data_3dsg_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3dsg _Structure_validation_residue.Date_analyzed 2016-10-12 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 ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.229 0 CA-C-O 114.876 -2.487 . . . . 83.55 107.605 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.8 164.19 36.52 Favored Glycine 0 N--CA 1.409 -3.15 0 N-CA-C 120.636 3.014 . . . . 76.73 120.636 163.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.2 mt -98.18 142.73 14.07 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.934 0 C-N-CA 114.871 -2.732 . . . . 71.71 104.52 -178.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 26.5 tp -107.16 114.37 28.39 Favored 'General case' 1 C--N 1.244 -4.005 0 O-C-N 127.239 2.837 . . . . 64.16 108.749 172.854 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.0 137.2 32.54 Favored 'General case' 0 C--N 1.28 -2.421 0 N-CA-C 121.165 3.765 . . . . 56.43 121.165 177.658 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.378 25.9 tp -136.14 105.85 6.18 Favored 'General case' 0 N--CA 1.415 -2.195 1 C-N-CA 133.601 4.76 . . . . 50.26 119.394 171.141 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -113.54 122.57 47.65 Favored 'General case' 0 N--CA 1.515 2.794 0 C-N-CA 116.411 -2.116 . . . . 50.23 106.333 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . 0.369 5.3 mt -103.25 106.42 16.94 Favored 'General case' 0 C--N 1.244 -3.988 0 C-N-CA 128.742 2.817 . . . . 52.64 113.719 -179.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . 1.084 ' N ' ' O ' ' A' ' 492' ' ' HOH 0.474 2.6 tptm -56.44 -40.11 74.23 Favored 'General case' 0 C--N 1.288 -2.09 0 N-CA-C 119.552 3.167 . . . . 67.85 119.552 177.063 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -150.52 -178.61 6.64 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 118.226 -2.796 . . . . 59.29 110.319 -174.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -65.26 -24.99 67.47 Favored 'General case' 0 N--CA 1.405 -2.676 0 C-N-CA 129.375 3.07 . . . . 68.55 115.289 175.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.56 -41.53 46.11 Favored 'General case' 0 C--O 1.16 -3.626 1 CA-C-O 131.505 5.431 . . . . 54.31 106.688 179.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . 0.518 . . -62.59 -41.82 99.19 Favored 'General case' 0 C--N 1.279 -2.49 1 O-C-N 111.226 -7.171 . . . . 49.64 118.211 174.875 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . 0.289 30.5 tp -53.25 -58.99 5.14 Favored 'General case' 0 N--CA 1.406 -2.647 0 C-N-CA 127.673 2.389 . . . . 48.44 111.489 166.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.283 41.1 t80 -54.01 -44.42 70.88 Favored 'General case' 0 C--N 1.284 -2.245 1 C-N-CA 132.251 4.22 . . . . 51.3 112.23 -178.372 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . 0.593 1.3 p -72.25 -33.75 67.74 Favored 'General case' 0 C--N 1.271 -2.816 0 N-CA-C 121.006 3.706 . . . . 55.63 121.006 170.925 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.443 . . -69.37 -44.81 70.79 Favored 'General case' 0 C--O 1.195 -1.776 0 N-CA-C 116.786 2.143 . . . . 47.6 116.786 173.261 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . 0.384 29.0 t80 -57.56 133.75 55.53 Favored 'General case' 0 C--N 1.276 -2.607 0 CA-C-O 126.184 2.897 . . . . 48.81 113.157 -175.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' MSE . . . . . 1.078 ' CG ' ' O ' ' A' ' 203' ' ' HOH . 70.1 mtp -121.18 82.1 37.47 Favored Pre-proline 0 C--O 1.172 -2.989 1 O-C-N 110.96 -7.337 . . . . 57.81 105.984 -179.644 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.39 -24.55 75.74 Favored 'Trans proline' 0 N--CA 1.433 -2.082 0 C-N-CA 123.006 2.47 . . . . 46.79 117.269 -175.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -72.94 -8.81 57.38 Favored 'General case' 0 C--N 1.278 -2.531 0 C-N-CA 129.43 3.092 . . . . 42.02 115.771 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . 0.359 41.6 t -76.81 123.52 33.42 Favored 'Isoleucine or valine' 0 C--N 1.26 -3.299 0 C-N-CA 129.803 3.241 . . . . 45.16 115.768 171.323 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -56.08 137.42 51.32 Favored 'General case' 0 C--O 1.193 -1.87 0 O-C-N 117.253 -3.404 . . . . 63.55 107.106 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.3 m 77.79 -0.25 2.74 Favored 'General case' 1 C--O 1.135 -4.962 1 CA-C-O 133.33 6.3 . . . . 48.59 112.365 179.198 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.31 150.21 20.23 Favored Glycine 0 N--CA 1.4 -3.709 1 O-C-N 107.311 -9.618 . . . . 44.66 115.904 -170.814 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -156.77 174.82 34.45 Favored Glycine 0 C--O 1.206 -1.635 0 C-N-CA 115.365 -3.302 . . . . 40.77 107.403 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . 0.348 13.3 tt -151.22 142.45 16.29 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.45 0 CA-C-N 120.59 2.195 . . . . 39.43 113.302 -174.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -89.01 133.29 34.38 Favored 'General case' 0 C--N 1.29 -1.982 0 O-C-N 119.287 -2.133 . . . . 45.06 109.373 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.9 t -125.89 113.89 24.49 Favored Pre-proline 0 C--N 1.259 -3.369 0 CA-C-N 121.705 2.048 . . . . 46.76 109.987 -174.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.8 139.43 74.59 Favored 'Trans proline' 0 C--N 1.399 3.227 1 C-N-CA 111.123 -5.451 . . . . 54.98 117.008 170.917 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.6 t -179.06 138.85 0.34 Allowed Pre-proline 0 C--O 1.168 -3.23 1 C-N-CA 132.317 4.247 . . . . 60.82 112.923 178.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -93.02 -5.07 3.11 Favored 'Trans proline' 0 C--N 1.399 3.195 3 C-N-CA 108.956 -6.896 . . . . 65.57 112.465 171.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . 0.866 ' CD ' ' O ' ' A' ' 654' ' ' HOH . 13.5 mttp -57.42 161.77 3.23 Favored 'General case' 0 C--N 1.259 -3.345 0 CA-C-N 122.174 2.261 . . . . 71.62 108.636 170.386 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 -111.6 117.69 33.65 Favored 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 130.34 3.456 . . . . 79.05 107.092 -175.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -122.35 152.84 39.73 Favored 'General case' 1 C--O 1.14 -4.704 0 O-C-N 128.502 3.626 . . . . 65.59 109.289 -174.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' MSE . . . . . . . . . . . . . 87.5 mtp -112.61 153.89 26.87 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 117.526 -3.233 . . . . 82.41 111.421 173.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.56 140.62 58.65 Favored 'General case' 0 C--O 1.186 -2.265 0 CA-C-O 115.106 -2.378 . . . . 55.44 104.744 -178.554 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.83 4.1 52.96 Favored Glycine 1 N--CA 1.396 -4.026 2 O-C-N 131.63 5.581 . . . . 51.64 114.929 -172.133 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.45 155.54 11.87 Favored 'General case' 0 N--CA 1.415 -2.199 0 CA-C-N 121.343 2.572 . . . . 52.35 112.452 166.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -88.41 126.4 35.2 Favored 'General case' 0 N--CA 1.421 -1.905 1 C-N-CA 132.633 4.373 . . . . 68.16 108.723 166.817 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.5 p -126.45 137.49 57.62 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.107 0 O-C-N 126.198 2.187 . . . . 53.94 108.283 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -95.37 118.57 32.35 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 119.825 1.193 . . . . 51.27 108.85 172.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -108.26 127.73 54.1 Favored 'General case' 0 C--N 1.266 -3.031 0 N-CA-C 107.762 -1.199 . . . . 48.89 107.762 -176.511 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.3 tp -103.36 113.56 27.15 Favored 'General case' 0 C--N 1.289 -2.039 0 CA-C-O 118.093 -0.956 . . . . 48.25 112.329 160.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -107.97 115.99 31.13 Favored 'General case' 0 C--N 1.262 -3.228 0 C-N-CA 129.469 3.108 . . . . 50.73 114.319 -166.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . 0.536 ' OG1' ' O ' ' A' ' 204' ' ' HOH . 0.7 OUTLIER -107.44 118.55 37.02 Favored 'General case' 0 C--O 1.189 -2.099 0 CA-C-N 120.239 1.381 . . . . 48.93 114.651 170.42 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . 0.469 ' O ' ' C ' ' A' ' 55' ' ' PRO 0.252 0.0 OUTLIER -80.57 135.83 52.68 Favored Pre-proline 0 C--N 1.257 -3.414 1 C-N-CA 134.667 5.187 . . . . 56.33 114.148 -178.662 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PRO . . . . . 0.469 ' C ' ' O ' ' A' ' 54' ' ' LEU . 10.6 Cg_exo -42.42 130.97 5.06 Favored 'Trans proline' 1 C--N 1.438 5.237 1 C-N-CA 106.766 -8.356 . . . . 63.15 114.484 -179.561 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . 0.56 2.9 t70 66.4 17.54 10.69 Favored 'General case' 0 N--CA 1.422 -1.841 0 O-C-N 118.158 -2.839 . . . . 73.63 116.181 166.139 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.8 p -101.77 166.87 10.44 Favored 'General case' 0 C--O 1.206 -1.195 0 O-C-N 117.255 -3.403 . . . . 69.34 108.916 170.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.3 p -114.39 16.84 17.73 Favored 'General case' 1 C--O 1.132 -5.081 0 CA-C-O 127.607 3.575 . . . . 67.58 108.919 179.925 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.59 146.22 50.6 Favored 'General case' 0 C--N 1.286 -2.195 1 O-C-N 100.444 -13.91 . . . . 70.64 109.806 -173.179 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.6 mtt85 -112.53 119.44 38.2 Favored 'General case' 0 C--N 1.278 -2.514 1 C-N-CA 135.01 5.324 . . . . 65.14 108.38 174.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.419 6.4 mt -92.39 105.61 14.89 Favored Pre-proline 0 C--N 1.262 -3.233 1 C-N-CA 137.992 6.517 . . . . 52.7 115.89 -176.071 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -81.3 136.3 9.96 Favored 'Trans proline' 1 C--N 1.423 4.463 1 C-N-CA 109.059 -6.827 . . . . 48.22 107.412 -177.611 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.8 t -128.98 132.89 66.96 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.057 0 C-N-CA 128.955 2.902 . . . . 44.85 108.532 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -102.29 81.78 2.11 Favored 'General case' 0 C--N 1.274 -2.678 0 C-N-CA 131.566 3.946 . . . . 44.44 107.935 -179.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -104.24 174.9 22.52 Favored Glycine 0 C--O 1.191 -2.58 0 C-N-CA 113.966 -3.969 . . . . 45.24 110.375 -160.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -126.51 137.21 53.35 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 119.191 -1.003 . . . . 55.47 109.065 176.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.64 123.78 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.652 0 CA-C-O 117.477 -1.249 . . . . 45.91 110.868 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . 0.471 17.1 m -120.18 -9.8 10.55 Favored 'Isoleucine or valine' 0 C--N 1.263 -3.169 0 N-CA-C 118.021 2.6 . . . . 49.96 118.021 -175.764 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' TRP . . . . . . . . . . . . . 7.2 t-105 -173.33 136.48 0.62 Allowed 'General case' 0 N--CA 1.485 1.296 0 CA-C-N 113.598 -1.637 . . . . 68.4 112.529 -168.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.5 p -123.03 140.03 53.46 Favored 'General case' 0 C--O 1.182 -2.458 0 CA-C-O 128.152 3.834 . . . . 66.41 109.173 -177.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.1 m -116.63 97.34 50.07 Favored Pre-proline 0 C--N 1.284 -2.281 1 O-C-N 114.002 -5.436 . . . . 75.52 102.838 178.052 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo . . . . . 0 C--O 1.259 1.545 0 CA-C-O 124.322 1.717 . . . . 81.42 113.859 165.296 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 114.141 1.163 . . . . 83.24 114.141 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . 0.469 ' NH2' ' O ' ' A' ' 449' ' ' HOH 0.402 0.0 OUTLIER 58.47 112.4 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.184 0 CA-C-O 127.344 3.449 . . . . 87.83 116.537 -164.314 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -88.11 156.09 19.45 Favored 'General case' 0 C--N 1.3 -1.551 0 C-N-CA 130.903 3.681 . . . . 73.28 117.234 -172.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.68 140.34 51.47 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-O 115.115 -2.374 . . . . 63.45 104.951 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 161.81 -155.58 26.87 Favored Glycine 0 N--CA 1.403 -3.523 2 C-N-CA 137.773 7.368 . . . . 56.14 125.204 -177.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 11.1 pt -138.73 147.98 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.777 0 O-C-N 119.894 -1.945 . . . . 47.99 114.511 -166.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -93.35 113.54 4.5 Favored Glycine 1 C--O 1.137 -5.96 0 C-N-CA 130.305 3.812 . . . . 40.34 108.263 172.01 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . 0.299 61.9 t -102.99 117.52 48.51 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.426 0 C-N-CA 129.922 3.289 . . . . 40.32 111.317 -176.729 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -90.6 136.47 33.04 Favored 'General case' 0 C--O 1.19 -2.063 0 CA-C-O 116.842 -1.551 . . . . 45.36 110.576 174.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.341 22.4 m-30 -68.28 143.98 96.24 Favored Pre-proline 0 C--N 1.276 -2.603 0 C-N-CA 130.027 3.331 . . . . 46.32 109.907 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.63 147.65 64.19 Favored 'Trans proline' 0 C--N 1.27 -3.561 1 O-C-N 109.041 -6.347 . . . . 51.92 111.896 175.721 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.2 p30 -76.51 154.85 34.24 Favored 'General case' 0 C--O 1.202 -1.439 0 O-C-N 119.456 -2.028 . . . . 68.01 111.551 172.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 108.31 -173.86 18.35 Favored Glycine 0 C--O 1.169 -3.94 0 C-N-CA 117.933 -2.079 . . . . 67.34 109.423 -172.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.65 -55.18 3.22 Favored 'Trans proline' 1 C--N 1.429 4.813 3 CA-C-N 102.469 -6.865 . . . . 68.75 115.196 -172.072 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.64 -26.46 33.13 Favored 'General case' 0 C--N 1.257 -3.444 1 C-N-CA 132.741 4.416 . . . . 81.17 115.006 -176.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -89.25 -48.06 3.9 Favored Glycine 0 C--N 1.268 -3.243 1 C-N-CA 132.621 4.915 . . . . 67.08 110.277 -178.638 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . 0.346 3.3 mm-40 -55.69 -32.21 63.08 Favored 'General case' 0 N--CA 1.419 -2.009 0 N-CA-C 117.495 2.405 . . . . 73.69 117.495 167.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.5 -45.26 76.34 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 115.307 1.595 . . . . 60.52 115.307 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . 0.447 6.4 t -60.31 -50.95 78.27 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.95 1 C-N-CA 131.866 4.066 . . . . 59.08 111.633 171.618 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -55.55 -44.07 76.44 Favored 'General case' 0 C--N 1.29 -2.008 1 CA-C-O 128.845 4.164 . . . . 74.77 108.35 -179.579 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . 0.537 7.1 m-80 -78.15 -38.94 42.5 Favored 'General case' 0 N--CA 1.416 -2.133 0 O-C-N 118.462 -2.649 . . . . 67.34 111.702 -172.958 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.2 mttm -56.25 -41.07 75.17 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 115.827 -2.349 . . . . 68.02 113.637 171.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 45.0 mt -63.87 -46.18 94.96 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.211 0 CA-C-O 125.789 2.709 . . . . 62.85 109.316 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -68.06 -42.01 81.13 Favored 'General case' 0 C--O 1.195 -1.786 0 CA-C-N 112.544 -2.116 . . . . 71.45 106.449 -164.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . 0.452 0.6 OUTLIER -58.71 -43.57 90.14 Favored 'General case' 0 C--N 1.257 -3.422 0 O-C-N 127.378 2.924 . . . . 69.89 109.86 178.437 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -35.83 78.54 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 117.781 -1.104 . . . . 66.96 110.92 172.194 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.3 mt -97.05 -0.78 46.64 Favored 'General case' 0 C--N 1.273 -2.724 0 O-C-N 117.99 -2.944 . . . . 69.17 116.214 -170.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.83 115.36 2.54 Favored 'General case' 0 C--N 1.293 -1.855 0 C-N-CA 129.484 3.114 . . . . 74.09 109.532 -177.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.462 -3.23 1 CA-C-O 133.504 7.169 . . . . 78.18 114.231 -162.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 . . . . . 0 N--CA 1.498 1.974 0 CA-C-O 120.358 0.123 . . . . 84.32 111.307 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 67.22 -173.88 27.76 Favored Glycine 0 C--N 1.342 0.889 0 CA-C-O 121.505 0.503 . . . . 75.8 113.65 -171.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 96.6 mt -86.38 124.33 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-O 122.174 0.988 . . . . 68.9 110.883 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 tp -93.88 123.16 37.05 Favored 'General case' 0 N--CA 1.42 -1.958 0 CA-C-N 114.508 -1.223 . . . . 62.5 108.185 169.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 1.8 t -106.48 150.01 26.52 Favored 'General case' 0 C--N 1.288 -2.09 0 C-N-CA 117.563 -1.655 . . . . 56.86 113.218 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 tp -145.42 111.98 5.83 Favored 'General case' 0 N--CA 1.418 -2.072 0 C-N-CA 127.828 2.451 . . . . 51.63 114.154 169.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -114.11 123.34 49.39 Favored 'General case' 0 C--O 1.194 -1.862 0 O-C-N 120.452 -1.405 . . . . 52.19 109.45 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.4 mt -105.25 111.84 24.73 Favored 'General case' 0 C--N 1.289 -2.06 0 O-C-N 124.252 0.97 . . . . 55.02 109.423 -170.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LYS . . . . . 0.941 ' N ' ' O ' ' B' ' 482' ' ' HOH . 43.2 tttm -67.55 -35.21 78.62 Favored 'General case' 1 C--O 1.152 -4.044 1 CA-C-O 140.794 9.854 . . . . 68.37 117.666 -174.865 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 p30 -150.17 173.86 13.44 Favored 'General case' 0 C--N 1.292 -1.893 1 O-C-N 98.044 -15.41 . . . . 64.45 117.053 -177.254 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -62.59 -29.02 70.29 Favored 'General case' 0 N--CA 1.415 -2.205 0 O-C-N 119.314 -2.116 . . . . 70.65 111.159 -173.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.86 97.89 Favored 'General case' 0 C--N 1.257 -3.445 0 C-N-CA 118.112 -1.435 . . . . 57.43 109.099 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ALA . . . . . 0.558 ' O ' ' O ' ' B' ' 403' ' ' HOH 0.57 . . -72.79 -36.68 67.66 Favored 'General case' 0 C--N 1.253 -3.591 0 CA-C-N 112.819 -1.991 . . . . 51.55 111.848 -171.763 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . 0.402 22.9 tp -52.14 -55.21 22.41 Favored 'General case' 0 N--CA 1.41 -2.457 0 O-C-N 125.531 1.769 . . . . 52.7 113.964 164.841 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -56.92 -41.72 78.68 Favored 'General case' 1 C--N 1.243 -4.039 0 C-N-CA 128.305 2.642 . . . . 55.6 109.003 -173.863 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . 0.579 1.0 OUTLIER -79.49 -37.27 37.15 Favored 'General case' 0 C--N 1.265 -3.075 0 O-C-N 126.907 2.629 . . . . 54.1 115.762 -175.674 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . 0.426 . . -69.65 -37.77 76.87 Favored 'General case' 0 C--O 1.19 -2.036 0 C-N-CA 128.433 2.693 . . . . 48.21 117.716 175.802 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . 0.45 14.7 t80 -60.03 129.82 43.67 Favored 'General case' 0 N--CA 1.41 -2.465 0 C-N-CA 130.4 3.48 . . . . 48.61 116.15 177.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' MSE . . . . . 1.063 ' CG ' ' O ' ' B' ' 350' ' ' HOH . 57.8 mtp -121.62 82.38 40.85 Favored Pre-proline 0 C--N 1.317 -0.822 1 O-C-N 114.663 -5.023 . . . . 56.76 106.468 -178.682 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -63.02 -19.14 68.36 Favored 'Trans proline' 0 N--CA 1.44 -1.642 1 C-N-CA 125.99 4.46 . . . . 46.97 116.327 -176.733 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . 0.271 13.3 p90 -73.17 -20.84 60.81 Favored 'General case' 1 C--N 1.232 -4.512 0 C-N-CA 129.99 3.316 . . . . 43.49 118.861 176.682 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . 0.285 57.0 t -75.82 133.81 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.393 0 C-N-CA 125.897 1.679 . . . . 47.49 112.152 176.333 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -54.21 126.7 23.96 Favored 'General case' 0 C--N 1.283 -2.309 0 C-N-CA 127.886 2.474 . . . . 65.83 108.173 173.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 44.7 m 69.13 16.76 8.55 Favored 'General case' 0 C--N 1.288 -2.092 0 C-N-CA 128.647 2.779 . . . . 55.08 111.199 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 80.57 157.1 14.76 Favored Glycine 1 C--O 1.167 -4.088 0 O-C-N 119.807 -1.808 . . . . 45.55 116.313 -172.145 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -158.69 176.77 35.53 Favored Glycine 0 N--CA 1.414 -2.802 0 CA-C-O 118.675 -1.069 . . . . 40.51 111.191 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 11.0 tt -164.24 144.93 2.28 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.084 0 C-N-CA 128.781 2.832 . . . . 40.83 111.993 -174.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -100.52 117.51 34.82 Favored 'General case' 0 C--N 1.279 -2.475 0 C-N-CA 131.542 3.937 . . . . 46.2 109.024 -173.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 65.5 t -116.05 113.74 41.58 Favored Pre-proline 0 C--N 1.278 -2.531 0 O-C-N 125.795 1.934 . . . . 47.5 108.474 -169.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -62.9 129.39 25.88 Favored 'Trans proline' 0 C--N 1.39 2.717 0 C-N-CA 124.158 3.239 . . . . 54.81 110.572 174.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . 0.267 13.1 t -167.91 142.76 3.02 Favored Pre-proline 0 C--O 1.17 -3.096 1 C-N-CA 133.701 4.8 . . . . 64.5 113.651 176.894 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -104.02 11.86 0.28 Allowed 'Trans proline' 0 C--N 1.39 2.738 3 CA-C-N 104.995 -4.323 . . . . 70.09 109.911 173.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -76.46 158.94 30.87 Favored 'General case' 0 C--N 1.249 -3.778 0 CA-C-N 120.69 1.586 . . . . 77.86 109.438 168.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . 0.284 5.8 mtm180 -107.25 141.43 38.58 Favored 'General case' 0 N--CA 1.428 -1.532 0 C-N-CA 118.647 -1.221 . . . . 88.04 109.024 -179.851 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' TYR . . . . . 1.002 ' OH ' ' O ' ' B' ' 638' ' ' HOH 0.278 88.2 m-85 -141.83 143.17 33.26 Favored 'General case' 0 C--O 1.19 -2.055 1 C-N-CA 134.971 5.308 . . . . 66.83 111.612 -165.87 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' MSE . . . . . . . . . . . . . 71.4 mtp -107.4 150.33 26.87 Favored 'General case' 0 C--N 1.252 -3.643 0 O-C-N 118.584 -2.573 . . . . 84.69 111.7 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.35 125.32 21.39 Favored 'General case' 0 C--O 1.198 -1.625 0 CA-C-O 116.478 -1.725 . . . . 55.1 108.383 175.352 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 103.43 -7.52 51.01 Favored Glycine 0 N--CA 1.408 -3.209 1 C-N-CA 131.556 4.408 . . . . 51.94 109.797 170.16 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . 0.252 71.5 m-20 -57.23 132.9 54.39 Favored 'General case' 0 C--N 1.268 -2.972 0 O-C-N 125.238 1.199 . . . . 55.0 111.244 171.53 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -52.36 122.2 8.32 Favored 'General case' 0 N--CA 1.405 -2.708 1 C-N-CA 137.883 6.473 . . . . 68.27 110.402 153.439 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.45 142.41 42.67 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.53 0 C-N-CA 113.139 -3.424 . . . . 54.09 107.485 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -99.04 120.29 39.22 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-O 123.884 1.802 . . . . 50.36 108.006 172.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.1 tp -112.58 135.82 52.85 Favored 'General case' 1 CA--C 1.344 -6.969 0 CA-C-N 113.252 -1.795 . . . . 49.6 110.991 177.282 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.63 115.99 27.35 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 128.023 3.327 . . . . 49.76 110.597 168.63 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 23.4 tp -120.05 123.85 44.44 Favored 'General case' 0 N--CA 1.421 -1.886 0 CA-C-N 114.759 -1.11 . . . . 46.62 113.206 -166.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . 0.29 0.3 OUTLIER -102.55 114.18 28.18 Favored 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 130.651 3.58 . . . . 51.47 118.137 167.852 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 58.5 mt -78.93 141.48 59.03 Favored Pre-proline 0 C--O 1.172 -3.003 1 C-N-CA 137.062 6.145 . . . . 57.56 110.823 177.912 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' PRO . . . . . 0.473 ' O ' ' C ' ' B' ' 56' ' ' ASP . 51.9 Cg_exo -51.34 137.81 47.0 Favored 'Trans proline' 1 C--N 1.43 4.82 3 C-N-CA 108.614 -7.124 . . . . 64.01 117.087 -176.739 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ASP . . . . . 0.473 ' C ' ' O ' ' B' ' 55' ' ' PRO 0.342 0.3 OUTLIER 45.82 34.46 1.88 Allowed 'General case' 0 N--CA 1.418 -2.036 2 O-C-N 108.081 -9.137 . . . . 74.69 117.192 -174.836 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -98.36 161.46 13.68 Favored 'General case' 0 C--O 1.19 -2.071 1 O-C-N 115.514 -4.491 . . . . 69.93 108.917 168.288 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 47.5 p -107.04 -13.97 15.05 Favored 'General case' 0 C--N 1.287 -2.124 0 C-N-CA 115.733 -2.387 . . . . 67.61 111.969 173.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -105.01 144.03 32.38 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 131.436 3.894 . . . . 70.39 113.284 -174.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 -95.52 127.23 41.39 Favored 'General case' 0 C--N 1.277 -2.571 1 C-N-CA 135.29 5.436 . . . . 68.91 110.425 172.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.11 109.48 60.74 Favored Pre-proline 0 C--N 1.256 -3.495 1 C-N-CA 132.109 4.164 . . . . 51.73 108.855 -173.136 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -77.96 136.41 14.81 Favored 'Trans proline' 1 C--N 1.432 4.927 3 CA-C-N 102.034 -5.381 . . . . 47.54 107.856 175.873 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 93.6 t -132.39 127.79 57.43 Favored 'Isoleucine or valine' 0 C--N 1.245 -3.948 0 O-C-N 126.494 2.371 . . . . 45.62 106.665 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -101.18 94.45 5.97 Favored 'General case' 0 C--N 1.281 -2.394 0 N-CA-C 105.731 -1.952 . . . . 46.6 105.731 176.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . -110.12 176.52 19.18 Favored Glycine 0 N--CA 1.41 -3.037 0 CA-C-N 114.245 -1.343 . . . . 46.78 113.2 -165.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 49.7 tttt -133.97 136.9 44.47 Favored 'General case' 0 C--O 1.176 -2.806 0 O-C-N 127.409 2.476 . . . . 59.78 107.577 -174.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . 0.313 94.9 t -71.15 106.79 2.03 Favored 'Isoleucine or valine' 0 C--N 1.249 -3.779 1 C-N-CA 133.463 4.705 . . . . 46.79 112.475 176.877 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -115.58 -7.02 12.08 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.081 0 O-C-N 120.999 -1.063 . . . . 48.87 111.556 -170.325 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' TRP . . . . . . . . . . . . . 12.6 t-105 -167.86 135.8 2.34 Favored 'General case' 0 C--N 1.271 -2.843 0 C-N-CA 124.862 1.265 . . . . 64.04 109.007 -167.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' THR . . . . . . . . . . . . . 23.3 p -117.75 161.45 19.69 Favored 'General case' 0 C--N 1.307 -1.265 0 C-N-CA 130.273 3.429 . . . . 62.06 108.835 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 19.9 m -151.71 130.79 6.52 Favored Pre-proline 0 C--O 1.154 -3.956 1 C-N-CA 133.429 4.691 . . . . 72.6 114.043 172.675 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -88.82 19.17 1.35 Allowed 'Trans proline' 0 CA--C 1.589 3.272 2 C-N-CA 125.835 4.356 . . . . 79.76 122.593 177.562 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . 83.24 115.6 0.05 Allowed 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 116.552 2.056 . . . . 83.16 116.552 -175.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -80.3 -76.97 0.98 Allowed Glycine 0 N--CA 1.478 1.445 0 CA-C-N 116.515 -0.311 . . . . 85.87 113.609 -178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . 0.431 . . . . . . . 0 CA--C 1.489 -1.369 0 CA-C-O 127.214 3.388 . . . . 86.7 114.083 173.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 6.3 t30 . . . . . 0 C--O 1.254 1.304 0 CA-C-O 123.932 1.825 . . . . 87.49 112.006 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . 0.25 0.7 OUTLIER -62.48 142.46 57.9 Favored 'General case' 0 N--CA 1.415 -2.193 0 O-C-N 117.094 -3.504 . . . . 85.1 111.201 -167.1 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.92 153.84 42.33 Favored 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 130.508 3.523 . . . . 73.34 109.833 173.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.28 138.4 26.56 Favored 'General case' 0 C--N 1.269 -2.903 0 CA-C-N 109.676 -3.42 . . . . 63.74 109.378 168.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . 164.79 -170.38 39.85 Favored Glycine 0 N--CA 1.408 -3.183 0 N-CA-C 121.565 3.386 . . . . 55.72 121.565 -177.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.6 pt -131.98 146.46 33.24 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.73 0 C-N-CA 125.709 1.604 . . . . 47.56 111.081 -171.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.0 111.09 3.29 Favored Glycine 0 N--CA 1.409 -3.141 1 C-N-CA 138.846 7.879 . . . . 41.27 111.614 164.765 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . 0.263 86.0 t -112.29 117.89 56.37 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.082 0 O-C-N 116.972 -3.663 . . . . 40.96 109.444 -173.891 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -92.0 126.0 36.91 Favored 'General case' 0 N--CA 1.415 -2.211 0 C-N-CA 124.548 1.139 . . . . 46.25 111.822 175.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . 0.412 2.4 m-30 -54.01 136.69 57.15 Favored Pre-proline 0 C--O 1.173 -2.971 2 CA-C-O 136.328 7.728 . . . . 45.59 113.114 172.656 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.0 164.79 34.55 Favored 'Trans proline' 0 C--N 1.395 3.026 2 C-N-CA 104.891 -9.606 . . . . 51.34 109.243 -179.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.54 138.42 58.5 Favored 'General case' 0 C--N 1.271 -2.81 1 C-N-CA 135.793 5.637 . . . . 67.66 115.024 162.684 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 90.74 -175.15 40.11 Favored Glycine 0 N--CA 1.41 -3.06 0 CA-C-O 116.117 -2.491 . . . . 65.62 116.088 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -43.02 -46.34 8.94 Favored 'Trans proline' 0 C--O 1.276 2.413 1 C-N-CA 129.049 6.499 . . . . 69.33 118.766 -169.676 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . 0.491 21.5 mt-10 -75.02 -26.73 59.71 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 116.593 2.072 . . . . 82.29 116.593 -175.757 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' GLY . . . . . 0.472 ' O ' ' C ' ' B' ' 94' ' ' GLU . . . -79.8 -41.15 13.11 Favored Glycine 0 CA--C 1.473 -2.581 1 CA-C-O 132.646 6.692 . . . . 71.0 109.04 179.089 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' B' ' 93' ' ' GLY . 7.6 tt0 -60.82 -44.41 96.94 Favored 'General case' 0 C--N 1.306 -1.3 1 O-C-N 104.109 -11.23 . . . . 77.23 112.204 172.96 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.3 -43.31 74.7 Favored 'General case' 0 N--CA 1.422 -1.863 0 N-CA-C 116.505 2.039 . . . . 64.82 116.505 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 59.0 t -64.61 -43.11 96.71 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.983 0 C-N-CA 125.725 1.61 . . . . 62.88 106.758 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ARG . . . . . 0.669 ' NH2' ' O ' ' B' ' 446' ' ' HOH . 24.6 ttp85 -66.78 -45.02 79.76 Favored 'General case' 0 C--N 1.255 -3.503 0 CA-C-O 127.624 3.583 . . . . 71.46 107.199 -171.74 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.97 -42.44 99.83 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 109.53 -3.486 . . . . 67.48 108.756 -179.722 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.268 45.8 mttp -61.23 -40.84 95.52 Favored 'General case' 0 C--O 1.185 -2.295 0 CA-C-N 121.222 1.828 . . . . 67.5 114.075 176.34 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 41.5 mt -63.76 -58.2 8.41 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.891 0 CA-C-N 114.568 -1.196 . . . . 61.34 108.008 -179.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -57.02 -41.5 78.67 Favored 'General case' 0 N--CA 1.399 -3.0 0 CA-C-O 124.203 1.954 . . . . 73.13 113.41 -172.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' THR . . . . . . . . . . . . 0.378 0.1 OUTLIER -60.78 -38.26 84.72 Favored 'General case' 0 N--CA 1.424 -1.767 0 O-C-N 118.329 -2.732 . . . . 67.52 109.377 174.131 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.99 -29.23 69.01 Favored 'General case' 0 N--CA 1.426 -1.638 0 O-C-N 118.797 -2.439 . . . . 66.51 116.996 176.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 81.9 mt -98.92 -5.82 30.01 Favored 'General case' 1 C--N 1.244 -4.006 0 CA-C-N 114.645 -1.161 . . . . 70.63 111.051 -172.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.56 -43.93 83.72 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-O 115.969 -1.967 . . . . 79.0 106.889 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.744 1 C-N-CA 134.29 5.709 . . . . 84.73 118.56 177.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . 0.391 14.0 mm-40 . . . . . 0 C--O 1.247 0.955 0 N-CA-C 117.296 2.332 . . . . 88.92 117.296 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' GLY . . . . . . . . . . . . . . . 73.83 -165.5 54.78 Favored Glycine 0 C--N 1.297 -1.609 1 C-N-CA 132.789 4.995 . . . . 82.92 116.461 -177.473 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 12.4 mt -90.52 129.56 41.16 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.611 1 CA-C-N 124.239 4.019 . . . . 76.53 113.198 -177.543 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' LEU . . . . . . . . . . . . . 19.3 tp -99.25 115.92 30.24 Favored 'General case' 0 C--O 1.199 -1.575 0 CA-C-N 111.246 -2.706 . . . . 67.19 107.609 170.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 4.0 p -112.23 156.86 21.66 Favored 'General case' 0 C--N 1.261 -3.268 0 N-CA-C 119.146 3.017 . . . . 58.03 119.146 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 66.5 tp -150.03 113.27 4.9 Favored 'General case' 0 C--O 1.187 -2.194 0 N-CA-C 105.615 -1.994 . . . . 50.79 105.615 -174.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' ALA . . . . . . . . . . . . . . . -107.12 119.24 38.86 Favored 'General case' 2 CA--C 1.408 -4.489 0 CA-C-O 128.009 3.766 . . . . 49.42 108.933 171.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' LEU . . . . . . . . . . . . . 11.1 mt -103.99 108.77 20.26 Favored 'General case' 0 N--CA 1.415 -2.222 1 O-C-N 116.13 -4.106 . . . . 53.98 115.399 177.7 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LYS . . . . . 0.469 ' CE ' ' O ' ' C' ' 500' ' ' HOH . 17.9 tttt -54.72 -41.97 70.98 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 117.614 2.45 . . . . 68.22 117.614 -175.858 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -147.88 172.76 13.65 Favored 'General case' 1 C--O 1.117 -5.891 0 CA-C-N 122.595 2.452 . . . . 61.15 115.541 -175.791 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -62.89 -28.05 69.78 Favored 'General case' 0 N--CA 1.467 0.414 1 O-C-N 114.975 -4.828 . . . . 65.01 112.195 -177.626 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.52 77.99 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 117.247 -1.358 . . . . 54.93 107.729 172.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' ALA . . . . . . . . . . . . 0.25 . . -73.5 -38.89 65.2 Favored 'General case' 0 C--O 1.185 -2.296 0 O-C-N 125.36 1.663 . . . . 50.63 107.559 -163.822 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 40.2 tp -57.64 -54.34 47.97 Favored 'General case' 0 N--CA 1.418 -2.064 0 O-C-N 126.245 2.216 . . . . 51.67 107.803 171.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -56.0 -43.41 77.66 Favored 'General case' 0 C--O 1.197 -1.674 0 CA-C-N 119.966 1.257 . . . . 49.3 111.937 -175.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' SER . . . . . . . . . . . . . 7.8 t -62.6 -42.67 99.71 Favored 'General case' 1 N--CA 1.377 -4.122 0 O-C-N 126.428 2.33 . . . . 53.37 115.026 179.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . 0.35 . . -81.06 -32.74 33.9 Favored 'General case' 0 C--O 1.201 -1.492 0 C-N-CA 127.724 2.409 . . . . 45.07 113.465 -173.428 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -68.94 139.44 55.07 Favored 'General case' 1 C--O 1.127 -5.378 1 CA-C-O 133.117 6.199 . . . . 45.51 114.088 -177.34 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' MSE . . . . . 1.094 ' CG ' ' O ' ' C' ' 425' ' ' HOH . 60.5 mtp -120.42 87.8 41.38 Favored Pre-proline 0 C--N 1.312 -1.062 1 O-C-N 107.544 -9.472 . . . . 59.1 106.186 -178.718 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -60.73 -29.0 87.44 Favored 'Trans proline' 0 N--CA 1.432 -2.146 0 N-CA-C 118.995 2.652 . . . . 46.7 118.995 -176.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -73.99 -12.44 60.64 Favored 'General case' 0 C--N 1.275 -2.637 1 C-N-CA 136.383 5.873 . . . . 42.84 116.29 179.571 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' VAL . . . . . . . . . . . . . 70.1 t -75.55 137.38 22.97 Favored 'Isoleucine or valine' 0 C--N 1.258 -3.394 0 C-N-CA 125.831 1.652 . . . . 44.07 111.651 169.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -60.34 143.3 53.3 Favored 'General case' 0 N--CA 1.417 -2.089 0 O-C-N 118.742 -2.474 . . . . 63.34 112.509 170.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' SER . . . . . . . . . . . . 0.34 1.7 m 61.43 6.81 1.54 Allowed 'General case' 0 N--CA 1.411 -2.398 0 N-CA-C 115.689 1.736 . . . . 54.92 115.689 -176.088 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 70.46 138.14 0.14 Allowed Glycine 0 C--O 1.213 -1.187 0 C-N-CA 126.998 2.237 . . . . 48.98 112.804 -177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -127.53 -160.94 10.64 Favored Glycine 0 N--CA 1.473 1.11 0 CA-C-N 112.115 -2.043 . . . . 47.5 109.988 -173.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' ILE . . . . . . . . . . . . . 16.2 tt 179.01 137.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 122.426 1.108 . . . . 47.61 109.062 176.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -86.97 127.4 35.08 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 109.081 -0.711 . . . . 50.38 109.081 175.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 91.1 t -120.49 113.78 33.39 Favored Pre-proline 0 C--O 1.168 -3.236 0 N-CA-C 107.845 -1.169 . . . . 49.64 107.845 -176.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -67.04 137.43 44.38 Favored 'Trans proline' 1 C--N 1.418 4.225 1 C-N-CA 111.572 -5.152 . . . . 58.54 117.844 170.981 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' THR . . . . . . . . . . . . . 12.6 t -174.08 133.39 0.56 Allowed Pre-proline 0 C--O 1.172 -3.025 1 C-N-CA 137.454 6.302 . . . . 64.39 111.795 -172.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -93.2 9.03 2.46 Favored 'Trans proline' 0 N--CA 1.419 -2.901 2 C-N-CA 108.619 -7.121 . . . . 66.8 111.722 169.672 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 35.7 mttp -69.43 171.43 8.73 Favored 'General case' 0 C--N 1.263 -3.192 0 CA-C-N 121.874 2.124 . . . . 73.52 107.891 172.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' ARG . . . . . . . . . . . . . 13.2 mtm105 -118.49 122.01 41.66 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 105.716 -1.957 . . . . 79.56 105.716 -177.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -125.23 155.92 39.32 Favored 'General case' 1 C--O 1.13 -5.222 0 O-C-N 127.471 2.982 . . . . 64.88 111.419 -174.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' MSE . . . . . . . . . . . . . 80.6 mtp -113.45 150.43 32.8 Favored 'General case' 0 C--N 1.311 -1.096 0 O-C-N 117.117 -3.489 . . . . 85.34 112.758 174.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.26 132.49 53.18 Favored 'General case' 0 C--O 1.191 -1.98 0 N-CA-C 106.517 -1.66 . . . . 55.38 106.517 179.162 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' GLY . . . . . . . . . . . . . . . 88.52 -13.76 61.44 Favored Glycine 0 N--CA 1.403 -3.535 0 C-N-CA 128.842 3.115 . . . . 53.38 114.153 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -52.09 152.19 3.34 Favored 'General case' 0 N--CA 1.412 -2.334 0 C-N-CA 116.311 -2.155 . . . . 54.98 112.7 170.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.89 129.43 34.93 Favored 'General case' 0 N--CA 1.416 -2.138 1 C-N-CA 132.009 4.124 . . . . 67.2 109.458 167.855 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' VAL . . . . . . . . . . . . . 34.9 t -124.48 131.72 72.36 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.927 0 CA-C-O 116.488 -1.72 . . . . 56.56 109.39 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' PHE . . . . . . . . . . . . 0.371 9.4 t80 -92.15 117.24 29.66 Favored 'General case' 0 C--N 1.26 -3.324 0 C-N-CA 126.818 2.047 . . . . 51.47 111.367 167.199 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' LEU . . . . . . . . . . . . . 36.7 tp -122.61 128.42 50.65 Favored 'General case' 0 C--O 1.196 -1.74 0 CA-C-N 113.15 -1.841 . . . . 49.44 109.898 -174.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 tp -95.97 115.43 27.42 Favored 'General case' 0 CA--C 1.454 -2.733 0 C-N-CA 126.33 1.852 . . . . 50.01 111.223 166.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 44.5 tp -116.24 120.77 40.02 Favored 'General case' 0 C--N 1.292 -1.915 0 O-C-N 118.613 -2.555 . . . . 48.48 110.233 -173.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -100.61 113.41 26.23 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 115.56 1.689 . . . . 50.7 115.56 165.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' LEU . . . . . . . . . . . . 0.476 30.6 mt -71.48 143.11 87.28 Favored Pre-proline 0 C--N 1.255 -3.531 1 C-N-CA 132.014 4.126 . . . . 55.73 116.788 173.36 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.09 139.69 71.14 Favored 'Trans proline' 1 C--N 1.434 5.078 1 C-N-CA 108.157 -7.428 . . . . 62.65 114.595 -174.558 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' ASP . . . . . . . . . . . . 0.499 0.1 OUTLIER 35.03 44.06 0.12 Allowed 'General case' 0 N--CA 1.416 -2.137 1 CA-C-O 129.1 4.286 . . . . 71.26 118.739 -174.764 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' SER . . . . . . . . . . . . . 3.6 t -97.09 152.68 18.54 Favored 'General case' 0 C--O 1.187 -2.193 0 O-C-N 118.16 -2.837 . . . . 67.57 105.446 169.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' SER . . . . . . . . . . . . . 45.3 p -104.55 11.78 33.89 Favored 'General case' 1 C--O 1.131 -5.162 2 CA-C-O 136.574 7.845 . . . . 66.11 109.011 175.369 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . 0.3 4.9 pt-20 -129.84 152.6 49.14 Favored 'General case' 0 C--N 1.302 -1.46 1 O-C-N 100.579 -13.826 . . . . 74.17 113.01 -173.862 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' ARG . . . . . . . . . . . . . 76.9 mtt85 -112.34 116.82 30.98 Favored 'General case' 0 C--N 1.271 -2.837 1 C-N-CA 133.456 4.702 . . . . 62.96 108.133 177.393 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 18.2 mt -96.62 106.2 28.26 Favored Pre-proline 0 C--O 1.17 -3.113 0 C-N-CA 129.442 3.097 . . . . 51.06 114.477 -176.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -80.72 138.05 11.66 Favored 'Trans proline' 1 C--N 1.432 4.972 1 C-N-CA 109.439 -6.574 . . . . 47.68 110.791 -179.235 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . 0.435 1.5 m -130.27 116.34 35.93 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.287 0 C-N-CA 130.464 3.506 . . . . 45.28 109.505 -175.012 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.14 83.53 6.0 Favored 'General case' 0 C--N 1.279 -2.477 1 CA-C-O 132.139 5.733 . . . . 45.87 108.985 170.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' GLY . . . . . . . . . . . . . . . -100.66 179.42 29.11 Favored Glycine 0 C--N 1.291 -1.937 1 O-C-N 102.832 -12.417 . . . . 44.97 111.484 -167.343 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' LYS . . . . . . . . . . . . . 51.4 tttt -125.02 137.05 54.24 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 126.916 2.186 . . . . 54.64 114.755 172.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' VAL . . . . . . . . . . . . . 72.3 t -75.6 115.83 17.61 Favored 'Isoleucine or valine' 0 C--N 1.253 -3.591 0 CA-C-O 116.493 -1.717 . . . . 43.7 109.302 -178.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' VAL . . . . . . . . . . . . 0.286 4.3 m -114.91 -3.33 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.961 0 N-CA-C 117.32 2.341 . . . . 48.53 117.32 -175.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' TRP . . . . . . . . . . . . . 73.5 t-105 -172.39 133.76 0.66 Allowed 'General case' 0 C--O 1.191 -2.02 0 C-N-CA 130.466 3.506 . . . . 62.7 111.644 -169.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 68.1 p -117.96 150.75 38.73 Favored 'General case' 0 C--N 1.284 -2.279 1 O-C-N 112.139 -6.601 . . . . 65.06 115.001 171.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.3 m -143.62 101.49 5.06 Favored Pre-proline 0 C--O 1.164 -3.416 0 C-N-CA 128.381 2.672 . . . . 76.15 115.871 170.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' PRO . . . . . 0.482 ' O ' ' CB ' ' C' ' 73' ' ' ALA . 10.8 Cg_endo -56.46 4.33 0.07 OUTLIER 'Trans proline' 1 C--N 1.437 5.21 1 CA-C-N 105.635 -4.095 . . . . 84.61 118.115 -179.4 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' ALA . . . . . 0.482 ' CB ' ' O ' ' C' ' 72' ' ' PRO . . . . . . . . 0 C--O 1.291 3.285 0 CA-C-N 120.464 1.484 . . . . 85.37 112.377 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' ARG . . . . . 0.955 ' NH2' ' O ' ' C' ' 628' ' ' HOH . 60.9 ttt180 . . . . . 0 N--CA 1.497 1.884 0 CA-C-O 120.339 0.114 . . . . 78.51 111.175 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -83.38 161.81 21.24 Favored 'General case' 0 C--O 1.204 -1.308 0 N-CA-C 114.053 1.131 . . . . 68.31 114.053 173.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.96 153.67 32.9 Favored 'General case' 0 C--N 1.286 -2.174 0 C-N-CA 127.152 2.181 . . . . 62.51 106.363 174.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' GLY . . . . . . . . . . . . . . . 141.37 -164.57 26.57 Favored Glycine 1 C--O 1.092 -8.773 0 C-N-CA 126.463 1.982 . . . . 57.01 117.185 -176.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' ILE . . . . . . . . . . . . . 41.8 pt -137.35 148.12 26.24 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.816 0 C-N-CA 128.175 2.59 . . . . 48.61 113.39 -162.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . -89.37 116.64 4.75 Favored Glycine 0 C--N 1.276 -2.802 0 C-N-CA 129.173 3.273 . . . . 41.06 108.874 170.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 40.6 t -110.93 114.22 46.48 Favored 'Isoleucine or valine' 0 C--N 1.254 -3.574 0 C-N-CA 128.231 2.612 . . . . 40.82 111.564 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -81.55 136.87 35.59 Favored 'General case' 0 N--CA 1.416 -2.163 0 C-N-CA 125.321 1.449 . . . . 43.42 108.967 175.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' PHE . . . . . . . . . . . . 0.288 2.7 m-30 -70.29 146.6 94.63 Favored Pre-proline 0 C--N 1.25 -3.748 1 CA-C-O 129.847 4.641 . . . . 44.79 112.123 170.872 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -72.85 161.25 44.21 Favored 'Trans proline' 0 C--N 1.397 3.082 1 C-N-CA 107.5 -7.867 . . . . 51.06 110.366 -178.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' ASP . . . . . . . . . . . . 0.273 16.8 m-20 -57.32 129.06 40.12 Favored 'General case' 0 C--N 1.281 -2.398 1 C-N-CA 134.869 5.267 . . . . 69.47 112.839 156.616 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 114.99 -169.7 12.96 Favored Glycine 1 C--N 1.247 -4.377 0 CA-C-O 125.446 2.692 . . . . 64.62 107.941 168.828 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -54.2 -45.96 37.12 Favored 'Trans proline' 1 C--N 1.422 4.446 1 CA-C-N 103.14 -6.53 . . . . 65.14 120.89 -174.497 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' GLU . . . . . . . . . . . . . . . -62.56 -38.21 89.17 Favored 'General case' 0 C--N 1.271 -2.816 0 O-C-N 118.395 -2.691 . . . . 64.52 116.775 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' C' ' 94' ' ' GLU . . . -69.13 -47.83 50.82 Favored Glycine 1 C--O 1.137 -5.956 2 C-N-CA 133.088 5.137 . . . . 64.95 111.858 176.241 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' GLU . . . . . 0.626 ' OE2' ' NH1' ' C' ' 97' ' ' ARG . 5.6 tp10 -64.19 -30.41 71.47 Favored 'General case' 0 C--N 1.28 -2.432 1 O-C-N 109.391 -8.123 . . . . 74.88 111.039 176.538 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.82 -43.54 92.78 Favored 'General case' 0 C--O 1.2 -1.527 0 C-N-CA 117.617 -1.633 . . . . 66.31 109.45 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.76 -41.36 79.88 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.904 0 CA-C-O 124.538 2.113 . . . . 64.74 105.898 -169.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' ARG . . . . . 0.626 ' NH1' ' OE2' ' C' ' 94' ' ' GLU . 27.7 ttp180 -65.52 -39.97 92.42 Favored 'General case' 0 C--O 1.161 -3.576 0 CA-C-N 109.694 -3.412 . . . . 73.68 107.418 -175.359 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' ASN . . . . . . . . . . . . 0.272 86.6 m-20 -62.89 -55.05 29.57 Favored 'General case' 0 C--N 1.267 -3.014 0 C-N-CA 125.242 1.417 . . . . 70.7 113.86 178.489 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' LYS . . . . . . . . . . . . 0.291 13.0 mttm -45.15 -54.21 7.13 Favored 'General case' 0 C--O 1.196 -1.716 0 O-C-N 117.978 -2.951 . . . . 66.44 115.316 165.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' ILE . . . . . . . . . . . . 0.251 65.9 mt -58.14 -50.88 76.74 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.935 0 O-C-N 120.024 -1.672 . . . . 63.08 109.962 -175.995 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -61.59 -33.13 73.35 Favored 'General case' 0 C--N 1.271 -2.812 0 CA-C-N 115.312 -0.858 . . . . 74.91 110.477 -172.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' THR . . . . . . . . . . . . 0.509 0.5 OUTLIER -66.85 -44.73 80.25 Favored 'General case' 0 CA--C 1.477 -1.861 0 CA-C-O 125.424 2.535 . . . . 67.93 110.357 171.659 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.63 -15.75 61.68 Favored 'General case' 0 N--CA 1.422 -1.861 1 O-C-N 112.764 -6.21 . . . . 66.39 116.971 176.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -107.66 -4.73 17.95 Favored 'General case' 0 C--N 1.265 -3.091 0 C-N-CA 117.632 -1.627 . . . . 68.1 114.25 -168.71 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -31.91 102.27 0.02 OUTLIER 'General case' 0 C--N 1.281 -2.372 1 C-N-CA 132.261 4.224 . . . . 73.74 114.089 160.96 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' GLY . . . . . 1.285 ' OXT' ' C ' ' C' ' 106' ' ' GLY . . . . . . . . 0 CA--C 1.482 -2.006 1 CA-C-O 130.51 5.505 . . . . 76.0 118.413 178.611 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 1.078 ' O ' ' CG ' ' A' ' 26' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.536 ' O ' ' OG1' ' A' ' 53' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 298' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' HOH . . . . . 0.469 ' O ' ' NH2' ' A' ' 79' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 492' ' ' HOH . . . . . 1.084 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 635' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 636' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 651' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 653' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 654' ' ' HOH . . . . . 0.866 ' O ' ' CD ' ' A' ' 40' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 350' ' ' HOH . . . . . 1.063 ' O ' ' CG ' ' B' ' 26' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 399' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 403' ' ' HOH . . . . . 0.558 ' O ' ' O ' ' B' ' 20' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 446' ' ' HOH . . . . . 0.669 ' O ' ' NH2' ' B' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 482' ' ' HOH . . . . . 0.941 ' O ' ' N ' ' B' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 627' ' ' HOH . . . . . 0.497 ' O ' ' NE ' ' B' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 634' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 638' ' ' HOH . . . . . 1.002 ' O ' ' OH ' ' B' ' 42' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 639' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 642' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 643' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 649' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 425' ' ' HOH . . . . . 1.094 ' O ' ' CG ' ' C' ' 26' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 500' ' ' HOH . . . . . 0.469 ' O ' ' CE ' ' C' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 628' ' ' HOH . . . . . 0.955 ' O ' ' NH2' ' C' ' 79' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 632' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 633' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 640' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 645' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 646' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.229 0 CA-C-O 114.876 -2.487 . . . . 83.549999999999997 107.605 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.8 164.19 36.52 Favored Glycine 0 N--CA 1.409 -3.15 0 N-CA-C 120.636 3.014 . . . . 76.730000000000004 120.636 163.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.2 mt -98.18 142.73 14.07 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.934 0 C-N-CA 114.871 -2.732 . . . . 71.709999999999994 104.52 -178.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 26.5 tp -107.16 114.37 28.39 Favored 'General case' 1 C--N 1.244 -4.005 0 O-C-N 127.239 2.837 . . . . 64.159999999999997 108.749 172.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.0 137.2 32.54 Favored 'General case' 0 C--N 1.28 -2.421 0 N-CA-C 121.165 3.765 . . . . 56.43 121.165 177.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.378 25.9 tp -136.14 105.85 6.18 Favored 'General case' 0 N--CA 1.415 -2.195 1 C-N-CA 133.601 4.76 . . . . 50.259999999999998 119.394 171.141 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -113.54 122.57 47.65 Favored 'General case' 0 N--CA 1.515 2.794 0 C-N-CA 116.411 -2.116 . . . . 50.229999999999997 106.333 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . 0.61 HD13 ' HA ' ' A' ' 21' ' ' LEU 0.369 5.3 mt -103.25 106.42 16.94 Favored 'General case' 0 C--N 1.244 -3.988 0 C-N-CA 128.742 2.817 . . . . 52.640000000000001 113.719 -179.82 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . 0.861 ' HB3' ' O ' ' A' ' 492' ' ' HOH 0.474 2.6 tptm -56.44 -40.11 74.23 Favored 'General case' 0 C--N 1.288 -2.09 0 N-CA-C 119.552 3.167 . . . . 67.849999999999994 119.552 177.063 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -150.52 -178.61 6.64 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 118.226 -2.796 . . . . 59.289999999999999 110.319 -174.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -65.26 -24.99 67.47 Favored 'General case' 0 N--CA 1.405 -2.676 0 C-N-CA 129.375 3.07 . . . . 68.549999999999997 115.289 175.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.56 -41.53 46.11 Favored 'General case' 0 C--O 1.16 -3.626 1 CA-C-O 131.505 5.431 . . . . 54.310000000000002 106.688 179.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . 0.518 . . -62.59 -41.82 99.19 Favored 'General case' 0 C--N 1.279 -2.49 1 O-C-N 111.226 -7.171 . . . . 49.640000000000001 118.211 174.875 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . 0.61 ' HA ' HD13 ' A' ' 15' ' ' LEU 0.289 30.5 tp -53.25 -58.99 5.14 Favored 'General case' 0 N--CA 1.406 -2.647 0 C-N-CA 127.673 2.389 . . . . 48.439999999999998 111.489 166.585 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.283 41.1 t80 -54.01 -44.42 70.88 Favored 'General case' 0 C--N 1.284 -2.245 1 C-N-CA 132.251 4.22 . . . . 51.299999999999997 112.23 -178.372 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . 0.593 1.3 p -72.25 -33.75 67.74 Favored 'General case' 0 C--N 1.271 -2.816 0 N-CA-C 121.006 3.706 . . . . 55.630000000000003 121.006 170.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.443 . . -69.37 -44.81 70.79 Favored 'General case' 0 C--O 1.195 -1.776 0 N-CA-C 116.786 2.143 . . . . 47.600000000000001 116.786 173.261 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . 0.384 29.0 t80 -57.56 133.75 55.53 Favored 'General case' 0 C--N 1.276 -2.607 0 CA-C-O 126.184 2.897 . . . . 48.810000000000002 113.157 -175.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' MSE . . . . . 1.178 ' HG2' ' O ' ' A' ' 203' ' ' HOH . 70.1 mtp -121.18 82.1 37.47 Favored Pre-proline 0 C--O 1.172 -2.989 1 O-C-N 110.96 -7.337 . . . . 57.810000000000002 105.984 -179.644 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.39 -24.55 75.74 Favored 'Trans proline' 0 N--CA 1.433 -2.082 0 C-N-CA 123.006 2.47 . . . . 46.789999999999999 117.269 -175.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -72.94 -8.81 57.38 Favored 'General case' 0 C--N 1.278 -2.531 0 C-N-CA 129.43 3.092 . . . . 42.020000000000003 115.771 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . 0.359 41.6 t -76.81 123.52 33.42 Favored 'Isoleucine or valine' 0 C--N 1.26 -3.299 0 C-N-CA 129.803 3.241 . . . . 45.159999999999997 115.768 171.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -56.08 137.42 51.32 Favored 'General case' 0 C--O 1.193 -1.87 0 O-C-N 117.253 -3.404 . . . . 63.549999999999997 107.106 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.3 m 77.79 -0.25 2.74 Favored 'General case' 1 C--O 1.135 -4.962 1 CA-C-O 133.33 6.3 . . . . 48.590000000000003 112.365 179.198 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.31 150.21 20.23 Favored Glycine 0 N--CA 1.4 -3.709 1 O-C-N 107.311 -9.618 . . . . 44.659999999999997 115.904 -170.814 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -156.77 174.82 34.45 Favored Glycine 0 C--O 1.206 -1.635 0 C-N-CA 115.365 -3.302 . . . . 40.770000000000003 107.403 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . 0.348 13.3 tt -151.22 142.45 16.29 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.45 0 CA-C-N 120.59 2.195 . . . . 39.43 113.302 -174.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -89.01 133.29 34.38 Favored 'General case' 0 C--N 1.29 -1.982 0 O-C-N 119.287 -2.133 . . . . 45.060000000000002 109.373 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.9 t -125.89 113.89 24.49 Favored Pre-proline 0 C--N 1.259 -3.369 0 CA-C-N 121.705 2.048 . . . . 46.759999999999998 109.987 -174.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.8 139.43 74.59 Favored 'Trans proline' 0 C--N 1.399 3.227 1 C-N-CA 111.123 -5.451 . . . . 54.979999999999997 117.008 170.917 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.6 t -179.06 138.85 0.34 Allowed Pre-proline 0 C--O 1.168 -3.23 1 C-N-CA 132.317 4.247 . . . . 60.82 112.923 178.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -93.02 -5.07 3.11 Favored 'Trans proline' 0 C--N 1.399 3.195 3 C-N-CA 108.956 -6.896 . . . . 65.569999999999993 112.465 171.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . 1.137 ' HD3' ' O ' ' A' ' 654' ' ' HOH . 13.5 mttp -57.42 161.77 3.23 Favored 'General case' 0 C--N 1.259 -3.345 0 CA-C-N 122.174 2.261 . . . . 71.620000000000005 108.636 170.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 41' ' ' ARG . 13.5 mtm180 -111.6 117.69 33.65 Favored 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 130.34 3.456 . . . . 79.049999999999997 107.092 -175.298 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -122.35 152.84 39.73 Favored 'General case' 1 C--O 1.14 -4.704 0 O-C-N 128.502 3.626 . . . . 65.590000000000003 109.289 -174.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' MSE . . . . . . . . . . . . . 87.5 mtp -112.61 153.89 26.87 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 117.526 -3.233 . . . . 82.409999999999997 111.421 173.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.56 140.62 58.65 Favored 'General case' 0 C--O 1.186 -2.265 0 CA-C-O 115.106 -2.378 . . . . 55.439999999999998 104.744 -178.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.83 4.1 52.96 Favored Glycine 1 N--CA 1.396 -4.026 2 O-C-N 131.63 5.581 . . . . 51.640000000000001 114.929 -172.133 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.45 155.54 11.87 Favored 'General case' 0 N--CA 1.415 -2.199 0 CA-C-N 121.343 2.572 . . . . 52.350000000000001 112.452 166.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 653' ' ' HOH . 6.0 mt-10 -88.41 126.4 35.2 Favored 'General case' 0 N--CA 1.421 -1.905 1 C-N-CA 132.633 4.373 . . . . 68.159999999999997 108.723 166.817 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.5 p -126.45 137.49 57.62 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.107 0 O-C-N 126.198 2.187 . . . . 53.939999999999998 108.283 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . 0.569 ' HE1' ' HA ' ' B' ' 19' ' ' ALA . 32.5 t80 -95.37 118.57 32.35 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 119.825 1.193 . . . . 51.270000000000003 108.85 172.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -108.26 127.73 54.1 Favored 'General case' 0 C--N 1.266 -3.031 0 N-CA-C 107.762 -1.199 . . . . 48.890000000000001 107.762 -176.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.3 tp -103.36 113.56 27.15 Favored 'General case' 0 C--N 1.289 -2.039 0 CA-C-O 118.093 -0.956 . . . . 48.25 112.329 160.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -107.97 115.99 31.13 Favored 'General case' 0 C--N 1.262 -3.228 0 C-N-CA 129.469 3.108 . . . . 50.729999999999997 114.319 -166.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . 0.536 ' OG1' ' O ' ' A' ' 204' ' ' HOH . 0.7 OUTLIER -107.44 118.55 37.02 Favored 'General case' 0 C--O 1.189 -2.099 0 CA-C-N 120.239 1.381 . . . . 48.93 114.651 170.42 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . 0.469 ' O ' ' C ' ' A' ' 55' ' ' PRO 0.252 0.0 OUTLIER -80.57 135.83 52.68 Favored Pre-proline 0 C--N 1.257 -3.414 1 C-N-CA 134.667 5.187 . . . . 56.329999999999998 114.148 -178.662 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PRO . . . . . 0.469 ' C ' ' O ' ' A' ' 54' ' ' LEU . 10.6 Cg_exo -42.42 130.97 5.06 Favored 'Trans proline' 1 C--N 1.438 5.237 1 C-N-CA 106.766 -8.356 . . . . 63.149999999999999 114.484 -179.561 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . 0.56 2.9 t70 66.4 17.54 10.69 Favored 'General case' 0 N--CA 1.422 -1.841 0 O-C-N 118.158 -2.839 . . . . 73.629999999999995 116.181 166.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . 0.593 ' HB3' ' O ' ' A' ' 635' ' ' HOH . 45.8 p -101.77 166.87 10.44 Favored 'General case' 0 C--O 1.206 -1.195 0 O-C-N 117.255 -3.403 . . . . 69.340000000000003 108.916 170.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.3 p -114.39 16.84 17.73 Favored 'General case' 1 C--O 1.132 -5.081 0 CA-C-O 127.607 3.575 . . . . 67.579999999999998 108.919 179.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.59 146.22 50.6 Favored 'General case' 0 C--N 1.286 -2.195 1 O-C-N 100.444 -13.91 . . . . 70.640000000000001 109.806 -173.179 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.6 mtt85 -112.53 119.44 38.2 Favored 'General case' 0 C--N 1.278 -2.514 1 C-N-CA 135.01 5.324 . . . . 65.140000000000001 108.38 174.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.419 6.4 mt -92.39 105.61 14.89 Favored Pre-proline 0 C--N 1.262 -3.233 1 C-N-CA 137.992 6.517 . . . . 52.700000000000003 115.89 -176.071 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PRO . . . . . 0.443 ' HD2' ' O ' ' A' ' 618' ' ' HOH . 3.0 Cg_exo -81.3 136.3 9.96 Favored 'Trans proline' 1 C--N 1.423 4.463 1 C-N-CA 109.059 -6.827 . . . . 48.219999999999999 107.412 -177.611 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.8 t -128.98 132.89 66.96 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.057 0 C-N-CA 128.955 2.902 . . . . 44.850000000000001 108.532 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -102.29 81.78 2.11 Favored 'General case' 0 C--N 1.274 -2.678 0 C-N-CA 131.566 3.946 . . . . 44.439999999999998 107.935 -179.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -104.24 174.9 22.52 Favored Glycine 0 C--O 1.191 -2.58 0 C-N-CA 113.966 -3.969 . . . . 45.240000000000002 110.375 -160.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -126.51 137.21 53.35 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 119.191 -1.003 . . . . 55.469999999999999 109.065 176.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.64 123.78 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.652 0 CA-C-O 117.477 -1.249 . . . . 45.909999999999997 110.868 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . 0.471 17.1 m -120.18 -9.8 10.55 Favored 'Isoleucine or valine' 0 C--N 1.263 -3.169 0 N-CA-C 118.021 2.6 . . . . 49.960000000000001 118.021 -175.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' TRP . . . . . . . . . . . . . 7.2 t-105 -173.33 136.48 0.62 Allowed 'General case' 0 N--CA 1.485 1.296 0 CA-C-N 113.598 -1.637 . . . . 68.400000000000006 112.529 -168.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.5 p -123.03 140.03 53.46 Favored 'General case' 0 C--O 1.182 -2.458 0 CA-C-O 128.152 3.834 . . . . 66.409999999999997 109.173 -177.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.1 m -116.63 97.34 50.07 Favored Pre-proline 0 C--N 1.284 -2.281 1 O-C-N 114.002 -5.436 . . . . 75.519999999999996 102.838 178.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo . . . . . 0 C--O 1.259 1.545 0 CA-C-O 124.322 1.717 . . . . 81.420000000000002 113.859 165.296 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 114.141 1.163 . . . . 83.239999999999995 114.141 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . 0.469 ' NH2' ' O ' ' A' ' 449' ' ' HOH 0.402 0.0 OUTLIER 58.47 112.4 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.184 0 CA-C-O 127.344 3.449 . . . . 87.829999999999998 116.537 -164.314 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -88.11 156.09 19.45 Favored 'General case' 0 C--N 1.3 -1.551 0 C-N-CA 130.903 3.681 . . . . 73.280000000000001 117.234 -172.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.68 140.34 51.47 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-O 115.115 -2.374 . . . . 63.450000000000003 104.951 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 161.81 -155.58 26.87 Favored Glycine 0 N--CA 1.403 -3.523 2 C-N-CA 137.773 7.368 . . . . 56.140000000000001 125.204 -177.061 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 11.1 pt -138.73 147.98 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.777 0 O-C-N 119.894 -1.945 . . . . 47.990000000000002 114.511 -166.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -93.35 113.54 4.5 Favored Glycine 1 C--O 1.137 -5.96 0 C-N-CA 130.305 3.812 . . . . 40.340000000000003 108.263 172.01 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . 0.299 61.9 t -102.99 117.52 48.51 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.426 0 C-N-CA 129.922 3.289 . . . . 40.32 111.317 -176.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -90.6 136.47 33.04 Favored 'General case' 0 C--O 1.19 -2.063 0 CA-C-O 116.842 -1.551 . . . . 45.359999999999999 110.576 174.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.341 22.4 m-30 -68.28 143.98 96.24 Favored Pre-proline 0 C--N 1.276 -2.603 0 C-N-CA 130.027 3.331 . . . . 46.32 109.907 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.63 147.65 64.19 Favored 'Trans proline' 0 C--N 1.27 -3.561 1 O-C-N 109.041 -6.347 . . . . 51.920000000000002 111.896 175.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.2 p30 -76.51 154.85 34.24 Favored 'General case' 0 C--O 1.202 -1.439 0 O-C-N 119.456 -2.028 . . . . 68.010000000000005 111.551 172.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 108.31 -173.86 18.35 Favored Glycine 0 C--O 1.169 -3.94 0 C-N-CA 117.933 -2.079 . . . . 67.340000000000003 109.423 -172.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.65 -55.18 3.22 Favored 'Trans proline' 1 C--N 1.429 4.813 3 CA-C-N 102.469 -6.865 . . . . 68.75 115.196 -172.072 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.64 -26.46 33.13 Favored 'General case' 0 C--N 1.257 -3.444 1 C-N-CA 132.741 4.416 . . . . 81.170000000000002 115.006 -176.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -89.25 -48.06 3.9 Favored Glycine 0 C--N 1.268 -3.243 1 C-N-CA 132.621 4.915 . . . . 67.079999999999998 110.277 -178.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . 0.346 3.3 mm-40 -55.69 -32.21 63.08 Favored 'General case' 0 N--CA 1.419 -2.009 0 N-CA-C 117.495 2.405 . . . . 73.689999999999998 117.495 167.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.5 -45.26 76.34 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 115.307 1.595 . . . . 60.520000000000003 115.307 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . 0.447 6.4 t -60.31 -50.95 78.27 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.95 1 C-N-CA 131.866 4.066 . . . . 59.079999999999998 111.633 171.618 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -55.55 -44.07 76.44 Favored 'General case' 0 C--N 1.29 -2.008 1 CA-C-O 128.845 4.164 . . . . 74.769999999999996 108.35 -179.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . 0.537 7.1 m-80 -78.15 -38.94 42.5 Favored 'General case' 0 N--CA 1.416 -2.133 0 O-C-N 118.462 -2.649 . . . . 67.340000000000003 111.702 -172.958 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.2 mttm -56.25 -41.07 75.17 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 115.827 -2.349 . . . . 68.019999999999996 113.637 171.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 45.0 mt -63.87 -46.18 94.96 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.211 0 CA-C-O 125.789 2.709 . . . . 62.850000000000001 109.316 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -68.06 -42.01 81.13 Favored 'General case' 0 C--O 1.195 -1.786 0 CA-C-N 112.544 -2.116 . . . . 71.450000000000003 106.449 -164.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . 0.452 0.6 OUTLIER -58.71 -43.57 90.14 Favored 'General case' 0 C--N 1.257 -3.422 0 O-C-N 127.378 2.924 . . . . 69.890000000000001 109.86 178.437 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -35.83 78.54 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 117.781 -1.104 . . . . 66.959999999999994 110.92 172.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.3 mt -97.05 -0.78 46.64 Favored 'General case' 0 C--N 1.273 -2.724 0 O-C-N 117.99 -2.944 . . . . 69.170000000000002 116.214 -170.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.83 115.36 2.54 Favored 'General case' 0 C--N 1.293 -1.855 0 C-N-CA 129.484 3.114 . . . . 74.090000000000003 109.532 -177.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.462 -3.23 1 CA-C-O 133.504 7.169 . . . . 78.180000000000007 114.231 -162.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 . . . . . 0 N--CA 1.498 1.974 0 CA-C-O 120.358 0.123 . . . . 84.319999999999993 111.307 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 67.22 -173.88 27.76 Favored Glycine 0 C--N 1.342 0.889 0 CA-C-O 121.505 0.503 . . . . 75.799999999999997 113.65 -171.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 96.6 mt -86.38 124.33 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-O 122.174 0.988 . . . . 68.900000000000006 110.883 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 tp -93.88 123.16 37.05 Favored 'General case' 0 N--CA 1.42 -1.958 0 CA-C-N 114.508 -1.223 . . . . 62.5 108.185 169.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 1.8 t -106.48 150.01 26.52 Favored 'General case' 0 C--N 1.288 -2.09 0 C-N-CA 117.563 -1.655 . . . . 56.859999999999999 113.218 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 tp -145.42 111.98 5.83 Favored 'General case' 0 N--CA 1.418 -2.072 0 C-N-CA 127.828 2.451 . . . . 51.630000000000003 114.154 169.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -114.11 123.34 49.39 Favored 'General case' 0 C--O 1.194 -1.862 0 O-C-N 120.452 -1.405 . . . . 52.189999999999998 109.45 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.4 mt -105.25 111.84 24.73 Favored 'General case' 0 C--N 1.289 -2.06 0 O-C-N 124.252 0.97 . . . . 55.020000000000003 109.423 -170.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 43.2 tttm -67.55 -35.21 78.62 Favored 'General case' 1 C--O 1.152 -4.044 1 CA-C-O 140.794 9.854 . . . . 68.370000000000005 117.666 -174.865 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 p30 -150.17 173.86 13.44 Favored 'General case' 0 C--N 1.292 -1.893 1 O-C-N 98.044 -15.41 . . . . 64.450000000000003 117.053 -177.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LYS . . . . . 0.605 ' HE2' ' O ' ' B' ' 103' ' ' LEU . 16.1 mttt -62.59 -29.02 70.29 Favored 'General case' 0 N--CA 1.415 -2.205 0 O-C-N 119.314 -2.116 . . . . 70.650000000000006 111.159 -173.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . 0.569 ' HA ' ' HE1' ' A' ' 49' ' ' PHE . . . -61.46 -41.86 97.89 Favored 'General case' 0 C--N 1.257 -3.445 0 C-N-CA 118.112 -1.435 . . . . 57.43 109.099 -179.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ALA . . . . . 0.558 ' O ' ' O ' ' B' ' 403' ' ' HOH 0.57 . . -72.79 -36.68 67.66 Favored 'General case' 0 C--N 1.253 -3.591 0 CA-C-N 112.819 -1.991 . . . . 51.549999999999997 111.848 -171.763 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LEU . . . . . 0.54 HD21 HG23 ' B' ' 100' ' ' ILE 0.402 22.9 tp -52.14 -55.21 22.41 Favored 'General case' 0 N--CA 1.41 -2.457 0 O-C-N 125.531 1.769 . . . . 52.700000000000003 113.964 164.841 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -56.92 -41.72 78.68 Favored 'General case' 1 C--N 1.243 -4.039 0 C-N-CA 128.305 2.642 . . . . 55.600000000000001 109.003 -173.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . 0.579 1.0 OUTLIER -79.49 -37.27 37.15 Favored 'General case' 0 C--N 1.265 -3.075 0 O-C-N 126.907 2.629 . . . . 54.100000000000001 115.762 -175.674 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . 0.426 . . -69.65 -37.77 76.87 Favored 'General case' 0 C--O 1.19 -2.036 0 C-N-CA 128.433 2.693 . . . . 48.210000000000001 117.716 175.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . 0.45 14.7 t80 -60.03 129.82 43.67 Favored 'General case' 0 N--CA 1.41 -2.465 0 C-N-CA 130.4 3.48 . . . . 48.609999999999999 116.15 177.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' MSE . . . . . 1.223 ' HG2' ' O ' ' B' ' 350' ' ' HOH . 57.8 mtp -121.62 82.38 40.85 Favored Pre-proline 0 C--N 1.317 -0.822 1 O-C-N 114.663 -5.023 . . . . 56.759999999999998 106.468 -178.682 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -63.02 -19.14 68.36 Favored 'Trans proline' 0 N--CA 1.44 -1.642 1 C-N-CA 125.99 4.46 . . . . 46.969999999999999 116.327 -176.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . 0.271 13.3 p90 -73.17 -20.84 60.81 Favored 'General case' 1 C--N 1.232 -4.512 0 C-N-CA 129.99 3.316 . . . . 43.490000000000002 118.861 176.682 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . 0.285 57.0 t -75.82 133.81 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.393 0 C-N-CA 125.897 1.679 . . . . 47.490000000000002 112.152 176.333 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -54.21 126.7 23.96 Favored 'General case' 0 C--N 1.283 -2.309 0 C-N-CA 127.886 2.474 . . . . 65.829999999999998 108.173 173.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 44.7 m 69.13 16.76 8.55 Favored 'General case' 0 C--N 1.288 -2.092 0 C-N-CA 128.647 2.779 . . . . 55.079999999999998 111.199 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 80.57 157.1 14.76 Favored Glycine 1 C--O 1.167 -4.088 0 O-C-N 119.807 -1.808 . . . . 45.549999999999997 116.313 -172.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -158.69 176.77 35.53 Favored Glycine 0 N--CA 1.414 -2.802 0 CA-C-O 118.675 -1.069 . . . . 40.509999999999998 111.191 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 11.0 tt -164.24 144.93 2.28 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.084 0 C-N-CA 128.781 2.832 . . . . 40.829999999999998 111.993 -174.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -100.52 117.51 34.82 Favored 'General case' 0 C--N 1.279 -2.475 0 C-N-CA 131.542 3.937 . . . . 46.200000000000003 109.024 -173.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 65.5 t -116.05 113.74 41.58 Favored Pre-proline 0 C--N 1.278 -2.531 0 O-C-N 125.795 1.934 . . . . 47.5 108.474 -169.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -62.9 129.39 25.88 Favored 'Trans proline' 0 C--N 1.39 2.717 0 C-N-CA 124.158 3.239 . . . . 54.810000000000002 110.572 174.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . 0.267 13.1 t -167.91 142.76 3.02 Favored Pre-proline 0 C--O 1.17 -3.096 1 C-N-CA 133.701 4.8 . . . . 64.5 113.651 176.894 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -104.02 11.86 0.28 Allowed 'Trans proline' 0 C--N 1.39 2.738 3 CA-C-N 104.995 -4.323 . . . . 70.090000000000003 109.911 173.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -76.46 158.94 30.87 Favored 'General case' 0 C--N 1.249 -3.778 0 CA-C-N 120.69 1.586 . . . . 77.859999999999999 109.438 168.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . 0.284 5.8 mtm180 -107.25 141.43 38.58 Favored 'General case' 0 N--CA 1.428 -1.532 0 C-N-CA 118.647 -1.221 . . . . 88.040000000000006 109.024 -179.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' TYR . . . . . 1.002 ' OH ' ' O ' ' B' ' 638' ' ' HOH 0.278 88.2 m-85 -141.83 143.17 33.26 Favored 'General case' 0 C--O 1.19 -2.055 1 C-N-CA 134.971 5.308 . . . . 66.829999999999998 111.612 -165.87 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 43' ' ' MSE . . . . . . . . . . . . . 71.4 mtp -107.4 150.33 26.87 Favored 'General case' 0 C--N 1.252 -3.643 0 O-C-N 118.584 -2.573 . . . . 84.689999999999998 111.7 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.35 125.32 21.39 Favored 'General case' 0 C--O 1.198 -1.625 0 CA-C-O 116.478 -1.725 . . . . 55.100000000000001 108.383 175.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 103.43 -7.52 51.01 Favored Glycine 0 N--CA 1.408 -3.209 1 C-N-CA 131.556 4.408 . . . . 51.939999999999998 109.797 170.16 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . 0.252 71.5 m-20 -57.23 132.9 54.39 Favored 'General case' 0 C--N 1.268 -2.972 0 O-C-N 125.238 1.199 . . . . 55.0 111.244 171.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -52.36 122.2 8.32 Favored 'General case' 0 N--CA 1.405 -2.708 1 C-N-CA 137.883 6.473 . . . . 68.269999999999996 110.402 153.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.45 142.41 42.67 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.53 0 C-N-CA 113.139 -3.424 . . . . 54.090000000000003 107.485 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -99.04 120.29 39.22 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-O 123.884 1.802 . . . . 50.359999999999999 108.006 172.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.1 tp -112.58 135.82 52.85 Favored 'General case' 1 CA--C 1.344 -6.969 0 CA-C-N 113.252 -1.795 . . . . 49.600000000000001 110.991 177.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.63 115.99 27.35 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 128.023 3.327 . . . . 49.759999999999998 110.597 168.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 23.4 tp -120.05 123.85 44.44 Favored 'General case' 0 N--CA 1.421 -1.886 0 CA-C-N 114.759 -1.11 . . . . 46.619999999999997 113.206 -166.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . 0.29 0.3 OUTLIER -102.55 114.18 28.18 Favored 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 130.651 3.58 . . . . 51.469999999999999 118.137 167.852 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 58.5 mt -78.93 141.48 59.03 Favored Pre-proline 0 C--O 1.172 -3.003 1 C-N-CA 137.062 6.145 . . . . 57.560000000000002 110.823 177.912 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' PRO . . . . . 0.473 ' O ' ' C ' ' B' ' 56' ' ' ASP . 51.9 Cg_exo -51.34 137.81 47.0 Favored 'Trans proline' 1 C--N 1.43 4.82 3 C-N-CA 108.614 -7.124 . . . . 64.010000000000005 117.087 -176.739 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ASP . . . . . 0.473 ' C ' ' O ' ' B' ' 55' ' ' PRO 0.342 0.3 OUTLIER 45.82 34.46 1.88 Allowed 'General case' 0 N--CA 1.418 -2.036 2 O-C-N 108.081 -9.137 . . . . 74.689999999999998 117.192 -174.836 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -98.36 161.46 13.68 Favored 'General case' 0 C--O 1.19 -2.071 1 O-C-N 115.514 -4.491 . . . . 69.930000000000007 108.917 168.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' SER . . . . . 0.754 ' O ' ' HG2' ' C' ' 43' ' ' MSE . 47.5 p -107.04 -13.97 15.05 Favored 'General case' 0 C--N 1.287 -2.124 0 C-N-CA 115.733 -2.387 . . . . 67.609999999999999 111.969 173.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -105.01 144.03 32.38 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 131.436 3.894 . . . . 70.390000000000001 113.284 -174.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 -95.52 127.23 41.39 Favored 'General case' 0 C--N 1.277 -2.571 1 C-N-CA 135.29 5.436 . . . . 68.909999999999997 110.425 172.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.11 109.48 60.74 Favored Pre-proline 0 C--N 1.256 -3.495 1 C-N-CA 132.109 4.164 . . . . 51.729999999999997 108.855 -173.136 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 62' ' ' PRO . . . . . 0.454 ' HD2' ' O ' ' B' ' 420' ' ' HOH . 6.8 Cg_exo -77.96 136.41 14.81 Favored 'Trans proline' 1 C--N 1.432 4.927 3 CA-C-N 102.034 -5.381 . . . . 47.539999999999999 107.856 175.873 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 93.6 t -132.39 127.79 57.43 Favored 'Isoleucine or valine' 0 C--N 1.245 -3.948 0 O-C-N 126.494 2.371 . . . . 45.619999999999997 106.665 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ALA . . . . . 0.5 ' O ' ' HD3' ' B' ' 88' ' ' PRO . . . -101.18 94.45 5.97 Favored 'General case' 0 C--N 1.281 -2.394 0 N-CA-C 105.731 -1.952 . . . . 46.600000000000001 105.731 176.407 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . -110.12 176.52 19.18 Favored Glycine 0 N--CA 1.41 -3.037 0 CA-C-N 114.245 -1.343 . . . . 46.780000000000001 113.2 -165.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 49.7 tttt -133.97 136.9 44.47 Favored 'General case' 0 C--O 1.176 -2.806 0 O-C-N 127.409 2.476 . . . . 59.780000000000001 107.577 -174.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . 0.313 94.9 t -71.15 106.79 2.03 Favored 'Isoleucine or valine' 0 C--N 1.249 -3.779 1 C-N-CA 133.463 4.705 . . . . 46.789999999999999 112.475 176.877 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -115.58 -7.02 12.08 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.081 0 O-C-N 120.999 -1.063 . . . . 48.869999999999997 111.556 -170.325 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' TRP . . . . . . . . . . . . . 12.6 t-105 -167.86 135.8 2.34 Favored 'General case' 0 C--N 1.271 -2.843 0 C-N-CA 124.862 1.265 . . . . 64.040000000000006 109.007 -167.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' THR . . . . . . . . . . . . . 23.3 p -117.75 161.45 19.69 Favored 'General case' 0 C--N 1.307 -1.265 0 C-N-CA 130.273 3.429 . . . . 62.060000000000002 108.835 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 19.9 m -151.71 130.79 6.52 Favored Pre-proline 0 C--O 1.154 -3.956 1 C-N-CA 133.429 4.691 . . . . 72.599999999999994 114.043 172.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' PRO . . . . . 0.45 ' O ' ' HB3' ' B' ' 73' ' ' ALA . 72.9 Cg_endo -88.82 19.17 1.35 Allowed 'Trans proline' 0 CA--C 1.589 3.272 2 C-N-CA 125.835 4.356 . . . . 79.760000000000005 122.593 177.562 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' B' ' 72' ' ' PRO . . . 83.24 115.6 0.05 Allowed 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 116.552 2.056 . . . . 83.159999999999997 116.552 -175.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -80.3 -76.97 0.98 Allowed Glycine 0 N--CA 1.478 1.445 0 CA-C-N 116.515 -0.311 . . . . 85.870000000000005 113.609 -178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . 0.431 . . . . . . . 0 CA--C 1.489 -1.369 0 CA-C-O 127.214 3.388 . . . . 86.700000000000003 114.083 173.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 6.3 t30 . . . . . 0 C--O 1.254 1.304 0 CA-C-O 123.932 1.825 . . . . 87.489999999999995 112.006 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . 0.25 0.7 OUTLIER -62.48 142.46 57.9 Favored 'General case' 0 N--CA 1.415 -2.193 0 O-C-N 117.094 -3.504 . . . . 85.099999999999994 111.201 -167.1 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.92 153.84 42.33 Favored 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 130.508 3.523 . . . . 73.340000000000003 109.833 173.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.28 138.4 26.56 Favored 'General case' 0 C--N 1.269 -2.903 0 CA-C-N 109.676 -3.42 . . . . 63.740000000000002 109.378 168.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . 164.79 -170.38 39.85 Favored Glycine 0 N--CA 1.408 -3.183 0 N-CA-C 121.565 3.386 . . . . 55.719999999999999 121.565 -177.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.6 pt -131.98 146.46 33.24 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.73 0 C-N-CA 125.709 1.604 . . . . 47.560000000000002 111.081 -171.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.0 111.09 3.29 Favored Glycine 0 N--CA 1.409 -3.141 1 C-N-CA 138.846 7.879 . . . . 41.270000000000003 111.614 164.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . 0.263 86.0 t -112.29 117.89 56.37 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.082 0 O-C-N 116.972 -3.663 . . . . 40.960000000000001 109.444 -173.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -92.0 126.0 36.91 Favored 'General case' 0 N--CA 1.415 -2.211 0 C-N-CA 124.548 1.139 . . . . 46.25 111.822 175.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . 0.412 2.4 m-30 -54.01 136.69 57.15 Favored Pre-proline 0 C--O 1.173 -2.971 2 CA-C-O 136.328 7.728 . . . . 45.590000000000003 113.114 172.656 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' B' ' 64' ' ' ALA . 73.1 Cg_endo -71.0 164.79 34.55 Favored 'Trans proline' 0 C--N 1.395 3.026 2 C-N-CA 104.891 -9.606 . . . . 51.340000000000003 109.243 -179.378 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.54 138.42 58.5 Favored 'General case' 0 C--N 1.271 -2.81 1 C-N-CA 135.793 5.637 . . . . 67.659999999999997 115.024 162.684 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 90.74 -175.15 40.11 Favored Glycine 0 N--CA 1.41 -3.06 0 CA-C-O 116.117 -2.491 . . . . 65.620000000000005 116.088 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -43.02 -46.34 8.94 Favored 'Trans proline' 0 C--O 1.276 2.413 1 C-N-CA 129.049 6.499 . . . . 69.329999999999998 118.766 -169.676 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . 0.491 21.5 mt-10 -75.02 -26.73 59.71 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 116.593 2.072 . . . . 82.290000000000006 116.593 -175.757 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' GLY . . . . . 0.472 ' O ' ' C ' ' B' ' 94' ' ' GLU . . . -79.8 -41.15 13.11 Favored Glycine 0 CA--C 1.473 -2.581 1 CA-C-O 132.646 6.692 . . . . 71.0 109.04 179.089 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . 0.509 ' HG3' HH11 ' B' ' 97' ' ' ARG . 7.6 tt0 -60.82 -44.41 96.94 Favored 'General case' 0 C--N 1.306 -1.3 1 O-C-N 104.109 -11.23 . . . . 77.230000000000004 112.204 172.96 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.3 -43.31 74.7 Favored 'General case' 0 N--CA 1.422 -1.863 0 N-CA-C 116.505 2.039 . . . . 64.819999999999993 116.505 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 59.0 t -64.61 -43.11 96.71 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.983 0 C-N-CA 125.725 1.61 . . . . 62.880000000000003 106.758 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ARG . . . . . 0.669 ' NH2' ' O ' ' B' ' 446' ' ' HOH . 24.6 ttp85 -66.78 -45.02 79.76 Favored 'General case' 0 C--N 1.255 -3.503 0 CA-C-O 127.624 3.583 . . . . 71.459999999999994 107.199 -171.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . 0.805 ' O ' HG23 ' B' ' 102' ' ' THR . 1.0 OUTLIER -62.97 -42.44 99.83 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 109.53 -3.486 . . . . 67.480000000000004 108.756 -179.722 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.268 45.8 mttp -61.23 -40.84 95.52 Favored 'General case' 0 C--O 1.185 -2.295 0 CA-C-N 121.222 1.828 . . . . 67.5 114.075 176.34 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ILE . . . . . 0.54 HG23 HD21 ' B' ' 21' ' ' LEU . 41.5 mt -63.76 -58.2 8.41 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.891 0 CA-C-N 114.568 -1.196 . . . . 61.340000000000003 108.008 -179.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -57.02 -41.5 78.67 Favored 'General case' 0 N--CA 1.399 -3.0 0 CA-C-O 124.203 1.954 . . . . 73.129999999999995 113.41 -172.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' THR . . . . . 0.805 HG23 ' O ' ' B' ' 98' ' ' ASN 0.378 0.1 OUTLIER -60.78 -38.26 84.72 Favored 'General case' 0 N--CA 1.424 -1.767 0 O-C-N 118.329 -2.732 . . . . 67.519999999999996 109.377 174.131 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 103' ' ' LEU . . . . . 0.605 ' O ' ' HE2' ' B' ' 18' ' ' LYS . 32.1 mt -66.99 -29.23 69.01 Favored 'General case' 0 N--CA 1.426 -1.638 0 O-C-N 118.797 -2.439 . . . . 66.510000000000005 116.996 176.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 81.9 mt -98.92 -5.82 30.01 Favored 'General case' 1 C--N 1.244 -4.006 0 CA-C-N 114.645 -1.161 . . . . 70.629999999999995 111.051 -172.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.56 -43.93 83.72 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-O 115.969 -1.967 . . . . 79.0 106.889 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.744 1 C-N-CA 134.29 5.709 . . . . 84.730000000000004 118.56 177.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . 0.391 14.0 mm-40 . . . . . 0 C--O 1.247 0.955 0 N-CA-C 117.296 2.332 . . . . 88.920000000000002 117.296 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' GLY . . . . . . . . . . . . . . . 73.83 -165.5 54.78 Favored Glycine 0 C--N 1.297 -1.609 1 C-N-CA 132.789 4.995 . . . . 82.920000000000002 116.461 -177.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ILE . . . . . 0.428 HG12 ' CD2' ' C' ' 49' ' ' PHE . 12.4 mt -90.52 129.56 41.16 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.611 1 CA-C-N 124.239 4.019 . . . . 76.530000000000001 113.198 -177.543 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 11' ' ' LEU . . . . . . . . . . . . . 19.3 tp -99.25 115.92 30.24 Favored 'General case' 0 C--O 1.199 -1.575 0 CA-C-N 111.246 -2.706 . . . . 67.189999999999998 107.609 170.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 4.0 p -112.23 156.86 21.66 Favored 'General case' 0 C--N 1.261 -3.268 0 N-CA-C 119.146 3.017 . . . . 58.030000000000001 119.146 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 66.5 tp -150.03 113.27 4.9 Favored 'General case' 0 C--O 1.187 -2.194 0 N-CA-C 105.615 -1.994 . . . . 50.789999999999999 105.615 -174.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' ALA . . . . . . . . . . . . . . . -107.12 119.24 38.86 Favored 'General case' 2 CA--C 1.408 -4.489 0 CA-C-O 128.009 3.766 . . . . 49.420000000000002 108.933 171.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 15' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' C' ' 21' ' ' LEU . 11.1 mt -103.99 108.77 20.26 Favored 'General case' 0 N--CA 1.415 -2.222 1 O-C-N 116.13 -4.106 . . . . 53.979999999999997 115.399 177.7 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LYS . . . . . 0.665 ' HE2' ' O ' ' C' ' 500' ' ' HOH . 17.9 tttt -54.72 -41.97 70.98 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 117.614 2.45 . . . . 68.219999999999999 117.614 -175.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -147.88 172.76 13.65 Favored 'General case' 1 C--O 1.117 -5.891 0 CA-C-N 122.595 2.452 . . . . 61.149999999999999 115.541 -175.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -62.89 -28.05 69.78 Favored 'General case' 0 N--CA 1.467 0.414 1 O-C-N 114.975 -4.828 . . . . 65.010000000000005 112.195 -177.626 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.52 77.99 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 117.247 -1.358 . . . . 54.93 107.729 172.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' ALA . . . . . . . . . . . . 0.25 . . -73.5 -38.89 65.2 Favored 'General case' 0 C--O 1.185 -2.296 0 O-C-N 125.36 1.663 . . . . 50.630000000000003 107.559 -163.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LEU . . . . . 0.665 HD21 HG23 ' C' ' 100' ' ' ILE . 40.2 tp -57.64 -54.34 47.97 Favored 'General case' 0 N--CA 1.418 -2.064 0 O-C-N 126.245 2.216 . . . . 51.670000000000002 107.803 171.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 22' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -56.0 -43.41 77.66 Favored 'General case' 0 C--O 1.197 -1.674 0 CA-C-N 119.966 1.257 . . . . 49.299999999999997 111.937 -175.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' SER . . . . . . . . . . . . . 7.8 t -62.6 -42.67 99.71 Favored 'General case' 1 N--CA 1.377 -4.122 0 O-C-N 126.428 2.33 . . . . 53.369999999999997 115.026 179.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . 0.35 . . -81.06 -32.74 33.9 Favored 'General case' 0 C--O 1.201 -1.492 0 C-N-CA 127.724 2.409 . . . . 45.07 113.465 -173.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 25' ' ' TYR . . . . . 0.607 ' O ' ' HD3' ' C' ' 27' ' ' PRO . 43.6 t80 -68.94 139.44 55.07 Favored 'General case' 1 C--O 1.127 -5.378 1 CA-C-O 133.117 6.199 . . . . 45.509999999999998 114.088 -177.34 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 26' ' ' MSE . . . . . 1.156 ' HG2' ' O ' ' C' ' 425' ' ' HOH . 60.5 mtp -120.42 87.8 41.38 Favored Pre-proline 0 C--N 1.312 -1.062 1 O-C-N 107.544 -9.472 . . . . 59.100000000000001 106.186 -178.718 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 27' ' ' PRO . . . . . 0.607 ' HD3' ' O ' ' C' ' 25' ' ' TYR . 13.2 Cg_endo -60.73 -29.0 87.44 Favored 'Trans proline' 0 N--CA 1.432 -2.146 0 N-CA-C 118.995 2.652 . . . . 46.700000000000003 118.995 -176.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 28' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -73.99 -12.44 60.64 Favored 'General case' 0 C--N 1.275 -2.637 1 C-N-CA 136.383 5.873 . . . . 42.840000000000003 116.29 179.571 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 29' ' ' VAL . . . . . . . . . . . . . 70.1 t -75.55 137.38 22.97 Favored 'Isoleucine or valine' 0 C--N 1.258 -3.394 0 C-N-CA 125.831 1.652 . . . . 44.07 111.651 169.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -60.34 143.3 53.3 Favored 'General case' 0 N--CA 1.417 -2.089 0 O-C-N 118.742 -2.474 . . . . 63.340000000000003 112.509 170.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' SER . . . . . . . . . . . . 0.34 1.7 m 61.43 6.81 1.54 Allowed 'General case' 0 N--CA 1.411 -2.398 0 N-CA-C 115.689 1.736 . . . . 54.920000000000002 115.689 -176.088 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 70.46 138.14 0.14 Allowed Glycine 0 C--O 1.213 -1.187 0 C-N-CA 126.998 2.237 . . . . 48.979999999999997 112.804 -177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -127.53 -160.94 10.64 Favored Glycine 0 N--CA 1.473 1.11 0 CA-C-N 112.115 -2.043 . . . . 47.5 109.988 -173.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' ILE . . . . . 0.443 HG22 ' HE1' ' C' ' 87' ' ' PHE . 16.2 tt 179.01 137.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 122.426 1.108 . . . . 47.609999999999999 109.062 176.651 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 35' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -86.97 127.4 35.08 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 109.081 -0.711 . . . . 50.380000000000003 109.081 175.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 91.1 t -120.49 113.78 33.39 Favored Pre-proline 0 C--O 1.168 -3.236 0 N-CA-C 107.845 -1.169 . . . . 49.640000000000001 107.845 -176.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -67.04 137.43 44.38 Favored 'Trans proline' 1 C--N 1.418 4.225 1 C-N-CA 111.572 -5.152 . . . . 58.539999999999999 117.844 170.981 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 38' ' ' THR . . . . . . . . . . . . . 12.6 t -174.08 133.39 0.56 Allowed Pre-proline 0 C--O 1.172 -3.025 1 C-N-CA 137.454 6.302 . . . . 64.390000000000001 111.795 -172.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 39' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -93.2 9.03 2.46 Favored 'Trans proline' 0 N--CA 1.419 -2.901 2 C-N-CA 108.619 -7.121 . . . . 66.799999999999997 111.722 169.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 35.7 mttp -69.43 171.43 8.73 Favored 'General case' 0 C--N 1.263 -3.192 0 CA-C-N 121.874 2.124 . . . . 73.519999999999996 107.891 172.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' ARG . . . . . . . . . . . . . 13.2 mtm105 -118.49 122.01 41.66 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 105.716 -1.957 . . . . 79.560000000000002 105.716 -177.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' TYR . . . . . 0.458 ' CE2' HG22 ' C' ' 48' ' ' VAL . 78.4 m-85 -125.23 155.92 39.32 Favored 'General case' 1 C--O 1.13 -5.222 0 O-C-N 127.471 2.982 . . . . 64.879999999999995 111.419 -174.724 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 43' ' ' MSE . . . . . 0.754 ' HG2' ' O ' ' B' ' 58' ' ' SER . 80.6 mtp -113.45 150.43 32.8 Favored 'General case' 0 C--N 1.311 -1.096 0 O-C-N 117.117 -3.489 . . . . 85.340000000000003 112.758 174.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.26 132.49 53.18 Favored 'General case' 0 C--O 1.191 -1.98 0 N-CA-C 106.517 -1.66 . . . . 55.380000000000003 106.517 179.162 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 45' ' ' GLY . . . . . . . . . . . . . . . 88.52 -13.76 61.44 Favored Glycine 0 N--CA 1.403 -3.535 0 C-N-CA 128.842 3.115 . . . . 53.380000000000003 114.153 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -52.09 152.19 3.34 Favored 'General case' 0 N--CA 1.412 -2.334 0 C-N-CA 116.311 -2.155 . . . . 54.979999999999997 112.7 170.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' GLU . . . . . 0.813 ' HG3' ' O ' ' C' ' 646' ' ' HOH . 0.0 OUTLIER -83.89 129.43 34.93 Favored 'General case' 0 N--CA 1.416 -2.138 1 C-N-CA 132.009 4.124 . . . . 67.200000000000003 109.458 167.855 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' C' C ' 48' ' ' VAL . . . . . 0.458 HG22 ' CE2' ' C' ' 42' ' ' TYR . 34.9 t -124.48 131.72 72.36 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.927 0 CA-C-O 116.488 -1.72 . . . . 56.560000000000002 109.39 -179.529 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 49' ' ' PHE . . . . . 0.428 ' CD2' HG12 ' C' ' 10' ' ' ILE 0.371 9.4 t80 -92.15 117.24 29.66 Favored 'General case' 0 C--N 1.26 -3.324 0 C-N-CA 126.818 2.047 . . . . 51.469999999999999 111.367 167.199 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 50' ' ' LEU . . . . . . . . . . . . . 36.7 tp -122.61 128.42 50.65 Favored 'General case' 0 C--O 1.196 -1.74 0 CA-C-N 113.15 -1.841 . . . . 49.439999999999998 109.898 -174.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' C' ' 51' ' ' LEU . 2.3 tp -95.97 115.43 27.42 Favored 'General case' 0 CA--C 1.454 -2.733 0 C-N-CA 126.33 1.852 . . . . 50.009999999999998 111.223 166.04 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 44.5 tp -116.24 120.77 40.02 Favored 'General case' 0 C--N 1.292 -1.915 0 O-C-N 118.613 -2.555 . . . . 48.479999999999997 110.233 -173.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -100.61 113.41 26.23 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 115.56 1.689 . . . . 50.700000000000003 115.56 165.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' LEU . . . . . . . . . . . . 0.476 30.6 mt -71.48 143.11 87.28 Favored Pre-proline 0 C--N 1.255 -3.531 1 C-N-CA 132.014 4.126 . . . . 55.729999999999997 116.788 173.36 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 55' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.09 139.69 71.14 Favored 'Trans proline' 1 C--N 1.434 5.078 1 C-N-CA 108.157 -7.428 . . . . 62.649999999999999 114.595 -174.558 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 56' ' ' ASP . . . . . . . . . . . . 0.499 0.1 OUTLIER 35.03 44.06 0.12 Allowed 'General case' 0 N--CA 1.416 -2.137 1 CA-C-O 129.1 4.286 . . . . 71.260000000000005 118.739 -174.764 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 57' ' ' SER . . . . . . . . . . . . . 3.6 t -97.09 152.68 18.54 Favored 'General case' 0 C--O 1.187 -2.193 0 O-C-N 118.16 -2.837 . . . . 67.569999999999993 105.446 169.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' SER . . . . . . . . . . . . . 45.3 p -104.55 11.78 33.89 Favored 'General case' 1 C--O 1.131 -5.162 2 CA-C-O 136.574 7.845 . . . . 66.109999999999999 109.011 175.369 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . 0.3 4.9 pt-20 -129.84 152.6 49.14 Favored 'General case' 0 C--N 1.302 -1.46 1 O-C-N 100.579 -13.826 . . . . 74.170000000000002 113.01 -173.862 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 60' ' ' ARG . . . . . . . . . . . . . 76.9 mtt85 -112.34 116.82 30.98 Favored 'General case' 0 C--N 1.271 -2.837 1 C-N-CA 133.456 4.702 . . . . 62.960000000000001 108.133 177.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 18.2 mt -96.62 106.2 28.26 Favored Pre-proline 0 C--O 1.17 -3.113 0 C-N-CA 129.442 3.097 . . . . 51.060000000000002 114.477 -176.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' PRO . . . . . 0.471 ' HD2' ' O ' ' C' ' 631' ' ' HOH . 39.6 Cg_endo -80.72 138.05 11.66 Favored 'Trans proline' 1 C--N 1.432 4.972 1 C-N-CA 109.439 -6.574 . . . . 47.68 110.791 -179.235 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . 0.435 1.5 m -130.27 116.34 35.93 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.287 0 C-N-CA 130.464 3.506 . . . . 45.280000000000001 109.505 -175.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.14 83.53 6.0 Favored 'General case' 0 C--N 1.279 -2.477 1 CA-C-O 132.139 5.733 . . . . 45.869999999999997 108.985 170.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 65' ' ' GLY . . . . . . . . . . . . . . . -100.66 179.42 29.11 Favored Glycine 0 C--N 1.291 -1.937 1 O-C-N 102.832 -12.417 . . . . 44.969999999999999 111.484 -167.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 66' ' ' LYS . . . . . . . . . . . . . 51.4 tttt -125.02 137.05 54.24 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 126.916 2.186 . . . . 54.640000000000001 114.755 172.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' VAL . . . . . 0.456 HG23 HG23 ' C' ' 48' ' ' VAL . 72.3 t -75.6 115.83 17.61 Favored 'Isoleucine or valine' 0 C--N 1.253 -3.591 0 CA-C-O 116.493 -1.717 . . . . 43.700000000000003 109.302 -178.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 68' ' ' VAL . . . . . . . . . . . . 0.286 4.3 m -114.91 -3.33 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.961 0 N-CA-C 117.32 2.341 . . . . 48.530000000000001 117.32 -175.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 69' ' ' TRP . . . . . . . . . . . . . 73.5 t-105 -172.39 133.76 0.66 Allowed 'General case' 0 C--O 1.191 -2.02 0 C-N-CA 130.466 3.506 . . . . 62.700000000000003 111.644 -169.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 68.1 p -117.96 150.75 38.73 Favored 'General case' 0 C--N 1.284 -2.279 1 O-C-N 112.139 -6.601 . . . . 65.060000000000002 115.001 171.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.3 m -143.62 101.49 5.06 Favored Pre-proline 0 C--O 1.164 -3.416 0 C-N-CA 128.381 2.672 . . . . 76.150000000000006 115.871 170.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' PRO . . . . . 0.482 ' O ' ' CB ' ' C' ' 73' ' ' ALA . 10.8 Cg_endo -56.46 4.33 0.07 OUTLIER 'Trans proline' 1 C--N 1.437 5.21 1 CA-C-N 105.635 -4.095 . . . . 84.609999999999999 118.115 -179.4 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 73' ' ' ALA . . . . . 0.482 ' CB ' ' O ' ' C' ' 72' ' ' PRO . . . . . . . . 0 C--O 1.291 3.285 0 CA-C-N 120.464 1.484 . . . . 85.370000000000005 112.377 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' ARG . . . . . 0.955 ' NH2' ' O ' ' C' ' 628' ' ' HOH . 60.9 ttt180 . . . . . 0 N--CA 1.497 1.884 0 CA-C-O 120.339 0.114 . . . . 78.510000000000005 111.175 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' ALA . . . . . 0.708 ' H ' ' HG2' ' C' ' 79' ' ' ARG . . . -83.38 161.81 21.24 Favored 'General case' 0 C--O 1.204 -1.308 0 N-CA-C 114.053 1.131 . . . . 68.310000000000002 114.053 173.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.96 153.67 32.9 Favored 'General case' 0 C--N 1.286 -2.174 0 C-N-CA 127.152 2.181 . . . . 62.509999999999998 106.363 174.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' GLY . . . . . . . . . . . . . . . 141.37 -164.57 26.57 Favored Glycine 1 C--O 1.092 -8.773 0 C-N-CA 126.463 1.982 . . . . 57.009999999999998 117.185 -176.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 83' ' ' ILE . . . . . . . . . . . . . 41.8 pt -137.35 148.12 26.24 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.816 0 C-N-CA 128.175 2.59 . . . . 48.609999999999999 113.39 -162.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . -89.37 116.64 4.75 Favored Glycine 0 C--N 1.276 -2.802 0 C-N-CA 129.173 3.273 . . . . 41.060000000000002 108.874 170.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 40.6 t -110.93 114.22 46.48 Favored 'Isoleucine or valine' 0 C--N 1.254 -3.574 0 C-N-CA 128.231 2.612 . . . . 40.82 111.564 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -81.55 136.87 35.59 Favored 'General case' 0 N--CA 1.416 -2.163 0 C-N-CA 125.321 1.449 . . . . 43.420000000000002 108.967 175.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' PHE . . . . . 0.443 ' HE1' HG22 ' C' ' 34' ' ' ILE 0.288 2.7 m-30 -70.29 146.6 94.63 Favored Pre-proline 0 C--N 1.25 -3.748 1 CA-C-O 129.847 4.641 . . . . 44.789999999999999 112.123 170.872 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 88' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -72.85 161.25 44.21 Favored 'Trans proline' 0 C--N 1.397 3.082 1 C-N-CA 107.5 -7.867 . . . . 51.060000000000002 110.366 -178.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 89' ' ' ASP . . . . . . . . . . . . 0.273 16.8 m-20 -57.32 129.06 40.12 Favored 'General case' 0 C--N 1.281 -2.398 1 C-N-CA 134.869 5.267 . . . . 69.469999999999999 112.839 156.616 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 114.99 -169.7 12.96 Favored Glycine 1 C--N 1.247 -4.377 0 CA-C-O 125.446 2.692 . . . . 64.620000000000005 107.941 168.828 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 91' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -54.2 -45.96 37.12 Favored 'Trans proline' 1 C--N 1.422 4.446 1 CA-C-N 103.14 -6.53 . . . . 65.140000000000001 120.89 -174.497 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 92' ' ' GLU . . . . . . . . . . . . . . . -62.56 -38.21 89.17 Favored 'General case' 0 C--N 1.271 -2.816 0 O-C-N 118.395 -2.691 . . . . 64.519999999999996 116.775 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 93' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' C' ' 94' ' ' GLU . . . -69.13 -47.83 50.82 Favored Glycine 1 C--O 1.137 -5.956 2 C-N-CA 133.088 5.137 . . . . 64.950000000000003 111.858 176.241 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 94' ' ' GLU . . . . . 0.732 ' CD ' HH11 ' C' ' 97' ' ' ARG . 5.6 tp10 -64.19 -30.41 71.47 Favored 'General case' 0 C--N 1.28 -2.432 1 O-C-N 109.391 -8.123 . . . . 74.879999999999995 111.039 176.538 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.82 -43.54 92.78 Favored 'General case' 0 C--O 1.2 -1.527 0 C-N-CA 117.617 -1.633 . . . . 66.310000000000002 109.45 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.76 -41.36 79.88 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.904 0 CA-C-O 124.538 2.113 . . . . 64.739999999999995 105.898 -169.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' ARG . . . . . 0.732 HH11 ' CD ' ' C' ' 94' ' ' GLU . 27.7 ttp180 -65.52 -39.97 92.42 Favored 'General case' 0 C--O 1.161 -3.576 0 CA-C-N 109.694 -3.412 . . . . 73.680000000000007 107.418 -175.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 98' ' ' ASN . . . . . 0.651 ' O ' HG23 ' C' ' 102' ' ' THR 0.272 86.6 m-20 -62.89 -55.05 29.57 Favored 'General case' 0 C--N 1.267 -3.014 0 C-N-CA 125.242 1.417 . . . . 70.700000000000003 113.86 178.489 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 99' ' ' LYS . . . . . . . . . . . . 0.291 13.0 mttm -45.15 -54.21 7.13 Favored 'General case' 0 C--O 1.196 -1.716 0 O-C-N 117.978 -2.951 . . . . 66.439999999999998 115.316 165.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 100' ' ' ILE . . . . . 0.665 HG23 HD21 ' C' ' 21' ' ' LEU 0.251 65.9 mt -58.14 -50.88 76.74 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.935 0 O-C-N 120.024 -1.672 . . . . 63.079999999999998 109.962 -175.995 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -61.59 -33.13 73.35 Favored 'General case' 0 C--N 1.271 -2.812 0 CA-C-N 115.312 -0.858 . . . . 74.909999999999997 110.477 -172.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 102' ' ' THR . . . . . 0.651 HG23 ' O ' ' C' ' 98' ' ' ASN 0.509 0.5 OUTLIER -66.85 -44.73 80.25 Favored 'General case' 0 CA--C 1.477 -1.861 0 CA-C-O 125.424 2.535 . . . . 67.930000000000007 110.357 171.659 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' C' C ' 103' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.63 -15.75 61.68 Favored 'General case' 0 N--CA 1.422 -1.861 1 O-C-N 112.764 -6.21 . . . . 66.390000000000001 116.971 176.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -107.66 -4.73 17.95 Favored 'General case' 0 C--N 1.265 -3.091 0 C-N-CA 117.632 -1.627 . . . . 68.099999999999994 114.25 -168.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -31.91 102.27 0.02 OUTLIER 'General case' 0 C--N 1.281 -2.372 1 C-N-CA 132.261 4.224 . . . . 73.739999999999995 114.089 160.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 106' ' ' GLY . . . . . 1.285 ' C ' ' OXT' ' C' ' 106' ' ' GLY . . . . . . . . 0 CA--C 1.482 -2.006 1 CA-C-O 130.51 5.505 . . . . 76.0 118.413 178.611 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 1.178 ' O ' ' HG2' ' A' ' 26' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . 0.536 ' O ' ' OG1' ' A' ' 53' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 298' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 449' ' ' HOH . . . . . 0.469 ' O ' ' NH2' ' A' ' 79' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 492' ' ' HOH . . . . . 0.861 ' O ' ' HB3' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 618' ' ' HOH . . . . . 0.443 ' O ' ' HD2' ' A' ' 62' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 635' ' ' HOH . . . . . 0.593 ' O ' ' HB3' ' A' ' 57' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 636' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 651' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 653' ' ' HOH . . . . . 0.593 ' O ' ' HG2' ' A' ' 47' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 654' ' ' HOH . . . . . 1.137 ' O ' ' HD3' ' A' ' 40' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 350' ' ' HOH . . . . . 1.223 ' O ' ' HG2' ' B' ' 26' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 399' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 403' ' ' HOH . . . . . 0.558 ' O ' ' O ' ' B' ' 20' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 420' ' ' HOH . . . . . 0.454 ' O ' ' HD2' ' B' ' 62' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 446' ' ' HOH . . . . . 0.669 ' O ' ' NH2' ' B' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 634' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 638' ' ' HOH . . . . . 1.002 ' O ' ' OH ' ' B' ' 42' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 639' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 642' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 643' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 649' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 425' ' ' HOH . . . . . 1.156 ' O ' ' HG2' ' C' ' 26' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 500' ' ' HOH . . . . . 0.665 ' O ' ' HE2' ' C' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 628' ' ' HOH . . . . . 0.955 ' O ' ' NH2' ' C' ' 79' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 631' ' ' HOH . . . . . 0.471 ' O ' ' HD2' ' C' ' 62' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 632' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 633' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 640' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 645' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 646' ' ' HOH . . . . . 0.813 ' O ' ' HG3' ' C' ' 47' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.229 0 CA-C-O 114.876 -2.487 . . . . 83.549999999999997 107.605 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.8 164.19 36.52 Favored Glycine 0 N--CA 1.409 -3.15 0 N-CA-C 120.636 3.014 . . . . 76.730000000000004 120.636 163.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.2 mt -98.18 142.73 14.07 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.934 0 C-N-CA 114.871 -2.732 . . . . 71.709999999999994 104.52 -178.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 26.5 tp -107.16 114.37 28.39 Favored 'General case' 1 C--N 1.244 -4.005 0 O-C-N 127.239 2.837 . . . . 64.159999999999997 108.749 172.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.0 137.2 32.54 Favored 'General case' 0 C--N 1.28 -2.421 0 N-CA-C 121.165 3.765 . . . . 56.43 121.165 177.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.378 25.9 tp -136.14 105.85 6.18 Favored 'General case' 0 N--CA 1.415 -2.195 1 C-N-CA 133.601 4.76 . . . . 50.259999999999998 119.394 171.141 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -113.54 122.57 47.65 Favored 'General case' 0 N--CA 1.515 2.794 0 C-N-CA 116.411 -2.116 . . . . 50.229999999999997 106.333 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.61 HD13 ' HA ' ' A' ' 21' ' ' LEU 0.369 5.3 mt -103.25 106.42 16.94 Favored 'General case' 0 C--N 1.244 -3.988 0 C-N-CA 128.742 2.817 . . . . 52.640000000000001 113.719 -179.82 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.861 ' HB3' ' O ' ' A' ' 492' ' ' HOH 0.474 2.6 tptm -56.44 -40.11 74.23 Favored 'General case' 0 C--N 1.288 -2.09 0 N-CA-C 119.552 3.167 . . . . 67.849999999999994 119.552 177.063 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -150.52 -178.61 6.64 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 118.226 -2.796 . . . . 59.289999999999999 110.319 -174.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -65.26 -24.99 67.47 Favored 'General case' 0 N--CA 1.405 -2.676 0 C-N-CA 129.375 3.07 . . . . 68.549999999999997 115.289 175.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.56 -41.53 46.11 Favored 'General case' 0 C--O 1.16 -3.626 1 CA-C-O 131.505 5.431 . . . . 54.310000000000002 106.688 179.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . 0.518 . . -62.59 -41.82 99.19 Favored 'General case' 0 C--N 1.279 -2.49 1 O-C-N 111.226 -7.171 . . . . 49.640000000000001 118.211 174.875 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.61 ' HA ' HD13 ' A' ' 15' ' ' LEU 0.289 30.5 tp -53.25 -58.99 5.14 Favored 'General case' 0 N--CA 1.406 -2.647 0 C-N-CA 127.673 2.389 . . . . 48.439999999999998 111.489 166.585 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . 0.283 41.1 t80 -54.01 -44.42 70.88 Favored 'General case' 0 C--N 1.284 -2.245 1 C-N-CA 132.251 4.22 . . . . 51.299999999999997 112.23 -178.372 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . 0.593 1.3 p -72.25 -33.75 67.74 Favored 'General case' 0 C--N 1.271 -2.816 0 N-CA-C 121.006 3.706 . . . . 55.630000000000003 121.006 170.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.443 . . -69.37 -44.81 70.79 Favored 'General case' 0 C--O 1.195 -1.776 0 N-CA-C 116.786 2.143 . . . . 47.600000000000001 116.786 173.261 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . 0.384 29.0 t80 -57.56 133.75 55.53 Favored 'General case' 0 C--N 1.276 -2.607 0 CA-C-O 126.184 2.897 . . . . 48.810000000000002 113.157 -175.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' MSE . . . . . 1.178 ' HG2' ' O ' ' A' ' 203' ' ' HOH . 70.1 mtp -121.18 82.1 37.47 Favored Pre-proline 0 C--O 1.172 -2.989 1 O-C-N 110.96 -7.337 . . . . 57.810000000000002 105.984 -179.644 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.39 -24.55 75.74 Favored 'Trans proline' 0 N--CA 1.433 -2.082 0 C-N-CA 123.006 2.47 . . . . 46.789999999999999 117.269 -175.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -72.94 -8.81 57.38 Favored 'General case' 0 C--N 1.278 -2.531 0 C-N-CA 129.43 3.092 . . . . 42.020000000000003 115.771 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . 0.359 41.6 t -76.81 123.52 33.42 Favored 'Isoleucine or valine' 0 C--N 1.26 -3.299 0 C-N-CA 129.803 3.241 . . . . 45.159999999999997 115.768 171.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -56.08 137.42 51.32 Favored 'General case' 0 C--O 1.193 -1.87 0 O-C-N 117.253 -3.404 . . . . 63.549999999999997 107.106 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.3 m 77.79 -0.25 2.74 Favored 'General case' 1 C--O 1.135 -4.962 1 CA-C-O 133.33 6.3 . . . . 48.590000000000003 112.365 179.198 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.31 150.21 20.23 Favored Glycine 0 N--CA 1.4 -3.709 1 O-C-N 107.311 -9.618 . . . . 44.659999999999997 115.904 -170.814 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -156.77 174.82 34.45 Favored Glycine 0 C--O 1.206 -1.635 0 C-N-CA 115.365 -3.302 . . . . 40.770000000000003 107.403 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . 0.348 13.3 tt -151.22 142.45 16.29 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.45 0 CA-C-N 120.59 2.195 . . . . 39.43 113.302 -174.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -89.01 133.29 34.38 Favored 'General case' 0 C--N 1.29 -1.982 0 O-C-N 119.287 -2.133 . . . . 45.060000000000002 109.373 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.9 t -125.89 113.89 24.49 Favored Pre-proline 0 C--N 1.259 -3.369 0 CA-C-N 121.705 2.048 . . . . 46.759999999999998 109.987 -174.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.8 139.43 74.59 Favored 'Trans proline' 0 C--N 1.399 3.227 1 C-N-CA 111.123 -5.451 . . . . 54.979999999999997 117.008 170.917 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.6 t -179.06 138.85 0.34 Allowed Pre-proline 0 C--O 1.168 -3.23 1 C-N-CA 132.317 4.247 . . . . 60.82 112.923 178.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -93.02 -5.07 3.11 Favored 'Trans proline' 0 C--N 1.399 3.195 3 C-N-CA 108.956 -6.896 . . . . 65.569999999999993 112.465 171.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . 1.137 ' HD3' ' O ' ' A' ' 654' ' ' HOH . 13.5 mttp -57.42 161.77 3.23 Favored 'General case' 0 C--N 1.259 -3.345 0 CA-C-N 122.174 2.261 . . . . 71.620000000000005 108.636 170.386 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 41' ' ' ARG . 13.5 mtm180 -111.6 117.69 33.65 Favored 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 130.34 3.456 . . . . 79.049999999999997 107.092 -175.298 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -122.35 152.84 39.73 Favored 'General case' 1 C--O 1.14 -4.704 0 O-C-N 128.502 3.626 . . . . 65.590000000000003 109.289 -174.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' MSE . . . . . . . . . . . . . 87.5 mtp -112.61 153.89 26.87 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 117.526 -3.233 . . . . 82.409999999999997 111.421 173.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.56 140.62 58.65 Favored 'General case' 0 C--O 1.186 -2.265 0 CA-C-O 115.106 -2.378 . . . . 55.439999999999998 104.744 -178.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.83 4.1 52.96 Favored Glycine 1 N--CA 1.396 -4.026 2 O-C-N 131.63 5.581 . . . . 51.640000000000001 114.929 -172.133 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.45 155.54 11.87 Favored 'General case' 0 N--CA 1.415 -2.199 0 CA-C-N 121.343 2.572 . . . . 52.350000000000001 112.452 166.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 653' ' ' HOH . 6.0 mt-10 -88.41 126.4 35.2 Favored 'General case' 0 N--CA 1.421 -1.905 1 C-N-CA 132.633 4.373 . . . . 68.159999999999997 108.723 166.817 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.5 p -126.45 137.49 57.62 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.107 0 O-C-N 126.198 2.187 . . . . 53.939999999999998 108.283 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.569 ' HE1' ' HA ' ' B' ' 19' ' ' ALA . 32.5 t80 -95.37 118.57 32.35 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 119.825 1.193 . . . . 51.270000000000003 108.85 172.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -108.26 127.73 54.1 Favored 'General case' 0 C--N 1.266 -3.031 0 N-CA-C 107.762 -1.199 . . . . 48.890000000000001 107.762 -176.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.3 tp -103.36 113.56 27.15 Favored 'General case' 0 C--N 1.289 -2.039 0 CA-C-O 118.093 -0.956 . . . . 48.25 112.329 160.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -107.97 115.99 31.13 Favored 'General case' 0 C--N 1.262 -3.228 0 C-N-CA 129.469 3.108 . . . . 50.729999999999997 114.319 -166.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . 0.536 ' OG1' ' O ' ' A' ' 204' ' ' HOH . 0.7 OUTLIER -107.44 118.55 37.02 Favored 'General case' 0 C--O 1.189 -2.099 0 CA-C-N 120.239 1.381 . . . . 48.93 114.651 170.42 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.469 ' O ' ' C ' ' A' ' 55' ' ' PRO 0.252 0.0 OUTLIER -80.57 135.83 52.68 Favored Pre-proline 0 C--N 1.257 -3.414 1 C-N-CA 134.667 5.187 . . . . 56.329999999999998 114.148 -178.662 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.469 ' C ' ' O ' ' A' ' 54' ' ' LEU . 10.6 Cg_exo -42.42 130.97 5.06 Favored 'Trans proline' 1 C--N 1.438 5.237 1 C-N-CA 106.766 -8.356 . . . . 63.149999999999999 114.484 -179.561 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . 0.56 2.9 t70 66.4 17.54 10.69 Favored 'General case' 0 N--CA 1.422 -1.841 0 O-C-N 118.158 -2.839 . . . . 73.629999999999995 116.181 166.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . 0.593 ' HB3' ' O ' ' A' ' 635' ' ' HOH . 45.8 p -101.77 166.87 10.44 Favored 'General case' 0 C--O 1.206 -1.195 0 O-C-N 117.255 -3.403 . . . . 69.340000000000003 108.916 170.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.3 p -114.39 16.84 17.73 Favored 'General case' 1 C--O 1.132 -5.081 0 CA-C-O 127.607 3.575 . . . . 67.579999999999998 108.919 179.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.59 146.22 50.6 Favored 'General case' 0 C--N 1.286 -2.195 1 O-C-N 100.444 -13.91 . . . . 70.640000000000001 109.806 -173.179 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.6 mtt85 -112.53 119.44 38.2 Favored 'General case' 0 C--N 1.278 -2.514 1 C-N-CA 135.01 5.324 . . . . 65.140000000000001 108.38 174.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.419 6.4 mt -92.39 105.61 14.89 Favored Pre-proline 0 C--N 1.262 -3.233 1 C-N-CA 137.992 6.517 . . . . 52.700000000000003 115.89 -176.071 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.443 ' HD2' ' O ' ' A' ' 618' ' ' HOH . 3.0 Cg_exo -81.3 136.3 9.96 Favored 'Trans proline' 1 C--N 1.423 4.463 1 C-N-CA 109.059 -6.827 . . . . 48.219999999999999 107.412 -177.611 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.8 t -128.98 132.89 66.96 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.057 0 C-N-CA 128.955 2.902 . . . . 44.850000000000001 108.532 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -102.29 81.78 2.11 Favored 'General case' 0 C--N 1.274 -2.678 0 C-N-CA 131.566 3.946 . . . . 44.439999999999998 107.935 -179.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -104.24 174.9 22.52 Favored Glycine 0 C--O 1.191 -2.58 0 C-N-CA 113.966 -3.969 . . . . 45.240000000000002 110.375 -160.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -126.51 137.21 53.35 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 119.191 -1.003 . . . . 55.469999999999999 109.065 176.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.64 123.78 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.652 0 CA-C-O 117.477 -1.249 . . . . 45.909999999999997 110.868 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . 0.471 17.1 m -120.18 -9.8 10.55 Favored 'Isoleucine or valine' 0 C--N 1.263 -3.169 0 N-CA-C 118.021 2.6 . . . . 49.960000000000001 118.021 -175.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' TRP . . . . . . . . . . . . . 7.2 t-105 -173.33 136.48 0.62 Allowed 'General case' 0 N--CA 1.485 1.296 0 CA-C-N 113.598 -1.637 . . . . 68.400000000000006 112.529 -168.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.5 p -123.03 140.03 53.46 Favored 'General case' 0 C--O 1.182 -2.458 0 CA-C-O 128.152 3.834 . . . . 66.409999999999997 109.173 -177.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.1 m -116.63 97.34 50.07 Favored Pre-proline 0 C--N 1.284 -2.281 1 O-C-N 114.002 -5.436 . . . . 75.519999999999996 102.838 178.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo . . . . . 0 C--O 1.259 1.545 0 CA-C-O 124.322 1.717 . . . . 81.420000000000002 113.859 165.296 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 114.141 1.163 . . . . 83.239999999999995 114.141 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.469 ' NH2' ' O ' ' A' ' 449' ' ' HOH 0.402 0.0 OUTLIER 58.47 112.4 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.184 0 CA-C-O 127.344 3.449 . . . . 87.829999999999998 116.537 -164.314 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -88.11 156.09 19.45 Favored 'General case' 0 C--N 1.3 -1.551 0 C-N-CA 130.903 3.681 . . . . 73.280000000000001 117.234 -172.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.68 140.34 51.47 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-O 115.115 -2.374 . . . . 63.450000000000003 104.951 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 161.81 -155.58 26.87 Favored Glycine 0 N--CA 1.403 -3.523 2 C-N-CA 137.773 7.368 . . . . 56.140000000000001 125.204 -177.061 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 11.1 pt -138.73 147.98 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.777 0 O-C-N 119.894 -1.945 . . . . 47.990000000000002 114.511 -166.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -93.35 113.54 4.5 Favored Glycine 1 C--O 1.137 -5.96 0 C-N-CA 130.305 3.812 . . . . 40.340000000000003 108.263 172.01 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . 0.299 61.9 t -102.99 117.52 48.51 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.426 0 C-N-CA 129.922 3.289 . . . . 40.32 111.317 -176.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -90.6 136.47 33.04 Favored 'General case' 0 C--O 1.19 -2.063 0 CA-C-O 116.842 -1.551 . . . . 45.359999999999999 110.576 174.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.341 22.4 m-30 -68.28 143.98 96.24 Favored Pre-proline 0 C--N 1.276 -2.603 0 C-N-CA 130.027 3.331 . . . . 46.32 109.907 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.63 147.65 64.19 Favored 'Trans proline' 0 C--N 1.27 -3.561 1 O-C-N 109.041 -6.347 . . . . 51.920000000000002 111.896 175.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.2 p30 -76.51 154.85 34.24 Favored 'General case' 0 C--O 1.202 -1.439 0 O-C-N 119.456 -2.028 . . . . 68.010000000000005 111.551 172.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 108.31 -173.86 18.35 Favored Glycine 0 C--O 1.169 -3.94 0 C-N-CA 117.933 -2.079 . . . . 67.340000000000003 109.423 -172.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.65 -55.18 3.22 Favored 'Trans proline' 1 C--N 1.429 4.813 3 CA-C-N 102.469 -6.865 . . . . 68.75 115.196 -172.072 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.64 -26.46 33.13 Favored 'General case' 0 C--N 1.257 -3.444 1 C-N-CA 132.741 4.416 . . . . 81.170000000000002 115.006 -176.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -89.25 -48.06 3.9 Favored Glycine 0 C--N 1.268 -3.243 1 C-N-CA 132.621 4.915 . . . . 67.079999999999998 110.277 -178.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . 0.346 3.3 mm-40 -55.69 -32.21 63.08 Favored 'General case' 0 N--CA 1.419 -2.009 0 N-CA-C 117.495 2.405 . . . . 73.689999999999998 117.495 167.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.5 -45.26 76.34 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 115.307 1.595 . . . . 60.520000000000003 115.307 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . 0.447 6.4 t -60.31 -50.95 78.27 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.95 1 C-N-CA 131.866 4.066 . . . . 59.079999999999998 111.633 171.618 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -55.55 -44.07 76.44 Favored 'General case' 0 C--N 1.29 -2.008 1 CA-C-O 128.845 4.164 . . . . 74.769999999999996 108.35 -179.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . 0.537 7.1 m-80 -78.15 -38.94 42.5 Favored 'General case' 0 N--CA 1.416 -2.133 0 O-C-N 118.462 -2.649 . . . . 67.340000000000003 111.702 -172.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.2 mttm -56.25 -41.07 75.17 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 115.827 -2.349 . . . . 68.019999999999996 113.637 171.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 45.0 mt -63.87 -46.18 94.96 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.211 0 CA-C-O 125.789 2.709 . . . . 62.850000000000001 109.316 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -68.06 -42.01 81.13 Favored 'General case' 0 C--O 1.195 -1.786 0 CA-C-N 112.544 -2.116 . . . . 71.450000000000003 106.449 -164.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . 0.452 0.6 OUTLIER -58.71 -43.57 90.14 Favored 'General case' 0 C--N 1.257 -3.422 0 O-C-N 127.378 2.924 . . . . 69.890000000000001 109.86 178.437 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.36 -35.83 78.54 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 117.781 -1.104 . . . . 66.959999999999994 110.92 172.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.3 mt -97.05 -0.78 46.64 Favored 'General case' 0 C--N 1.273 -2.724 0 O-C-N 117.99 -2.944 . . . . 69.170000000000002 116.214 -170.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.83 115.36 2.54 Favored 'General case' 0 C--N 1.293 -1.855 0 C-N-CA 129.484 3.114 . . . . 74.090000000000003 109.532 -177.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.462 -3.23 1 CA-C-O 133.504 7.169 . . . . 78.180000000000007 114.231 -162.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 . . . . . 0 N--CA 1.498 1.974 0 CA-C-O 120.358 0.123 . . . . 84.319999999999993 111.307 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 67.22 -173.88 27.76 Favored Glycine 0 C--N 1.342 0.889 0 CA-C-O 121.505 0.503 . . . . 75.799999999999997 113.65 -171.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 96.6 mt -86.38 124.33 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-O 122.174 0.988 . . . . 68.900000000000006 110.883 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 tp -93.88 123.16 37.05 Favored 'General case' 0 N--CA 1.42 -1.958 0 CA-C-N 114.508 -1.223 . . . . 62.5 108.185 169.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 1.8 t -106.48 150.01 26.52 Favored 'General case' 0 C--N 1.288 -2.09 0 C-N-CA 117.563 -1.655 . . . . 56.859999999999999 113.218 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 tp -145.42 111.98 5.83 Favored 'General case' 0 N--CA 1.418 -2.072 0 C-N-CA 127.828 2.451 . . . . 51.630000000000003 114.154 169.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -114.11 123.34 49.39 Favored 'General case' 0 C--O 1.194 -1.862 0 O-C-N 120.452 -1.405 . . . . 52.189999999999998 109.45 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.4 mt -105.25 111.84 24.73 Favored 'General case' 0 C--N 1.289 -2.06 0 O-C-N 124.252 0.97 . . . . 55.020000000000003 109.423 -170.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 43.2 tttm -67.55 -35.21 78.62 Favored 'General case' 1 C--O 1.152 -4.044 1 CA-C-O 140.794 9.854 . . . . 68.370000000000005 117.666 -174.865 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 p30 -150.17 173.86 13.44 Favored 'General case' 0 C--N 1.292 -1.893 1 O-C-N 98.044 -15.41 . . . . 64.450000000000003 117.053 -177.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.605 ' HE2' ' O ' ' B' ' 103' ' ' LEU . 16.1 mttt -62.59 -29.02 70.29 Favored 'General case' 0 N--CA 1.415 -2.205 0 O-C-N 119.314 -2.116 . . . . 70.650000000000006 111.159 -173.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.569 ' HA ' ' HE1' ' A' ' 49' ' ' PHE . . . -61.46 -41.86 97.89 Favored 'General case' 0 C--N 1.257 -3.445 0 C-N-CA 118.112 -1.435 . . . . 57.43 109.099 -179.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ALA . . . . . 0.558 ' O ' ' O ' ' B' ' 403' ' ' HOH 0.57 . . -72.79 -36.68 67.66 Favored 'General case' 0 C--N 1.253 -3.591 0 CA-C-N 112.819 -1.991 . . . . 51.549999999999997 111.848 -171.763 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.54 HD21 HG23 ' B' ' 100' ' ' ILE 0.402 22.9 tp -52.14 -55.21 22.41 Favored 'General case' 0 N--CA 1.41 -2.457 0 O-C-N 125.531 1.769 . . . . 52.700000000000003 113.964 164.841 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -56.92 -41.72 78.68 Favored 'General case' 1 C--N 1.243 -4.039 0 C-N-CA 128.305 2.642 . . . . 55.600000000000001 109.003 -173.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . 0.579 1.0 OUTLIER -79.49 -37.27 37.15 Favored 'General case' 0 C--N 1.265 -3.075 0 O-C-N 126.907 2.629 . . . . 54.100000000000001 115.762 -175.674 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . 0.426 . . -69.65 -37.77 76.87 Favored 'General case' 0 C--O 1.19 -2.036 0 C-N-CA 128.433 2.693 . . . . 48.210000000000001 117.716 175.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . 0.45 14.7 t80 -60.03 129.82 43.67 Favored 'General case' 0 N--CA 1.41 -2.465 0 C-N-CA 130.4 3.48 . . . . 48.609999999999999 116.15 177.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' MSE . . . . . 1.223 ' HG2' ' O ' ' B' ' 350' ' ' HOH . 57.8 mtp -121.62 82.38 40.85 Favored Pre-proline 0 C--N 1.317 -0.822 1 O-C-N 114.663 -5.023 . . . . 56.759999999999998 106.468 -178.682 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -63.02 -19.14 68.36 Favored 'Trans proline' 0 N--CA 1.44 -1.642 1 C-N-CA 125.99 4.46 . . . . 46.969999999999999 116.327 -176.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . 0.271 13.3 p90 -73.17 -20.84 60.81 Favored 'General case' 1 C--N 1.232 -4.512 0 C-N-CA 129.99 3.316 . . . . 43.490000000000002 118.861 176.682 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . 0.285 57.0 t -75.82 133.81 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.393 0 C-N-CA 125.897 1.679 . . . . 47.490000000000002 112.152 176.333 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -54.21 126.7 23.96 Favored 'General case' 0 C--N 1.283 -2.309 0 C-N-CA 127.886 2.474 . . . . 65.829999999999998 108.173 173.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 44.7 m 69.13 16.76 8.55 Favored 'General case' 0 C--N 1.288 -2.092 0 C-N-CA 128.647 2.779 . . . . 55.079999999999998 111.199 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 80.57 157.1 14.76 Favored Glycine 1 C--O 1.167 -4.088 0 O-C-N 119.807 -1.808 . . . . 45.549999999999997 116.313 -172.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -158.69 176.77 35.53 Favored Glycine 0 N--CA 1.414 -2.802 0 CA-C-O 118.675 -1.069 . . . . 40.509999999999998 111.191 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 11.0 tt -164.24 144.93 2.28 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.084 0 C-N-CA 128.781 2.832 . . . . 40.829999999999998 111.993 -174.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -100.52 117.51 34.82 Favored 'General case' 0 C--N 1.279 -2.475 0 C-N-CA 131.542 3.937 . . . . 46.200000000000003 109.024 -173.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 65.5 t -116.05 113.74 41.58 Favored Pre-proline 0 C--N 1.278 -2.531 0 O-C-N 125.795 1.934 . . . . 47.5 108.474 -169.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -62.9 129.39 25.88 Favored 'Trans proline' 0 C--N 1.39 2.717 0 C-N-CA 124.158 3.239 . . . . 54.810000000000002 110.572 174.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . 0.267 13.1 t -167.91 142.76 3.02 Favored Pre-proline 0 C--O 1.17 -3.096 1 C-N-CA 133.701 4.8 . . . . 64.5 113.651 176.894 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -104.02 11.86 0.28 Allowed 'Trans proline' 0 C--N 1.39 2.738 3 CA-C-N 104.995 -4.323 . . . . 70.090000000000003 109.911 173.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -76.46 158.94 30.87 Favored 'General case' 0 C--N 1.249 -3.778 0 CA-C-N 120.69 1.586 . . . . 77.859999999999999 109.438 168.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . 0.284 5.8 mtm180 -107.25 141.43 38.58 Favored 'General case' 0 N--CA 1.428 -1.532 0 C-N-CA 118.647 -1.221 . . . . 88.040000000000006 109.024 -179.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' TYR . . . . . 1.002 ' OH ' ' O ' ' B' ' 638' ' ' HOH 0.278 88.2 m-85 -141.83 143.17 33.26 Favored 'General case' 0 C--O 1.19 -2.055 1 C-N-CA 134.971 5.308 . . . . 66.829999999999998 111.612 -165.87 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' MSE . . . . . . . . . . . . . 71.4 mtp -107.4 150.33 26.87 Favored 'General case' 0 C--N 1.252 -3.643 0 O-C-N 118.584 -2.573 . . . . 84.689999999999998 111.7 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.35 125.32 21.39 Favored 'General case' 0 C--O 1.198 -1.625 0 CA-C-O 116.478 -1.725 . . . . 55.100000000000001 108.383 175.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 103.43 -7.52 51.01 Favored Glycine 0 N--CA 1.408 -3.209 1 C-N-CA 131.556 4.408 . . . . 51.939999999999998 109.797 170.16 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . 0.252 71.5 m-20 -57.23 132.9 54.39 Favored 'General case' 0 C--N 1.268 -2.972 0 O-C-N 125.238 1.199 . . . . 55.0 111.244 171.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 66.9 mt-10 -52.36 122.2 8.32 Favored 'General case' 0 N--CA 1.405 -2.708 1 C-N-CA 137.883 6.473 . . . . 68.269999999999996 110.402 153.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.45 142.41 42.67 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.53 0 C-N-CA 113.139 -3.424 . . . . 54.090000000000003 107.485 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -99.04 120.29 39.22 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-O 123.884 1.802 . . . . 50.359999999999999 108.006 172.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 37.1 tp -112.58 135.82 52.85 Favored 'General case' 1 CA--C 1.344 -6.969 0 CA-C-N 113.252 -1.795 . . . . 49.600000000000001 110.991 177.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.63 115.99 27.35 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 128.023 3.327 . . . . 49.759999999999998 110.597 168.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 23.4 tp -120.05 123.85 44.44 Favored 'General case' 0 N--CA 1.421 -1.886 0 CA-C-N 114.759 -1.11 . . . . 46.619999999999997 113.206 -166.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . 0.29 0.3 OUTLIER -102.55 114.18 28.18 Favored 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 130.651 3.58 . . . . 51.469999999999999 118.137 167.852 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 58.5 mt -78.93 141.48 59.03 Favored Pre-proline 0 C--O 1.172 -3.003 1 C-N-CA 137.062 6.145 . . . . 57.560000000000002 110.823 177.912 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' PRO . . . . . 0.473 ' O ' ' C ' ' B' ' 56' ' ' ASP . 51.9 Cg_exo -51.34 137.81 47.0 Favored 'Trans proline' 1 C--N 1.43 4.82 3 C-N-CA 108.614 -7.124 . . . . 64.010000000000005 117.087 -176.739 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ASP . . . . . 0.473 ' C ' ' O ' ' B' ' 55' ' ' PRO 0.342 0.3 OUTLIER 45.82 34.46 1.88 Allowed 'General case' 0 N--CA 1.418 -2.036 2 O-C-N 108.081 -9.137 . . . . 74.689999999999998 117.192 -174.836 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -98.36 161.46 13.68 Favored 'General case' 0 C--O 1.19 -2.071 1 O-C-N 115.514 -4.491 . . . . 69.930000000000007 108.917 168.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' SER . . . . . 0.754 ' O ' ' HG2' ' C' ' 43' ' ' MSE . 47.5 p -107.04 -13.97 15.05 Favored 'General case' 0 C--N 1.287 -2.124 0 C-N-CA 115.733 -2.387 . . . . 67.609999999999999 111.969 173.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -105.01 144.03 32.38 Favored 'General case' 0 C--N 1.295 -1.795 0 C-N-CA 131.436 3.894 . . . . 70.390000000000001 113.284 -174.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 -95.52 127.23 41.39 Favored 'General case' 0 C--N 1.277 -2.571 1 C-N-CA 135.29 5.436 . . . . 68.909999999999997 110.425 172.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.11 109.48 60.74 Favored Pre-proline 0 C--N 1.256 -3.495 1 C-N-CA 132.109 4.164 . . . . 51.729999999999997 108.855 -173.136 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' PRO . . . . . 0.454 ' HD2' ' O ' ' B' ' 420' ' ' HOH . 6.8 Cg_exo -77.96 136.41 14.81 Favored 'Trans proline' 1 C--N 1.432 4.927 3 CA-C-N 102.034 -5.381 . . . . 47.539999999999999 107.856 175.873 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 93.6 t -132.39 127.79 57.43 Favored 'Isoleucine or valine' 0 C--N 1.245 -3.948 0 O-C-N 126.494 2.371 . . . . 45.619999999999997 106.665 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.5 ' O ' ' HD3' ' B' ' 88' ' ' PRO . . . -101.18 94.45 5.97 Favored 'General case' 0 C--N 1.281 -2.394 0 N-CA-C 105.731 -1.952 . . . . 46.600000000000001 105.731 176.407 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLY . . . . . . . . . . . . . . . -110.12 176.52 19.18 Favored Glycine 0 N--CA 1.41 -3.037 0 CA-C-N 114.245 -1.343 . . . . 46.780000000000001 113.2 -165.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 49.7 tttt -133.97 136.9 44.47 Favored 'General case' 0 C--O 1.176 -2.806 0 O-C-N 127.409 2.476 . . . . 59.780000000000001 107.577 -174.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . 0.313 94.9 t -71.15 106.79 2.03 Favored 'Isoleucine or valine' 0 C--N 1.249 -3.779 1 C-N-CA 133.463 4.705 . . . . 46.789999999999999 112.475 176.877 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -115.58 -7.02 12.08 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.081 0 O-C-N 120.999 -1.063 . . . . 48.869999999999997 111.556 -170.325 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' TRP . . . . . . . . . . . . . 12.6 t-105 -167.86 135.8 2.34 Favored 'General case' 0 C--N 1.271 -2.843 0 C-N-CA 124.862 1.265 . . . . 64.040000000000006 109.007 -167.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' THR . . . . . . . . . . . . . 23.3 p -117.75 161.45 19.69 Favored 'General case' 0 C--N 1.307 -1.265 0 C-N-CA 130.273 3.429 . . . . 62.060000000000002 108.835 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 19.9 m -151.71 130.79 6.52 Favored Pre-proline 0 C--O 1.154 -3.956 1 C-N-CA 133.429 4.691 . . . . 72.599999999999994 114.043 172.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.45 ' O ' ' HB3' ' B' ' 73' ' ' ALA . 72.9 Cg_endo -88.82 19.17 1.35 Allowed 'Trans proline' 0 CA--C 1.589 3.272 2 C-N-CA 125.835 4.356 . . . . 79.760000000000005 122.593 177.562 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' B' ' 72' ' ' PRO . . . 83.24 115.6 0.05 Allowed 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 116.552 2.056 . . . . 83.159999999999997 116.552 -175.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -80.3 -76.97 0.98 Allowed Glycine 0 N--CA 1.478 1.445 0 CA-C-N 116.515 -0.311 . . . . 85.870000000000005 113.609 -178.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . 0.431 . . . . . . . 0 CA--C 1.489 -1.369 0 CA-C-O 127.214 3.388 . . . . 86.700000000000003 114.083 173.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 6.3 t30 . . . . . 0 C--O 1.254 1.304 0 CA-C-O 123.932 1.825 . . . . 87.489999999999995 112.006 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . 0.25 0.7 OUTLIER -62.48 142.46 57.9 Favored 'General case' 0 N--CA 1.415 -2.193 0 O-C-N 117.094 -3.504 . . . . 85.099999999999994 111.201 -167.1 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.92 153.84 42.33 Favored 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 130.508 3.523 . . . . 73.340000000000003 109.833 173.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.28 138.4 26.56 Favored 'General case' 0 C--N 1.269 -2.903 0 CA-C-N 109.676 -3.42 . . . . 63.740000000000002 109.378 168.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . 164.79 -170.38 39.85 Favored Glycine 0 N--CA 1.408 -3.183 0 N-CA-C 121.565 3.386 . . . . 55.719999999999999 121.565 -177.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.6 pt -131.98 146.46 33.24 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.73 0 C-N-CA 125.709 1.604 . . . . 47.560000000000002 111.081 -171.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.0 111.09 3.29 Favored Glycine 0 N--CA 1.409 -3.141 1 C-N-CA 138.846 7.879 . . . . 41.270000000000003 111.614 164.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . 0.263 86.0 t -112.29 117.89 56.37 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.082 0 O-C-N 116.972 -3.663 . . . . 40.960000000000001 109.444 -173.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -92.0 126.0 36.91 Favored 'General case' 0 N--CA 1.415 -2.211 0 C-N-CA 124.548 1.139 . . . . 46.25 111.822 175.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . 0.412 2.4 m-30 -54.01 136.69 57.15 Favored Pre-proline 0 C--O 1.173 -2.971 2 CA-C-O 136.328 7.728 . . . . 45.590000000000003 113.114 172.656 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' B' ' 64' ' ' ALA . 73.1 Cg_endo -71.0 164.79 34.55 Favored 'Trans proline' 0 C--N 1.395 3.026 2 C-N-CA 104.891 -9.606 . . . . 51.340000000000003 109.243 -179.378 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.54 138.42 58.5 Favored 'General case' 0 C--N 1.271 -2.81 1 C-N-CA 135.793 5.637 . . . . 67.659999999999997 115.024 162.684 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 90.74 -175.15 40.11 Favored Glycine 0 N--CA 1.41 -3.06 0 CA-C-O 116.117 -2.491 . . . . 65.620000000000005 116.088 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -43.02 -46.34 8.94 Favored 'Trans proline' 0 C--O 1.276 2.413 1 C-N-CA 129.049 6.499 . . . . 69.329999999999998 118.766 -169.676 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . 0.491 21.5 mt-10 -75.02 -26.73 59.71 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 116.593 2.072 . . . . 82.290000000000006 116.593 -175.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' GLY . . . . . 0.472 ' O ' ' C ' ' B' ' 94' ' ' GLU . . . -79.8 -41.15 13.11 Favored Glycine 0 CA--C 1.473 -2.581 1 CA-C-O 132.646 6.692 . . . . 71.0 109.04 179.089 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . 0.509 ' HG3' HH11 ' B' ' 97' ' ' ARG . 7.6 tt0 -60.82 -44.41 96.94 Favored 'General case' 0 C--N 1.306 -1.3 1 O-C-N 104.109 -11.23 . . . . 77.230000000000004 112.204 172.96 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.3 -43.31 74.7 Favored 'General case' 0 N--CA 1.422 -1.863 0 N-CA-C 116.505 2.039 . . . . 64.819999999999993 116.505 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 59.0 t -64.61 -43.11 96.71 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.983 0 C-N-CA 125.725 1.61 . . . . 62.880000000000003 106.758 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ARG . . . . . 0.669 ' NH2' ' O ' ' B' ' 446' ' ' HOH . 24.6 ttp85 -66.78 -45.02 79.76 Favored 'General case' 0 C--N 1.255 -3.503 0 CA-C-O 127.624 3.583 . . . . 71.459999999999994 107.199 -171.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . 0.805 ' O ' HG23 ' B' ' 102' ' ' THR . 1.0 OUTLIER -62.97 -42.44 99.83 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 109.53 -3.486 . . . . 67.480000000000004 108.756 -179.722 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.268 45.8 mttp -61.23 -40.84 95.52 Favored 'General case' 0 C--O 1.185 -2.295 0 CA-C-N 121.222 1.828 . . . . 67.5 114.075 176.34 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.54 HG23 HD21 ' B' ' 21' ' ' LEU . 41.5 mt -63.76 -58.2 8.41 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.891 0 CA-C-N 114.568 -1.196 . . . . 61.340000000000003 108.008 -179.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -57.02 -41.5 78.67 Favored 'General case' 0 N--CA 1.399 -3.0 0 CA-C-O 124.203 1.954 . . . . 73.129999999999995 113.41 -172.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' THR . . . . . 0.805 HG23 ' O ' ' B' ' 98' ' ' ASN 0.378 0.1 OUTLIER -60.78 -38.26 84.72 Favored 'General case' 0 N--CA 1.424 -1.767 0 O-C-N 118.329 -2.732 . . . . 67.519999999999996 109.377 174.131 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.605 ' O ' ' HE2' ' B' ' 18' ' ' LYS . 32.1 mt -66.99 -29.23 69.01 Favored 'General case' 0 N--CA 1.426 -1.638 0 O-C-N 118.797 -2.439 . . . . 66.510000000000005 116.996 176.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 81.9 mt -98.92 -5.82 30.01 Favored 'General case' 1 C--N 1.244 -4.006 0 CA-C-N 114.645 -1.161 . . . . 70.629999999999995 111.051 -172.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.56 -43.93 83.72 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-O 115.969 -1.967 . . . . 79.0 106.889 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.744 1 C-N-CA 134.29 5.709 . . . . 84.730000000000004 118.56 177.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . 0.391 14.0 mm-40 . . . . . 0 C--O 1.247 0.955 0 N-CA-C 117.296 2.332 . . . . 88.920000000000002 117.296 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' GLY . . . . . . . . . . . . . . . 73.83 -165.5 54.78 Favored Glycine 0 C--N 1.297 -1.609 1 C-N-CA 132.789 4.995 . . . . 82.920000000000002 116.461 -177.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ILE . . . . . 0.428 HG12 ' CD2' ' C' ' 49' ' ' PHE . 12.4 mt -90.52 129.56 41.16 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.611 1 CA-C-N 124.239 4.019 . . . . 76.530000000000001 113.198 -177.543 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' LEU . . . . . . . . . . . . . 19.3 tp -99.25 115.92 30.24 Favored 'General case' 0 C--O 1.199 -1.575 0 CA-C-N 111.246 -2.706 . . . . 67.189999999999998 107.609 170.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 4.0 p -112.23 156.86 21.66 Favored 'General case' 0 C--N 1.261 -3.268 0 N-CA-C 119.146 3.017 . . . . 58.030000000000001 119.146 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 66.5 tp -150.03 113.27 4.9 Favored 'General case' 0 C--O 1.187 -2.194 0 N-CA-C 105.615 -1.994 . . . . 50.789999999999999 105.615 -174.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' ALA . . . . . . . . . . . . . . . -107.12 119.24 38.86 Favored 'General case' 2 CA--C 1.408 -4.489 0 CA-C-O 128.009 3.766 . . . . 49.420000000000002 108.933 171.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' C' ' 21' ' ' LEU . 11.1 mt -103.99 108.77 20.26 Favored 'General case' 0 N--CA 1.415 -2.222 1 O-C-N 116.13 -4.106 . . . . 53.979999999999997 115.399 177.7 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LYS . . . . . 0.665 ' HE2' ' O ' ' C' ' 500' ' ' HOH . 17.9 tttt -54.72 -41.97 70.98 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 117.614 2.45 . . . . 68.219999999999999 117.614 -175.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -147.88 172.76 13.65 Favored 'General case' 1 C--O 1.117 -5.891 0 CA-C-N 122.595 2.452 . . . . 61.149999999999999 115.541 -175.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -62.89 -28.05 69.78 Favored 'General case' 0 N--CA 1.467 0.414 1 O-C-N 114.975 -4.828 . . . . 65.010000000000005 112.195 -177.626 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.52 77.99 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 117.247 -1.358 . . . . 54.93 107.729 172.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' ALA . . . . . . . . . . . . 0.25 . . -73.5 -38.89 65.2 Favored 'General case' 0 C--O 1.185 -2.296 0 O-C-N 125.36 1.663 . . . . 50.630000000000003 107.559 -163.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LEU . . . . . 0.665 HD21 HG23 ' C' ' 100' ' ' ILE . 40.2 tp -57.64 -54.34 47.97 Favored 'General case' 0 N--CA 1.418 -2.064 0 O-C-N 126.245 2.216 . . . . 51.670000000000002 107.803 171.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -56.0 -43.41 77.66 Favored 'General case' 0 C--O 1.197 -1.674 0 CA-C-N 119.966 1.257 . . . . 49.299999999999997 111.937 -175.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' SER . . . . . . . . . . . . . 7.8 t -62.6 -42.67 99.71 Favored 'General case' 1 N--CA 1.377 -4.122 0 O-C-N 126.428 2.33 . . . . 53.369999999999997 115.026 179.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . 0.35 . . -81.06 -32.74 33.9 Favored 'General case' 0 C--O 1.201 -1.492 0 C-N-CA 127.724 2.409 . . . . 45.07 113.465 -173.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' TYR . . . . . 0.607 ' O ' ' HD3' ' C' ' 27' ' ' PRO . 43.6 t80 -68.94 139.44 55.07 Favored 'General case' 1 C--O 1.127 -5.378 1 CA-C-O 133.117 6.199 . . . . 45.509999999999998 114.088 -177.34 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' MSE . . . . . 1.156 ' HG2' ' O ' ' C' ' 425' ' ' HOH . 60.5 mtp -120.42 87.8 41.38 Favored Pre-proline 0 C--N 1.312 -1.062 1 O-C-N 107.544 -9.472 . . . . 59.100000000000001 106.186 -178.718 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' PRO . . . . . 0.607 ' HD3' ' O ' ' C' ' 25' ' ' TYR . 13.2 Cg_endo -60.73 -29.0 87.44 Favored 'Trans proline' 0 N--CA 1.432 -2.146 0 N-CA-C 118.995 2.652 . . . . 46.700000000000003 118.995 -176.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -73.99 -12.44 60.64 Favored 'General case' 0 C--N 1.275 -2.637 1 C-N-CA 136.383 5.873 . . . . 42.840000000000003 116.29 179.571 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' VAL . . . . . . . . . . . . . 70.1 t -75.55 137.38 22.97 Favored 'Isoleucine or valine' 0 C--N 1.258 -3.394 0 C-N-CA 125.831 1.652 . . . . 44.07 111.651 169.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -60.34 143.3 53.3 Favored 'General case' 0 N--CA 1.417 -2.089 0 O-C-N 118.742 -2.474 . . . . 63.340000000000003 112.509 170.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' SER . . . . . . . . . . . . 0.34 1.7 m 61.43 6.81 1.54 Allowed 'General case' 0 N--CA 1.411 -2.398 0 N-CA-C 115.689 1.736 . . . . 54.920000000000002 115.689 -176.088 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 70.46 138.14 0.14 Allowed Glycine 0 C--O 1.213 -1.187 0 C-N-CA 126.998 2.237 . . . . 48.979999999999997 112.804 -177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -127.53 -160.94 10.64 Favored Glycine 0 N--CA 1.473 1.11 0 CA-C-N 112.115 -2.043 . . . . 47.5 109.988 -173.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' ILE . . . . . 0.443 HG22 ' HE1' ' C' ' 87' ' ' PHE . 16.2 tt 179.01 137.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 122.426 1.108 . . . . 47.609999999999999 109.062 176.651 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -86.97 127.4 35.08 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 109.081 -0.711 . . . . 50.380000000000003 109.081 175.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 91.1 t -120.49 113.78 33.39 Favored Pre-proline 0 C--O 1.168 -3.236 0 N-CA-C 107.845 -1.169 . . . . 49.640000000000001 107.845 -176.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -67.04 137.43 44.38 Favored 'Trans proline' 1 C--N 1.418 4.225 1 C-N-CA 111.572 -5.152 . . . . 58.539999999999999 117.844 170.981 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' THR . . . . . . . . . . . . . 12.6 t -174.08 133.39 0.56 Allowed Pre-proline 0 C--O 1.172 -3.025 1 C-N-CA 137.454 6.302 . . . . 64.390000000000001 111.795 -172.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -93.2 9.03 2.46 Favored 'Trans proline' 0 N--CA 1.419 -2.901 2 C-N-CA 108.619 -7.121 . . . . 66.799999999999997 111.722 169.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 35.7 mttp -69.43 171.43 8.73 Favored 'General case' 0 C--N 1.263 -3.192 0 CA-C-N 121.874 2.124 . . . . 73.519999999999996 107.891 172.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' ARG . . . . . . . . . . . . . 13.2 mtm105 -118.49 122.01 41.66 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 105.716 -1.957 . . . . 79.560000000000002 105.716 -177.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' TYR . . . . . 0.458 ' CE2' HG22 ' C' ' 48' ' ' VAL . 78.4 m-85 -125.23 155.92 39.32 Favored 'General case' 1 C--O 1.13 -5.222 0 O-C-N 127.471 2.982 . . . . 64.879999999999995 111.419 -174.724 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' MSE . . . . . 0.754 ' HG2' ' O ' ' B' ' 58' ' ' SER . 80.6 mtp -113.45 150.43 32.8 Favored 'General case' 0 C--N 1.311 -1.096 0 O-C-N 117.117 -3.489 . . . . 85.340000000000003 112.758 174.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.26 132.49 53.18 Favored 'General case' 0 C--O 1.191 -1.98 0 N-CA-C 106.517 -1.66 . . . . 55.380000000000003 106.517 179.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' GLY . . . . . . . . . . . . . . . 88.52 -13.76 61.44 Favored Glycine 0 N--CA 1.403 -3.535 0 C-N-CA 128.842 3.115 . . . . 53.380000000000003 114.153 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -52.09 152.19 3.34 Favored 'General case' 0 N--CA 1.412 -2.334 0 C-N-CA 116.311 -2.155 . . . . 54.979999999999997 112.7 170.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' GLU . . . . . 0.813 ' HG3' ' O ' ' C' ' 646' ' ' HOH . 0.0 OUTLIER -83.89 129.43 34.93 Favored 'General case' 0 N--CA 1.416 -2.138 1 C-N-CA 132.009 4.124 . . . . 67.200000000000003 109.458 167.855 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' VAL . . . . . 0.458 HG22 ' CE2' ' C' ' 42' ' ' TYR . 34.9 t -124.48 131.72 72.36 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.927 0 CA-C-O 116.488 -1.72 . . . . 56.560000000000002 109.39 -179.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' PHE . . . . . 0.428 ' CD2' HG12 ' C' ' 10' ' ' ILE 0.371 9.4 t80 -92.15 117.24 29.66 Favored 'General case' 0 C--N 1.26 -3.324 0 C-N-CA 126.818 2.047 . . . . 51.469999999999999 111.367 167.199 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' LEU . . . . . . . . . . . . . 36.7 tp -122.61 128.42 50.65 Favored 'General case' 0 C--O 1.196 -1.74 0 CA-C-N 113.15 -1.841 . . . . 49.439999999999998 109.898 -174.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' C' ' 51' ' ' LEU . 2.3 tp -95.97 115.43 27.42 Favored 'General case' 0 CA--C 1.454 -2.733 0 C-N-CA 126.33 1.852 . . . . 50.009999999999998 111.223 166.04 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 44.5 tp -116.24 120.77 40.02 Favored 'General case' 0 C--N 1.292 -1.915 0 O-C-N 118.613 -2.555 . . . . 48.479999999999997 110.233 -173.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -100.61 113.41 26.23 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 115.56 1.689 . . . . 50.700000000000003 115.56 165.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' LEU . . . . . . . . . . . . 0.476 30.6 mt -71.48 143.11 87.28 Favored Pre-proline 0 C--N 1.255 -3.531 1 C-N-CA 132.014 4.126 . . . . 55.729999999999997 116.788 173.36 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.09 139.69 71.14 Favored 'Trans proline' 1 C--N 1.434 5.078 1 C-N-CA 108.157 -7.428 . . . . 62.649999999999999 114.595 -174.558 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' ASP . . . . . . . . . . . . 0.499 0.1 OUTLIER 35.03 44.06 0.12 Allowed 'General case' 0 N--CA 1.416 -2.137 1 CA-C-O 129.1 4.286 . . . . 71.260000000000005 118.739 -174.764 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' SER . . . . . . . . . . . . . 3.6 t -97.09 152.68 18.54 Favored 'General case' 0 C--O 1.187 -2.193 0 O-C-N 118.16 -2.837 . . . . 67.569999999999993 105.446 169.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' SER . . . . . . . . . . . . . 45.3 p -104.55 11.78 33.89 Favored 'General case' 1 C--O 1.131 -5.162 2 CA-C-O 136.574 7.845 . . . . 66.109999999999999 109.011 175.369 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . 0.3 4.9 pt-20 -129.84 152.6 49.14 Favored 'General case' 0 C--N 1.302 -1.46 1 O-C-N 100.579 -13.826 . . . . 74.170000000000002 113.01 -173.862 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' ARG . . . . . . . . . . . . . 76.9 mtt85 -112.34 116.82 30.98 Favored 'General case' 0 C--N 1.271 -2.837 1 C-N-CA 133.456 4.702 . . . . 62.960000000000001 108.133 177.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 18.2 mt -96.62 106.2 28.26 Favored Pre-proline 0 C--O 1.17 -3.113 0 C-N-CA 129.442 3.097 . . . . 51.060000000000002 114.477 -176.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' PRO . . . . . 0.471 ' HD2' ' O ' ' C' ' 631' ' ' HOH . 39.6 Cg_endo -80.72 138.05 11.66 Favored 'Trans proline' 1 C--N 1.432 4.972 1 C-N-CA 109.439 -6.574 . . . . 47.68 110.791 -179.235 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . 0.435 1.5 m -130.27 116.34 35.93 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.287 0 C-N-CA 130.464 3.506 . . . . 45.280000000000001 109.505 -175.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.14 83.53 6.0 Favored 'General case' 0 C--N 1.279 -2.477 1 CA-C-O 132.139 5.733 . . . . 45.869999999999997 108.985 170.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' GLY . . . . . . . . . . . . . . . -100.66 179.42 29.11 Favored Glycine 0 C--N 1.291 -1.937 1 O-C-N 102.832 -12.417 . . . . 44.969999999999999 111.484 -167.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' LYS . . . . . . . . . . . . . 51.4 tttt -125.02 137.05 54.24 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 126.916 2.186 . . . . 54.640000000000001 114.755 172.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' VAL . . . . . 0.456 HG23 HG23 ' C' ' 48' ' ' VAL . 72.3 t -75.6 115.83 17.61 Favored 'Isoleucine or valine' 0 C--N 1.253 -3.591 0 CA-C-O 116.493 -1.717 . . . . 43.700000000000003 109.302 -178.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' VAL . . . . . . . . . . . . 0.286 4.3 m -114.91 -3.33 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.961 0 N-CA-C 117.32 2.341 . . . . 48.530000000000001 117.32 -175.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' TRP . . . . . . . . . . . . . 73.5 t-105 -172.39 133.76 0.66 Allowed 'General case' 0 C--O 1.191 -2.02 0 C-N-CA 130.466 3.506 . . . . 62.700000000000003 111.644 -169.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' THR . . . . . . . . . . . . . 68.1 p -117.96 150.75 38.73 Favored 'General case' 0 C--N 1.284 -2.279 1 O-C-N 112.139 -6.601 . . . . 65.060000000000002 115.001 171.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.3 m -143.62 101.49 5.06 Favored Pre-proline 0 C--O 1.164 -3.416 0 C-N-CA 128.381 2.672 . . . . 76.150000000000006 115.871 170.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' PRO . . . . . 0.482 ' O ' ' CB ' ' C' ' 73' ' ' ALA . 10.8 Cg_endo -56.46 4.33 0.07 OUTLIER 'Trans proline' 1 C--N 1.437 5.21 1 CA-C-N 105.635 -4.095 . . . . 84.609999999999999 118.115 -179.4 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' ALA . . . . . 0.482 ' CB ' ' O ' ' C' ' 72' ' ' PRO . . . . . . . . 0 C--O 1.291 3.285 0 CA-C-N 120.464 1.484 . . . . 85.370000000000005 112.377 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' ARG . . . . . 0.955 ' NH2' ' O ' ' C' ' 628' ' ' HOH . 60.9 ttt180 . . . . . 0 N--CA 1.497 1.884 0 CA-C-O 120.339 0.114 . . . . 78.510000000000005 111.175 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' ALA . . . . . 0.708 ' H ' ' HG2' ' C' ' 79' ' ' ARG . . . -83.38 161.81 21.24 Favored 'General case' 0 C--O 1.204 -1.308 0 N-CA-C 114.053 1.131 . . . . 68.310000000000002 114.053 173.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.96 153.67 32.9 Favored 'General case' 0 C--N 1.286 -2.174 0 C-N-CA 127.152 2.181 . . . . 62.509999999999998 106.363 174.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' GLY . . . . . . . . . . . . . . . 141.37 -164.57 26.57 Favored Glycine 1 C--O 1.092 -8.773 0 C-N-CA 126.463 1.982 . . . . 57.009999999999998 117.185 -176.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' ILE . . . . . . . . . . . . . 41.8 pt -137.35 148.12 26.24 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.816 0 C-N-CA 128.175 2.59 . . . . 48.609999999999999 113.39 -162.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . -89.37 116.64 4.75 Favored Glycine 0 C--N 1.276 -2.802 0 C-N-CA 129.173 3.273 . . . . 41.060000000000002 108.874 170.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 40.6 t -110.93 114.22 46.48 Favored 'Isoleucine or valine' 0 C--N 1.254 -3.574 0 C-N-CA 128.231 2.612 . . . . 40.82 111.564 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -81.55 136.87 35.59 Favored 'General case' 0 N--CA 1.416 -2.163 0 C-N-CA 125.321 1.449 . . . . 43.420000000000002 108.967 175.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' PHE . . . . . 0.443 ' HE1' HG22 ' C' ' 34' ' ' ILE 0.288 2.7 m-30 -70.29 146.6 94.63 Favored Pre-proline 0 C--N 1.25 -3.748 1 CA-C-O 129.847 4.641 . . . . 44.789999999999999 112.123 170.872 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -72.85 161.25 44.21 Favored 'Trans proline' 0 C--N 1.397 3.082 1 C-N-CA 107.5 -7.867 . . . . 51.060000000000002 110.366 -178.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' ASP . . . . . . . . . . . . 0.273 16.8 m-20 -57.32 129.06 40.12 Favored 'General case' 0 C--N 1.281 -2.398 1 C-N-CA 134.869 5.267 . . . . 69.469999999999999 112.839 156.616 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 114.99 -169.7 12.96 Favored Glycine 1 C--N 1.247 -4.377 0 CA-C-O 125.446 2.692 . . . . 64.620000000000005 107.941 168.828 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -54.2 -45.96 37.12 Favored 'Trans proline' 1 C--N 1.422 4.446 1 CA-C-N 103.14 -6.53 . . . . 65.140000000000001 120.89 -174.497 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' GLU . . . . . . . . . . . . . . . -62.56 -38.21 89.17 Favored 'General case' 0 C--N 1.271 -2.816 0 O-C-N 118.395 -2.691 . . . . 64.519999999999996 116.775 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' C' ' 94' ' ' GLU . . . -69.13 -47.83 50.82 Favored Glycine 1 C--O 1.137 -5.956 2 C-N-CA 133.088 5.137 . . . . 64.950000000000003 111.858 176.241 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' GLU . . . . . 0.732 ' CD ' HH11 ' C' ' 97' ' ' ARG . 5.6 tp10 -64.19 -30.41 71.47 Favored 'General case' 0 C--N 1.28 -2.432 1 O-C-N 109.391 -8.123 . . . . 74.879999999999995 111.039 176.538 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.82 -43.54 92.78 Favored 'General case' 0 C--O 1.2 -1.527 0 C-N-CA 117.617 -1.633 . . . . 66.310000000000002 109.45 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.76 -41.36 79.88 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.904 0 CA-C-O 124.538 2.113 . . . . 64.739999999999995 105.898 -169.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' ARG . . . . . 0.732 HH11 ' CD ' ' C' ' 94' ' ' GLU . 27.7 ttp180 -65.52 -39.97 92.42 Favored 'General case' 0 C--O 1.161 -3.576 0 CA-C-N 109.694 -3.412 . . . . 73.680000000000007 107.418 -175.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' ASN . . . . . 0.651 ' O ' HG23 ' C' ' 102' ' ' THR 0.272 86.6 m-20 -62.89 -55.05 29.57 Favored 'General case' 0 C--N 1.267 -3.014 0 C-N-CA 125.242 1.417 . . . . 70.700000000000003 113.86 178.489 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' LYS . . . . . . . . . . . . 0.291 13.0 mttm -45.15 -54.21 7.13 Favored 'General case' 0 C--O 1.196 -1.716 0 O-C-N 117.978 -2.951 . . . . 66.439999999999998 115.316 165.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' ILE . . . . . 0.665 HG23 HD21 ' C' ' 21' ' ' LEU 0.251 65.9 mt -58.14 -50.88 76.74 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.935 0 O-C-N 120.024 -1.672 . . . . 63.079999999999998 109.962 -175.995 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -61.59 -33.13 73.35 Favored 'General case' 0 C--N 1.271 -2.812 0 CA-C-N 115.312 -0.858 . . . . 74.909999999999997 110.477 -172.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' THR . . . . . 0.651 HG23 ' O ' ' C' ' 98' ' ' ASN 0.509 0.5 OUTLIER -66.85 -44.73 80.25 Favored 'General case' 0 CA--C 1.477 -1.861 0 CA-C-O 125.424 2.535 . . . . 67.930000000000007 110.357 171.659 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.63 -15.75 61.68 Favored 'General case' 0 N--CA 1.422 -1.861 1 O-C-N 112.764 -6.21 . . . . 66.390000000000001 116.971 176.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -107.66 -4.73 17.95 Favored 'General case' 0 C--N 1.265 -3.091 0 C-N-CA 117.632 -1.627 . . . . 68.099999999999994 114.25 -168.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -31.91 102.27 0.02 OUTLIER 'General case' 0 C--N 1.281 -2.372 1 C-N-CA 132.261 4.224 . . . . 73.739999999999995 114.089 160.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' GLY . . . . . 1.285 ' C ' ' OXT' ' C' ' 106' ' ' GLY . . . . . . . . 0 CA--C 1.482 -2.006 1 CA-C-O 130.51 5.505 . . . . 76.0 118.413 178.611 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 1.178 ' O ' ' HG2' ' A' ' 26' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . 0.536 ' O ' ' OG1' ' A' ' 53' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 298' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' HOH . . . . . 0.469 ' O ' ' NH2' ' A' ' 79' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 492' ' ' HOH . . . . . 0.861 ' O ' ' HB3' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 618' ' ' HOH . . . . . 0.443 ' O ' ' HD2' ' A' ' 62' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 635' ' ' HOH . . . . . 0.593 ' O ' ' HB3' ' A' ' 57' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 636' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 651' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 653' ' ' HOH . . . . . 0.593 ' O ' ' HG2' ' A' ' 47' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 654' ' ' HOH . . . . . 1.137 ' O ' ' HD3' ' A' ' 40' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 350' ' ' HOH . . . . . 1.223 ' O ' ' HG2' ' B' ' 26' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 399' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 403' ' ' HOH . . . . . 0.558 ' O ' ' O ' ' B' ' 20' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 420' ' ' HOH . . . . . 0.454 ' O ' ' HD2' ' B' ' 62' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 446' ' ' HOH . . . . . 0.669 ' O ' ' NH2' ' B' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 634' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 638' ' ' HOH . . . . . 1.002 ' O ' ' OH ' ' B' ' 42' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 639' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 642' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 643' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 649' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 425' ' ' HOH . . . . . 1.156 ' O ' ' HG2' ' C' ' 26' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 500' ' ' HOH . . . . . 0.665 ' O ' ' HE2' ' C' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 628' ' ' HOH . . . . . 0.955 ' O ' ' NH2' ' C' ' 79' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 631' ' ' HOH . . . . . 0.471 ' O ' ' HD2' ' C' ' 62' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 632' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 633' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 640' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 645' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 646' ' ' HOH . . . . . 0.813 ' O ' ' HG3' ' C' ' 47' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_