.33 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 115.443 -0.798 . . . . 67.08 112.056 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 65.7 m -67.85 -11.95 59.65 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.064 1.505 . . . . 41.48 115.064 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.9 -38.13 78.19 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.296 -0.878 . . . . 41.74 112.792 177.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 69.2 p -65.6 -38.13 88.59 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.5 -0.75 . . . . 46.85 111.609 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 3.5 m -63.48 -37.7 88.3 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-O 119.086 -0.483 . . . . 43.71 112.104 173.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 84.8 t -62.19 -42.73 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.819 0 CA-C-O 121.203 0.525 . . . . 34.43 111.015 173.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -56.87 -49.44 71.0 Favored Glycine 0 CA--C 1.508 -0.404 0 CA-C-N 115.219 -0.9 . . . . 32.22 113.19 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -61.35 -34.95 76.14 Favored 'General case' 0 C--O 1.262 1.735 0 CA-C-N 114.258 -0.971 . . . . 52.99 110.508 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 54.4 m -70.86 -40.77 72.13 Favored 'General case' 0 CA--C 1.561 1.393 0 CA-C-O 123.445 1.593 . . . . 26.4 111.907 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 tp -58.01 -48.77 79.05 Favored 'General case' 0 N--CA 1.427 -1.581 0 O-C-N 120.383 -1.448 . . . . 31.76 113.949 171.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.7 mt -63.86 -36.93 85.55 Favored 'General case' 0 C--O 1.255 1.37 0 CA-C-N 114.542 -1.208 . . . . 48.82 107.962 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -62.31 -48.45 79.78 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 122.118 0.961 . . . . 31.38 110.064 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' MET . . . . . 0.656 ' CE ' ' HB3' ' A' ' 23' ' ' HIS . 18.7 tmm? -62.42 -41.55 98.78 Favored 'General case' 0 N--CA 1.44 -0.925 0 O-C-N 121.578 -0.702 . . . . 53.15 110.6 -177.483 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.6 mt -63.7 -45.74 88.62 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.081 -0.387 . . . . 34.83 111.379 176.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -58.32 -48.63 79.91 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-O 118.309 -0.853 . . . . 58.79 109.472 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -65.62 -34.41 78.15 Favored 'General case' 0 C--O 1.195 -1.806 0 CA-C-O 117.679 -1.153 . . . . 42.26 111.343 -177.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.2 m -77.03 -37.74 54.29 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.002 0.814 . . . . 39.11 112.183 -178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LEU . . . . . 0.658 HD12 ' CD1' ' A' ' 125' ' ' PHE . 70.8 mt -91.79 -20.0 21.97 Favored 'General case' 0 C--O 1.262 1.739 0 N-CA-C 113.833 1.049 . . . . 47.69 113.833 -173.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 54.29 -127.92 40.27 Favored Glycine 0 C--O 1.247 0.961 0 CA-C-O 118.827 -0.985 . . . . 53.53 110.925 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -48.9 -37.59 36.8 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 O-C-N 123.26 1.137 . . . . 63.45 112.925 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -67.23 -9.06 36.6 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 118.281 2.697 . . . . 68.72 118.281 -176.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PHE . . . . . 0.658 ' CD1' HD12 ' A' ' 121' ' ' LEU . 14.3 t80 -86.91 72.7 10.08 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 124.257 1.979 . . . . 49.32 107.905 179.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 63.8 p -72.63 162.11 75.84 Favored Pre-proline 0 C--O 1.248 1.01 0 CA-C-N 113.011 -1.904 . . . . 53.41 111.051 -178.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -62.54 -24.13 75.12 Favored 'Trans proline' 0 CA--C 1.569 2.247 0 C-N-CA 116.059 -2.161 . . . . 54.14 115.288 -178.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -72.38 -30.75 64.97 Favored 'General case' 0 C--O 1.244 0.804 0 N-CA-C 106.493 -1.669 . . . . 47.66 106.493 177.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.6 m -68.85 -46.58 68.14 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 115.169 -0.923 . . . . 52.13 109.669 179.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 54.4 ttt-85 -55.73 -46.17 77.81 Favored 'General case' 0 C--O 1.272 2.246 0 O-C-N 121.504 -0.748 . . . . 83.13 112.782 173.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 55.1 m -63.88 -43.24 96.63 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-N 114.069 -1.423 . . . . 47.06 111.113 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . 0.488 ' HB2' ' HG2' ' A' ' 5' ' ' GLU . . . -58.16 -49.72 76.03 Favored 'General case' 0 C--O 1.268 2.027 0 O-C-N 124.07 0.856 . . . . 42.63 112.483 177.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 61.7 m95 -66.16 -34.51 78.2 Favored 'General case' 0 C--O 1.257 1.453 0 CA-C-N 114.676 -1.147 . . . . 38.41 113.087 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 m -63.72 -40.91 97.93 Favored 'General case' 0 C--O 1.279 2.621 0 N-CA-C 108.35 -0.982 . . . . 41.01 108.35 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . 0.324 2.7 mtp-105 -67.04 -46.65 73.78 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 116.885 -1.926 . . . . 75.39 111.389 -176.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 24.3 tp -59.95 -52.86 63.59 Favored 'General case' 0 C--O 1.195 -1.788 0 N-CA-C 114.047 1.128 . . . . 44.19 114.047 171.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -59.59 -39.88 85.6 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 108.021 -1.103 . . . . 41.35 108.021 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -63.92 -35.72 92.36 Favored Glycine 0 N--CA 1.465 0.59 0 N-CA-C 110.38 -1.088 . . . . 42.06 110.38 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.13 -42.05 89.67 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 114.801 -0.7 . . . . 51.83 112.035 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 49.5 t -60.98 -46.28 96.9 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-N 116.024 -0.535 . . . . 39.0 110.773 176.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.92 -37.17 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 N-CA-C 113.4 0.889 . . . . 41.68 113.4 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -44.35 95.83 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 107.97 -1.122 . . . . 65.95 107.97 175.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.5 92.79 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 115.555 -0.748 . . . . 45.61 112.264 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 86.9 mtp -69.08 -30.32 68.62 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.503 0.192 . . . . 42.99 110.487 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 83.9 p -66.52 -29.86 70.05 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.12 0.568 . . . . 60.23 110.736 -170.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.5 mtp-105 -53.03 -37.85 61.9 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 125.679 1.862 . . . . 67.42 108.444 174.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -66.63 -5.38 30.19 Favored Glycine 0 CA--C 1.531 1.092 0 N-CA-C 118.145 2.018 . . . . 61.38 118.145 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' TRP . . . . . 0.484 ' CG ' HD12 ' A' ' 103' ' ' LEU . 0.7 OUTLIER -93.51 -1.29 55.76 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.716 1.258 . . . . 84.57 114.115 174.276 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 19.8 p30 . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 116.131 1.9 . . . . 128.33 116.131 175.406 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HEM . . . . . 1.145 ' CBC' ' HHD' ' A' ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' DIO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.44 ' O ' ' NH2' ' A' ' 102' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . 0.454 ' O ' ' NH1' ' A' ' 102' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . 0.415 ' O ' ' NH1' ' A' ' 102' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo . . . . . 0 N--CA 1.506 2.265 0 N-CA-C 108.466 -1.398 . . . . 63.42 108.466 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.519 ' HA ' HD23 ' A' ' 8' ' ' LEU . 14.2 pt-20 -62.69 -33.73 75.67 Favored 'General case' 0 C--N 1.35 0.596 0 O-C-N 125.599 1.812 . . . . 85.02 109.741 174.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.6 m -63.41 -34.04 76.87 Favored 'General case' 0 C--O 1.215 -0.727 0 C-N-CA 119.268 -0.973 . . . . 70.61 112.171 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . 1.399 ' HG3' ' NH2' ' A' ' 10' ' ' ARG . 12.9 tp10 -70.39 -37.27 74.48 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.407 1.083 . . . . 57.88 112.613 171.477 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 5' ' ' GLU . 0.3 OUTLIER -56.33 -41.94 76.86 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.402 0.281 . . . . 55.03 111.709 173.915 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 25.1 mt -68.2 -52.2 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.102 0 O-C-N 123.609 0.568 . . . . 55.3 110.346 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . 1.399 ' NH2' ' HG3' ' A' ' 7' ' ' GLU . 43.0 mtt85 -48.75 -50.41 34.01 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.232 1.197 . . . . 82.27 114.232 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 7' ' ' GLU . 9.4 tt0 -74.07 -33.22 63.59 Favored 'General case' 0 C--O 1.257 1.493 0 C-N-CA 126.262 1.825 . . . . 62.85 111.479 179.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . 0.465 ' O ' HG12 ' A' ' 15' ' ' VAL . 10.6 p -70.85 -38.39 73.18 Favored 'General case' 0 C--O 1.271 2.202 0 CA-C-O 123.335 1.541 . . . . 47.43 112.747 -176.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.495 ' NE1' ' OG ' ' A' ' 17' ' ' SER . 65.1 t-105 -66.59 -27.7 67.92 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 114.035 -1.439 . . . . 47.04 110.376 -178.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -63.02 -42.06 99.7 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 123.474 1.607 . . . . 63.3 109.862 -175.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 12' ' ' SER . 2.9 p -53.75 -53.65 24.95 Favored 'Isoleucine or valine' 0 C--O 1.257 1.495 0 CA-C-N 113.339 -1.755 . . . . 76.84 112.089 -178.255 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 1.2 m -77.02 -31.19 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 121.371 0.605 . . . . 58.96 112.43 -173.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . 0.495 ' OG ' ' NE1' ' A' ' 13' ' ' TRP . 84.7 p -64.5 -18.96 65.27 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.489 -0.778 . . . . 50.99 112.841 -176.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.57 ' HG2' HH21 ' A' ' 18' ' ' ARG . 2.7 mtt-85 -78.73 -21.93 47.32 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.94 1.296 . . . . 64.91 111.806 -178.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . 0.785 ' OG ' ' CE1' ' A' ' 23' ' ' HIS . 65.4 m -134.45 71.48 71.58 Favored Pre-proline 0 C--O 1.212 -0.912 0 N-CA-C 107.926 -1.138 . . . . 53.59 107.926 178.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.87 -30.01 33.95 Favored 'Trans proline' 0 N--CA 1.445 -1.336 0 O-C-N 123.682 1.359 . . . . 38.92 113.742 -169.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 56.2 tp -73.17 -43.12 61.94 Favored 'General case' 0 C--O 1.195 -1.78 0 C-N-CA 118.961 -1.095 . . . . 36.93 110.929 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -60.93 -43.09 99.11 Favored 'General case' 0 CA--C 1.494 -1.21 0 CA-C-O 121.931 0.872 . . . . 57.83 111.676 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.785 ' CE1' ' OG ' ' A' ' 19' ' ' SER . 43.0 m80 -70.91 -43.57 68.0 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 115.047 -0.978 . . . . 38.47 112.574 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.56 -27.86 71.58 Favored Glycine 0 C--N 1.336 0.552 0 CA-C-O 122.872 1.262 . . . . 24.74 114.41 177.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.0 m -63.08 -43.64 97.97 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 113.463 -1.368 . . . . 25.81 110.396 174.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 65.8 t -54.63 -49.46 67.19 Favored 'Isoleucine or valine' 0 C--N 1.349 0.565 0 CA-C-N 118.286 0.493 . . . . 27.17 111.959 168.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.432 HD23 ' C ' ' A' ' 27' ' ' LEU . 6.0 tt -54.21 -51.43 64.45 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.848 -0.596 . . . . 29.27 111.542 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.279 42.1 m-85 -69.52 -40.54 76.87 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 114.808 1.41 . . . . 30.41 114.808 -177.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.54 -45.72 81.03 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 113.152 0.797 . . . . 23.01 113.152 171.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -60.21 -44.08 95.43 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 112.235 0.457 . . . . 25.4 112.235 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.3 tp -58.29 -44.94 88.74 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 113.29 0.848 . . . . 30.38 113.29 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.614 ' CZ ' HD23 ' A' ' 39' ' ' LEU . 23.3 m-85 -74.83 -28.76 60.83 Favored 'General case' 0 N--CA 1.39 -3.462 0 CA-C-N 118.481 0.582 . . . . 24.69 112.212 -179.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.58 -38.3 90.61 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 122.148 0.975 . . . . 26.93 112.296 172.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 98.6 mt -78.19 -41.71 33.75 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 113.918 1.081 . . . . 30.53 113.918 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -139.6 79.81 23.4 Favored Pre-proline 0 N--CA 1.466 0.337 0 CA-C-O 123.971 1.843 . . . . 42.71 108.254 -172.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -61.6 -23.51 76.56 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 CA-C-N 115.196 -0.68 . . . . 28.85 113.088 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' SER . . . . . 0.418 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 88.4 p -67.75 -11.31 58.14 Favored 'General case' 0 C--O 1.252 1.217 0 N-CA-C 114.086 1.143 . . . . 27.5 114.086 -179.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.0 mt -72.35 -23.04 61.08 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 116.36 1.985 . . . . 30.86 116.36 167.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.614 HD23 ' CZ ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -52.53 -44.93 95.8 Favored Pre-proline 0 C--O 1.185 -2.326 0 O-C-N 121.575 -0.703 . . . . 35.25 112.82 -176.29 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.418 ' HD2' ' O ' ' A' ' 37' ' ' SER . 13.6 Cg_exo -69.33 -9.16 25.51 Favored 'Trans proline' 0 C--N 1.374 1.887 0 N-CA-C 117.749 2.173 . . . . 30.54 117.749 -177.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.716 ' CB ' HBC1 ' A' ' 201' ' ' HEM . 33.7 mt -72.41 -15.76 61.84 Favored 'General case' 0 N--CA 1.424 -1.733 0 N-CA-C 112.95 0.722 . . . . 36.49 112.95 -178.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.434 ' HE2' ' ND1' ' A' ' 64' ' ' HIS . 65.0 m-85 -95.44 98.69 10.74 Favored 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 124.298 1.039 . . . . 53.24 112.821 174.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' A' ' 43' ' ' GLN . 35.7 mm-40 -117.79 53.96 0.92 Allowed 'General case' 0 N--CA 1.432 -1.338 0 O-C-N 128.552 3.657 . . . . 63.15 106.017 -177.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -67.79 126.72 30.29 Favored 'General case' 0 N--CA 1.41 -2.435 0 N-CA-C 103.207 -2.886 . . . . 42.13 103.207 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m120 72.05 29.83 2.28 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 115.643 -0.708 . . . . 83.63 111.182 -176.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 64.84 12.68 54.73 Favored Glycine 0 N--CA 1.477 1.368 0 CA-C-O 118.784 -1.009 . . . . 53.47 114.606 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -108.77 152.17 25.22 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.735 0.779 . . . . 69.72 112.156 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -104.88 134.95 47.14 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 107.167 -1.42 . . . . 42.1 107.167 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -66.2 135.02 53.91 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 108.048 -1.093 . . . . 26.68 108.048 169.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.2 m -77.3 -45.88 24.81 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.149 -0.969 . . . . 32.37 112.868 173.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.8 p -128.11 157.48 73.98 Favored Pre-proline 0 C--O 1.256 1.414 0 O-C-N 122.054 -0.403 . . . . 29.27 110.82 -175.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -54.13 -37.84 87.36 Favored 'Trans proline' 0 C--O 1.203 -1.26 0 N-CA-C 114.365 0.871 . . . . 34.67 114.365 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 22.8 pm0 -67.6 -24.03 65.44 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 117.661 -1.616 . . . . 25.65 111.26 -177.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -58.24 -37.92 75.85 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 113.037 0.754 . . . . 28.37 113.037 174.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 72.2 p -61.62 -38.78 88.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 122.025 0.917 . . . . 27.28 110.433 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.46 -11.71 61.05 Favored 'General case' 0 C--O 1.201 -1.495 0 N-CA-C 114.537 1.31 . . . . 32.46 114.537 -175.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 89.1 p -97.27 0.31 47.89 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 125.391 1.476 . . . . 40.21 111.66 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.5 t -95.34 118.15 66.43 Favored Pre-proline 0 C--O 1.211 -0.959 0 N-CA-C 112.625 0.602 . . . . 26.56 112.625 -174.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -62.28 -31.84 81.99 Favored 'Trans proline' 0 C--O 1.242 0.707 0 C-N-CA 120.783 0.989 . . . . 38.17 113.007 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -66.22 -40.03 90.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 114.777 -1.101 . . . . 51.36 111.32 -176.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -66.55 -41.05 89.28 Favored 'General case' 0 N--CA 1.418 -2.036 0 CA-C-O 120.786 0.327 . . . . 27.57 111.77 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.9 mt -67.02 -35.41 79.86 Favored 'General case' 0 C--O 1.268 2.052 0 N-CA-C 108.411 -0.959 . . . . 30.75 108.411 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -61.18 -40.16 92.89 Favored 'General case' 0 CA--C 1.494 -1.195 0 C-N-CA 119.951 -0.7 . . . . 42.57 111.541 175.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.458 ' CD2' ' NA ' ' A' ' 201' ' ' HEM . 36.7 t-80 -63.59 -39.65 94.93 Favored 'General case' 0 N--CA 1.42 -1.937 0 N-CA-C 112.461 0.541 . . . . 29.52 112.461 176.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.8 mt -51.65 -49.33 35.0 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 C-N-CA 118.754 -1.178 . . . . 31.41 113.756 169.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -55.66 -41.47 73.68 Favored 'General case' 0 C--O 1.254 1.326 0 N-CA-C 112.664 0.616 . . . . 46.12 112.664 175.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.436 ' NZ ' ' O1A' ' A' ' 201' ' ' HEM . 82.5 mttt -61.96 -45.21 94.68 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 123.566 0.542 . . . . 36.23 110.593 176.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.52 HG22 ' C4C' ' A' ' 201' ' ' HEM . 51.5 t -58.38 -46.93 89.14 Favored 'Isoleucine or valine' 0 C--O 1.243 0.753 0 CA-C-O 120.532 0.206 . . . . 31.23 110.62 178.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 87.0 mmm -69.75 -35.62 75.1 Favored 'General case' 0 N--CA 1.415 -2.212 0 N-CA-C 108.763 -0.829 . . . . 35.42 108.763 -174.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.9 tt -67.51 -34.18 76.59 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.683 0.754 . . . . 50.45 112.237 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 70.4 t -66.6 -44.33 89.99 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 O-C-N 120.957 -1.09 . . . . 39.04 113.083 176.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 94.9 mt -55.22 -48.0 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.197 0 C-N-CA 119.402 -0.919 . . . . 37.56 111.608 172.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -55.83 -37.69 69.02 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-O 121.606 0.717 . . . . 47.05 111.193 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.84 -41.39 95.75 Favored 'General case' 0 C--O 1.211 -0.927 0 O-C-N 121.716 -0.615 . . . . 46.53 111.109 178.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.65 -40.97 98.71 Favored 'General case' 0 C--O 1.253 1.281 0 N-CA-C 113.429 0.9 . . . . 42.81 113.429 174.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 76.3 t -61.28 -46.98 95.53 Favored 'Isoleucine or valine' 0 C--O 1.25 1.115 0 CA-C-N 115.864 -0.607 . . . . 49.53 109.617 176.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 8.0 m -53.05 -42.67 66.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.992 -0.549 . . . . 62.18 110.732 176.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -102.85 23.89 11.48 Favored 'General case' 0 C--O 1.253 1.256 0 N-CA-C 115.157 1.54 . . . . 55.57 115.157 -177.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 10.9 p -54.14 -35.72 30.2 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.641 0 N-CA-C 113.358 0.873 . . . . 52.35 113.358 -173.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.989 ' OE1' ' OD1' ' A' ' 81' ' ' ASP . 1.8 pm0 -71.17 -24.95 62.34 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.889 -1.05 . . . . 75.16 112.191 178.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.989 ' OD1' ' OE1' ' A' ' 80' ' ' GLU . 0.0 OUTLIER -157.21 104.36 2.05 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.056 0.455 . . . . 81.22 110.263 177.953 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.4 ' H ' ' HB2' ' A' ' 81' ' ' ASP . 1.7 tp -89.89 -10.81 43.86 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.271 -0.877 . . . . 86.51 112.62 163.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.3 p -54.54 -29.0 49.56 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 106.095 -1.817 . . . . 74.49 106.095 161.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.5 t -62.04 -18.38 60.43 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 113.253 -1.794 . . . . 63.88 113.577 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.2 mt -100.55 1.63 41.12 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 120.504 -1.373 . . . . 58.81 113.168 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -50.84 -48.92 59.81 Favored 'General case' 0 C--O 1.26 1.612 0 CA-C-N 114.864 -1.062 . . . . 73.26 112.289 -174.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 58.4 mp0 -75.21 -41.57 57.45 Favored 'General case' 0 C--O 1.26 1.632 0 CA-C-N 114.893 -1.049 . . . . 85.21 109.397 -171.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -55.45 -43.92 75.9 Favored 'General case' 0 N--CA 1.518 2.961 0 CA-C-N 114.623 -1.171 . . . . 47.69 111.539 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 86.3 mt -74.07 -34.96 64.2 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 109.753 -0.462 . . . . 46.6 109.753 -177.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.7 m -60.34 -40.13 89.59 Favored 'General case' 0 C--O 1.271 2.225 0 C-N-CA 117.536 -1.665 . . . . 52.61 110.914 179.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 91.5 p -73.64 -37.8 65.21 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 114.331 -1.304 . . . . 53.31 111.77 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.629 HD11 ' C3A' ' A' ' 201' ' ' HEM . 18.5 tp -56.8 -40.3 75.68 Favored 'General case' 0 C--O 1.249 1.027 0 O-C-N 124.369 1.043 . . . . 41.21 111.421 171.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.79 -41.68 99.81 Favored Glycine 0 C--O 1.29 3.635 0 C-N-CA 120.458 -0.877 . . . . 48.42 114.485 174.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -64.82 -40.14 94.73 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 108.649 -0.871 . . . . 67.19 108.649 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -55.47 -47.0 76.81 Favored 'General case' 0 C--O 1.199 -1.572 0 CA-C-O 121.884 0.849 . . . . 54.4 112.423 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.826 ' CE1' ' C1B' ' A' ' 201' ' ' HEM . 61.3 m80 -71.39 -31.13 66.93 Favored 'General case' 0 C--O 1.273 2.299 0 N-CA-C 113.066 0.765 . . . . 41.49 113.066 -178.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 148' ' ' TRP . 11.0 ttt-85 -60.31 -43.74 96.08 Favored 'General case' 0 C--O 1.265 1.905 0 N-CA-C 107.095 -1.446 . . . . 94.83 107.095 176.538 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.59 -35.21 80.24 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.91 -1.95 . . . . 48.06 114.238 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.7 m -83.33 -15.72 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.65 0 CA-C-O 122.094 0.949 . . . . 53.03 110.933 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.44 15.48 8.21 Favored Glycine 0 C--O 1.272 2.511 0 O-C-N 121.411 -0.806 . . . . 44.17 113.381 165.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 96' ' ' HIS . 47.9 t -79.48 131.86 33.3 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 N-CA-C 108.953 -0.758 . . . . 65.13 108.953 174.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.454 ' NH1' ' O ' ' A' ' 309' ' ' HOH . 1.2 mtt85 -83.88 142.97 30.2 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 107.925 -1.139 . . . . 69.33 107.925 174.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.484 HD12 ' CG ' ' A' ' 148' ' ' TRP . 0.8 OUTLIER -60.18 -34.3 73.4 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 121.185 -0.947 . . . . 55.59 108.672 -178.52 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.8 p -52.38 -34.76 49.33 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 115.443 -0.798 . . . . 67.08 112.056 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 65.7 m -67.85 -11.95 59.65 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.064 1.505 . . . . 41.48 115.064 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.9 -38.13 78.19 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.296 -0.878 . . . . 41.74 112.792 177.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 69.2 p -65.6 -38.13 88.59 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.5 -0.75 . . . . 46.85 111.609 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 3.5 m -63.48 -37.7 88.3 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-O 119.086 -0.483 . . . . 43.71 112.104 173.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 84.8 t -62.19 -42.73 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.819 0 CA-C-O 121.203 0.525 . . . . 34.43 111.015 173.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -56.87 -49.44 71.0 Favored Glycine 0 CA--C 1.508 -0.404 0 CA-C-N 115.219 -0.9 . . . . 32.22 113.19 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -61.35 -34.95 76.14 Favored 'General case' 0 C--O 1.262 1.735 0 CA-C-N 114.258 -0.971 . . . . 52.99 110.508 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 54.4 m -70.86 -40.77 72.13 Favored 'General case' 0 CA--C 1.561 1.393 0 CA-C-O 123.445 1.593 . . . . 26.4 111.907 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 tp -58.01 -48.77 79.05 Favored 'General case' 0 N--CA 1.427 -1.581 0 O-C-N 120.383 -1.448 . . . . 31.76 113.949 171.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.7 mt -63.86 -36.93 85.55 Favored 'General case' 0 C--O 1.255 1.37 0 CA-C-N 114.542 -1.208 . . . . 48.82 107.962 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -62.31 -48.45 79.78 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 122.118 0.961 . . . . 31.38 110.064 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' MET . . . . . 0.656 ' CE ' ' HB3' ' A' ' 23' ' ' HIS . 18.7 tmm? -62.42 -41.55 98.78 Favored 'General case' 0 N--CA 1.44 -0.925 0 O-C-N 121.578 -0.702 . . . . 53.15 110.6 -177.483 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.6 mt -63.7 -45.74 88.62 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.081 -0.387 . . . . 34.83 111.379 176.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -58.32 -48.63 79.91 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-O 118.309 -0.853 . . . . 58.79 109.472 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -65.62 -34.41 78.15 Favored 'General case' 0 C--O 1.195 -1.806 0 CA-C-O 117.679 -1.153 . . . . 42.26 111.343 -177.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.2 m -77.03 -37.74 54.29 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.002 0.814 . . . . 39.11 112.183 -178.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.658 HD12 ' CD1' ' A' ' 125' ' ' PHE . 70.8 mt -91.79 -20.0 21.97 Favored 'General case' 0 C--O 1.262 1.739 0 N-CA-C 113.833 1.049 . . . . 47.69 113.833 -173.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 54.29 -127.92 40.27 Favored Glycine 0 C--O 1.247 0.961 0 CA-C-O 118.827 -0.985 . . . . 53.53 110.925 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -48.9 -37.59 36.8 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 O-C-N 123.26 1.137 . . . . 63.45 112.925 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -67.23 -9.06 36.6 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 118.281 2.697 . . . . 68.72 118.281 -176.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.658 ' CD1' HD12 ' A' ' 121' ' ' LEU . 14.3 t80 -86.91 72.7 10.08 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 124.257 1.979 . . . . 49.32 107.905 179.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 63.8 p -72.63 162.11 75.84 Favored Pre-proline 0 C--O 1.248 1.01 0 CA-C-N 113.011 -1.904 . . . . 53.41 111.051 -178.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -62.54 -24.13 75.12 Favored 'Trans proline' 0 CA--C 1.569 2.247 0 C-N-CA 116.059 -2.161 . . . . 54.14 115.288 -178.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -72.38 -30.75 64.97 Favored 'General case' 0 C--O 1.244 0.804 0 N-CA-C 106.493 -1.669 . . . . 47.66 106.493 177.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 94.6 m -68.85 -46.58 68.14 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 115.169 -0.923 . . . . 52.13 109.669 179.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 54.4 ttt-85 -55.73 -46.17 77.81 Favored 'General case' 0 C--O 1.272 2.246 0 O-C-N 121.504 -0.748 . . . . 83.13 112.782 173.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 55.1 m -63.88 -43.24 96.63 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-N 114.069 -1.423 . . . . 47.06 111.113 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.488 ' HB2' ' HG2' ' A' ' 5' ' ' GLU . . . -58.16 -49.72 76.03 Favored 'General case' 0 C--O 1.268 2.027 0 O-C-N 124.07 0.856 . . . . 42.63 112.483 177.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 61.7 m95 -66.16 -34.51 78.2 Favored 'General case' 0 C--O 1.257 1.453 0 CA-C-N 114.676 -1.147 . . . . 38.41 113.087 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 m -63.72 -40.91 97.93 Favored 'General case' 0 C--O 1.279 2.621 0 N-CA-C 108.35 -0.982 . . . . 41.01 108.35 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . 0.324 2.7 mtp-105 -67.04 -46.65 73.78 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 116.885 -1.926 . . . . 75.39 111.389 -176.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 24.3 tp -59.95 -52.86 63.59 Favored 'General case' 0 C--O 1.195 -1.788 0 N-CA-C 114.047 1.128 . . . . 44.19 114.047 171.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -59.59 -39.88 85.6 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 108.021 -1.103 . . . . 41.35 108.021 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -63.92 -35.72 92.36 Favored Glycine 0 N--CA 1.465 0.59 0 N-CA-C 110.38 -1.088 . . . . 42.06 110.38 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.13 -42.05 89.67 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 114.801 -0.7 . . . . 51.83 112.035 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 49.5 t -60.98 -46.28 96.9 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-N 116.024 -0.535 . . . . 39.0 110.773 176.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.92 -37.17 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 N-CA-C 113.4 0.889 . . . . 41.68 113.4 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -44.35 95.83 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 107.97 -1.122 . . . . 65.95 107.97 175.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.5 92.79 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 115.555 -0.748 . . . . 45.61 112.264 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 86.9 mtp -69.08 -30.32 68.62 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.503 0.192 . . . . 42.99 110.487 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 83.9 p -66.52 -29.86 70.05 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.12 0.568 . . . . 60.23 110.736 -170.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.5 mtp-105 -53.03 -37.85 61.9 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 125.679 1.862 . . . . 67.42 108.444 174.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -66.63 -5.38 30.19 Favored Glycine 0 CA--C 1.531 1.092 0 N-CA-C 118.145 2.018 . . . . 61.38 118.145 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.484 ' CG ' HD12 ' A' ' 103' ' ' LEU . 0.7 OUTLIER -93.51 -1.29 55.76 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.716 1.258 . . . . 84.57 114.115 174.276 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 19.8 p30 . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 116.131 1.9 . . . . 128.33 116.131 175.406 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HEM . . . . . 1.145 ' CBC' ' HHD' ' A' ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' DIO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.44 ' O ' ' NH2' ' A' ' 102' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . 0.454 ' O ' ' NH1' ' A' ' 102' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . 0.415 ' O ' ' NH1' ' A' ' 102' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_