data_6mqu_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6mqu _Structure_validation_residue.Date_analyzed 2019-03-29 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 C--O 1.235 0.341 0 N-CA-C 110.379 -0.23 . . . . 83.86 110.379 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -61.05 -26.64 67.77 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.428 -0.509 . . . . 74.3 111.539 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.6 mt -58.95 -42.51 90.04 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 119.826 -0.75 . . . . 58.18 111.902 177.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.5 mttt -72.25 -38.16 68.95 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.247 -0.581 . . . . 68.93 111.143 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 37.9 t-105 -52.65 -55.51 22.02 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 119.832 -0.747 . . . . 54.88 110.614 172.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 80.1 mt -49.08 -49.06 16.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 121.198 0.523 . . . . 50.17 110.724 177.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.8 m -62.23 -34.42 76.47 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 120.437 -0.505 . . . . 50.37 111.509 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -61.2 -68.18 0.34 Allowed 'General case' 0 C--O 1.238 0.449 0 C-N-CA 118.592 -1.243 . . . . 42.79 110.926 174.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.1 m -33.59 -43.23 0.12 Allowed 'General case' 0 C--O 1.238 0.47 0 N-CA-C 114.661 1.356 . . . . 46.13 114.661 173.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 45.6 mt -69.68 -53.8 16.89 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 120.482 -0.487 . . . . 36.91 111.554 -175.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -45.7 -41.55 10.65 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 120.927 0.394 . . . . 44.9 111.796 168.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 tp -64.94 -49.78 69.01 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 122.0 -0.438 . . . . 40.47 111.485 178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.5 mt -57.76 -34.27 47.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 O-C-N 122.319 -0.238 . . . . 36.7 110.512 178.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.1 m -59.71 -54.69 43.46 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.878 0.37 . . . . 49.03 111.35 172.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.9 tp -61.36 -37.88 84.96 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.35 -0.54 . . . . 50.23 111.131 -178.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.6 mt -66.95 -54.9 17.42 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.289 -0.565 . . . . 39.66 111.158 179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.9 mt -48.52 -48.11 38.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.458 -0.497 . . . . 38.42 111.179 170.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.0 tp -57.33 -38.94 74.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 42.25 109.869 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' CYS . . . . . 0.491 ' SG ' ' CE1' ' F' ' 10' ' ' PHE . 53.5 t -68.21 -36.73 79.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.97 -0.559 . . . . 75.86 109.887 179.458 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.2 mt -62.43 -39.85 85.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.992 -0.549 . . . . 47.68 109.985 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.7 mt -62.33 -29.44 46.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.099 -0.501 . . . . 55.29 110.305 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -75.47 -40.67 57.11 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 111.966 0.358 . . . . 58.62 111.966 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.4 mtp -60.59 -40.08 90.46 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 111.883 0.327 . . . . 61.47 111.883 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.0 mt -68.15 -43.26 78.68 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 118.682 -1.207 . . . . 62.73 111.159 -175.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -68.69 -15.47 63.53 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 123.295 0.372 . . . . 97.53 111.235 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.4 ttp85 -72.41 -37.62 68.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 85.33 111.226 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 CA-C-N 116.197 -0.456 . . . . 72.2 112.536 179.998 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.464 0.254 0 CA-C-O 121.284 0.564 . . . . 73.32 109.641 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -62.42 -34.72 77.32 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.374 -0.931 . . . . 55.45 110.954 162.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.72 -35.84 81.91 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.984 -0.286 . . . . 51.88 111.602 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mttt -53.58 -43.19 68.34 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.037 -0.665 . . . . 61.6 111.187 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -71.04 -42.88 68.9 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 120.633 -0.427 . . . . 77.78 111.075 -175.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 49.4 mt -51.84 -41.34 29.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 120.583 -0.447 . . . . 47.36 110.303 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 67.6 m -70.35 -40.82 73.86 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.706 0.288 . . . . 43.99 111.547 -178.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -65.45 -31.08 71.97 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 118.297 -1.361 . . . . 49.58 112.275 172.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -72.09 -44.47 63.2 Favored 'General case' 0 C--O 1.238 0.461 0 O-C-N 121.916 -0.49 . . . . 45.4 111.802 -178.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 68.7 mt -59.59 -39.19 83.37 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 119.98 -0.688 . . . . 37.73 111.352 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -58.99 -45.78 89.78 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 120.232 -0.587 . . . . 41.97 111.683 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.74 -45.2 95.18 Favored 'General case' 0 C--N 1.352 0.686 0 N-CA-C 111.921 0.341 . . . . 39.26 111.921 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.56 -35.46 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 C-N-CA 119.094 -1.043 . . . . 36.62 110.576 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 70.9 m -70.13 -36.52 74.84 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.464 -0.894 . . . . 40.85 111.327 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 51.3 mt -69.04 -41.45 77.65 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 119.965 -0.694 . . . . 33.7 110.975 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.15 -35.32 77.89 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 119.826 -0.75 . . . . 32.3 110.421 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 26.9 mt -61.64 -35.02 76.71 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.132 -1.027 . . . . 33.95 111.219 176.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 6.4 mt -70.38 -43.13 70.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 112.477 0.547 . . . . 42.42 112.477 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' CYS . . . . . . . . . . . . . 4.3 m -65.86 -33.81 76.69 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 119.416 -0.914 . . . . 48.32 111.75 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 73.5 mt -60.86 -45.89 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 120.073 -0.651 . . . . 33.62 109.425 173.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 54.3 mt -61.75 -52.02 65.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 CA-C-O 120.99 0.424 . . . . 36.24 110.549 -179.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -52.99 -45.24 67.76 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.923 -0.485 . . . . 37.5 111.394 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' MET . . . . . . . . . . . . . 34.8 mtt -62.18 -45.53 92.98 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.555 -0.458 . . . . 80.38 111.541 -178.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 82.5 mt -55.21 -36.69 66.23 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.979 -0.689 . . . . 35.06 111.505 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -64.95 -41.79 95.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.834 0.35 . . . . 55.6 111.376 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -61.64 -0.16 0.4 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.749 1.018 . . . . 72.8 113.749 175.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.047 0 CA-C-O 122.851 1.251 . . . . 38.46 114.407 174.657 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo . . . . . 0 C--O 1.231 0.132 0 N-CA-C 111.788 -0.12 . . . . 57.7 111.788 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' GLU . . . . . . . . . . . . . . . -60.38 -28.74 68.45 Favored 'General case' 0 C--N 1.329 -0.32 0 O-C-N 123.322 0.389 . . . . 59.79 111.26 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -81.52 -33.99 31.48 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.743 1.016 . . . . 53.01 113.743 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 11.6 mt -63.41 -35.82 81.67 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 118.876 -1.13 . . . . 45.71 110.968 170.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -61.59 -42.02 98.27 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 120.547 0.213 . . . . 76.68 111.27 177.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' TRP . . . . . . . . . . . . . 61.2 t-105 -62.58 -44.4 96.42 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 120.69 0.281 . . . . 43.04 111.392 177.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ILE . . . . . . . . . . . . . 12.7 mt -61.09 -49.19 85.7 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 120.08 -0.648 . . . . 37.48 109.971 -179.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 68.5 m -57.55 -43.27 84.29 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 122.887 0.475 . . . . 44.87 111.613 -179.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -51.66 -59.17 4.58 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.858 0.361 . . . . 35.65 111.796 168.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 19.1 m -57.65 -49.62 75.88 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 116.549 -0.296 . . . . 37.99 111.485 -174.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 20.4 mt -48.61 -44.28 37.02 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.527 -0.306 . . . . 27.89 111.643 172.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -58.54 -47.57 83.74 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 120.664 -0.414 . . . . 35.82 111.158 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tp -60.03 -40.86 90.79 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.605 0.24 . . . . 42.55 111.295 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' ILE . . . . . . . . . . . . . 14.0 mt -62.84 -51.43 72.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 116.393 -0.367 . . . . 27.71 111.017 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' CYS . . . . . . . . . . . . . 80.8 m -55.56 -40.01 71.38 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-O 120.607 0.241 . . . . 33.57 111.62 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 43.2 tp -65.19 -36.72 85.08 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 119.243 -0.983 . . . . 34.97 109.942 -177.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' LEU . . . . . . . . . . . . . 86.0 mt -81.81 -33.67 30.68 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.735 0.643 . . . . 31.81 112.735 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mt -58.77 -40.49 84.12 Favored 'General case' 0 C--O 1.24 0.587 0 O-C-N 121.437 -0.79 . . . . 36.01 110.746 169.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -61.03 -39.39 89.58 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.339 -0.391 . . . . 36.1 111.539 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' CYS . . . . . . . . . . . . . 56.7 m -63.24 -50.86 68.55 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 119.133 -1.027 . . . . 42.21 110.701 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -45.36 -54.34 1.53 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 123.319 0.647 . . . . 35.86 111.167 171.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' ILE . . . . . . . . . . . . . 70.6 mt -56.62 -45.36 82.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 O-C-N 122.201 -0.312 . . . . 42.07 111.358 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.95 -21.9 65.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.089 -1.045 . . . . 46.11 112.952 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' MET . . . . . . . . . . . . . 84.2 mtp -81.1 -37.71 28.48 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 118.439 0.563 . . . . 38.05 111.108 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.28 -46.35 67.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 119.681 -0.808 . . . . 45.03 111.459 173.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -45.39 -48.35 13.53 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.107 0.479 . . . . 52.75 111.551 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ARG . . . . . . . . . . . . . 50.5 ttt-85 -63.62 -49.23 74.1 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.587 -0.279 . . . . 75.47 110.899 -176.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.55 0 N-CA-C 114.903 0.721 . . . . 57.65 114.903 -177.95 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.797 0.332 . . . . 69.65 111.185 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' GLN . . . . . 0.43 ' O ' ' N ' ' D' ' 7' ' ' TRP . 75.2 mt-30 -83.09 -17.97 41.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 64.38 111.183 -179.995 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' LEU . . . . . . . . . . . . . 17.7 mt -56.28 -21.62 25.0 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.166 -0.925 . . . . 51.63 110.396 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -71.92 -25.06 61.75 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.07 -1.085 . . . . 64.15 108.07 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' TRP . . . . . 0.43 ' N ' ' O ' ' D' ' 4' ' ' GLN . 70.7 t-105 -82.46 -44.38 16.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.988 -0.551 . . . . 49.19 111.223 179.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ILE . . . . . . . . . . . . . 3.7 mp -59.3 -57.36 11.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 107.111 -1.44 . . . . 47.75 107.111 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 17.0 m -44.5 -56.03 4.62 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.558 -0.747 . . . . 53.44 110.566 176.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -59.17 -45.47 90.92 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.245 -0.582 . . . . 43.54 111.58 -176.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' CYS . . . . . . . . . . . . . 10.0 m -63.76 -42.93 97.72 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 120.493 0.187 . . . . 41.6 111.461 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' LEU . . . . . . . . . . . . . 61.3 mt -56.12 -59.54 4.78 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 109.783 -0.451 . . . . 41.37 109.783 170.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -40.41 -47.26 2.55 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.185 1.394 . . . . 69.01 109.13 173.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' LEU . . . . . . . . . . . . . 63.1 tp -70.31 -34.38 72.64 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 113.583 0.957 . . . . 40.35 113.583 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' ILE . . . . . . . . . . . . . 18.4 mt -67.82 -43.08 86.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 119.637 -0.825 . . . . 41.65 110.774 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.9 -42.57 76.2 Favored 'General case' 0 C--O 1.241 0.616 0 O-C-N 121.668 -0.645 . . . . 48.52 111.566 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mp -50.99 -53.75 30.5 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 120.354 -0.538 . . . . 47.95 111.076 170.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.55 -32.88 73.95 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 119.475 -0.89 . . . . 46.14 111.085 -175.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' LEU . . . . . . . . . . . . . 33.6 mt -71.11 -42.52 69.17 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.776 -0.369 . . . . 43.0 111.791 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 20.0 mt -52.44 -42.07 63.81 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.445 -0.902 . . . . 51.87 111.823 170.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' CYS . . . . . . . . . . . . . 58.9 m -63.39 -44.67 94.05 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 120.084 -0.646 . . . . 59.47 111.136 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ILE . . . . . . . . . . . . . 88.0 mt -55.22 -37.36 43.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.133 0.492 . . . . 52.58 110.19 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' ILE . . . . . . . . . . . . . 18.4 mt -63.78 -53.41 44.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 121.082 0.468 . . . . 57.76 110.138 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -49.24 -42.33 40.26 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.343 0.498 . . . . 71.47 112.343 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' MET . . . . . . . . . . . . . 15.3 mtp -81.35 -21.6 39.01 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.689 0.626 . . . . 62.21 112.689 -171.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 65.2 mt -80.43 -25.22 39.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.705 -0.398 . . . . 70.1 111.463 169.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.54 -68.62 0.63 Allowed 'General case' 0 C--O 1.235 0.302 0 N-CA-C 110.287 -0.264 . . . . 84.33 110.287 172.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -53.25 -27.01 20.22 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 122.671 0.388 . . . . 93.44 111.977 -177.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 O-C-N 121.818 -0.551 . . . . 82.23 112.278 177.801 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 . . . . . 0 C--O 1.231 0.109 0 N-CA-C 109.332 -0.618 . . . . 62.36 109.332 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' LEU . . . . . 0.426 ' O ' ' N ' ' E' ' 9' ' ' SER . 4.2 mm? -54.7 -42.66 71.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 60.96 110.758 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' LYS . . . . . 0.701 ' O ' ' N ' ' E' ' 10' ' ' PHE . 2.9 tptm -51.65 -42.1 61.82 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.332 -0.988 . . . . 65.35 108.332 178.917 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -58.34 -43.32 88.23 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.199 -1.037 . . . . 98.1 108.199 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' ILE . . . . . . . . . . . . . 96.8 mt -70.32 -28.86 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.547 -0.909 . . . . 53.61 108.547 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 9' ' ' SER . . . . . 0.426 ' N ' ' O ' ' E' ' 5' ' ' LEU . 44.8 m -84.46 -32.13 24.19 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.33 -0.395 . . . . 54.14 110.117 179.275 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 10' ' ' PHE . . . . . 0.701 ' N ' ' O ' ' E' ' 6' ' ' LYS . 64.8 t80 -72.71 -52.56 14.68 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.176 -0.609 . . . . 70.04 109.977 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 11' ' ' CYS . . . . . . . . . . . . . 96.6 m -57.92 -38.93 76.79 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.819 0.674 . . . . 52.98 112.819 178.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 12' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.48 -49.8 73.96 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.007 -0.677 . . . . 42.06 111.185 178.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 13' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -49.78 -48.85 50.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.324 0.583 . . . . 51.25 110.551 171.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 tp -60.72 -31.69 70.97 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.378 0.51 . . . . 48.83 112.378 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 15' ' ' ILE . . . . . . . . . . . . . 27.9 mt -73.71 -43.66 53.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 C-N-CA 119.363 -0.935 . . . . 38.93 110.159 -175.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 11.9 m -55.91 -46.14 78.49 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 120.904 0.383 . . . . 47.06 111.238 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mt -54.47 -53.92 47.78 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.377 -0.929 . . . . 47.84 110.163 172.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 18' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.26 -30.36 68.23 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 111.809 0.3 . . . . 42.72 111.809 -176.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 36.8 mt -72.87 -51.03 20.28 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 119.463 -0.895 . . . . 45.25 110.635 175.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 20' ' ' LEU . . . . . . . . . . . . . 10.6 mt -49.28 -36.7 21.41 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.39 0.614 . . . . 45.28 111.194 171.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 21' ' ' CYS . . . . . . . . . . . . . 49.3 t -66.34 -42.17 88.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.037 -0.983 . . . . 61.37 109.369 178.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' ILE . . . . . . . . . . . . . 60.4 mt -71.23 -41.15 74.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.33 -0.548 . . . . 53.42 110.639 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' ILE . . . . . . . . . . . . . 22.6 mt -60.61 -32.09 50.72 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 119.985 -0.686 . . . . 53.0 110.904 176.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -64.12 -46.56 83.62 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 118.82 -1.152 . . . . 64.21 110.811 176.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' MET . . . . . . . . . . . . . 62.6 mtt -66.16 -32.81 74.48 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.931 -0.708 . . . . 86.29 111.63 -175.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' LEU . . . . . . . . . . . . . 33.1 mt -72.48 -33.82 67.25 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 119.744 -0.782 . . . . 72.84 111.026 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 27' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -82.19 11.8 4.96 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.868 0.867 . . . . 80.59 112.73 171.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 28' ' ' ARG . . . . . . . . . . . . . 72.9 ttp85 -106.19 -22.95 12.71 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 119.052 0.842 . . . . 90.55 112.876 -178.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 118.041 0.382 . . . . 82.02 112.686 174.836 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 C--O 1.236 0.38 0 N-CA-C 110.411 -0.218 . . . . 81.92 110.411 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -60.96 -26.68 67.71 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.423 -0.511 . . . . 78.19 111.564 174.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' LEU . . . . . . . . . . . . . 6.6 mt -58.97 -42.46 89.97 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.78 -0.768 . . . . 54.85 111.933 177.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -72.32 -38.09 68.77 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.247 -0.581 . . . . 65.32 111.128 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 7' ' ' TRP . . . . . . . . . . . . . 37.8 t-105 -52.66 -55.49 22.16 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 119.813 -0.755 . . . . 51.34 110.664 172.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 8' ' ' ILE . . . . . . . . . . . . . 80.1 mt -49.11 -48.99 16.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 121.179 0.514 . . . . 51.75 110.738 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 9' ' ' SER . . . . . . . . . . . . . 63.8 m -62.29 -34.44 76.59 Favored 'General case' 0 CA--C 1.511 -0.54 0 C-N-CA 120.473 -0.491 . . . . 57.67 111.464 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 10' ' ' PHE . . . . . 0.491 ' CE1' ' SG ' ' A' ' 21' ' ' CYS . 87.3 t80 -61.25 -68.11 0.34 Allowed 'General case' 0 C--O 1.237 0.417 0 C-N-CA 118.579 -1.248 . . . . 43.82 110.905 174.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 11' ' ' CYS . . . . . . . . . . . . . 61.4 m -33.6 -43.27 0.12 Allowed 'General case' 0 C--O 1.238 0.479 0 N-CA-C 114.682 1.364 . . . . 45.48 114.682 173.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 12' ' ' LEU . . . . . . . . . . . . . 45.4 mt -69.65 -53.84 16.76 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.509 -0.476 . . . . 42.07 111.552 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 13' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -45.71 -41.51 10.62 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 120.958 0.408 . . . . 45.97 111.79 168.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 tp -64.99 -49.72 69.12 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.898 -0.501 . . . . 42.11 111.507 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 15' ' ' ILE . . . . . . . . . . . . . 27.6 mt -57.73 -34.29 47.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 122.295 -0.253 . . . . 39.59 110.536 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 16' ' ' CYS . . . . . . . . . . . . . 36.1 m -59.68 -54.72 43.08 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.918 0.389 . . . . 46.06 111.356 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 17' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.41 -37.85 84.96 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.312 -0.555 . . . . 44.31 111.131 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 18' ' ' LEU . . . . . . . . . . . . . 16.6 mt -66.89 -53.6 30.59 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 120.259 -0.576 . . . . 43.57 111.251 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 96.0 mt -53.85 -36.15 62.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 44.84 110.042 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 20' ' ' LEU . . . . . . . . . . . . . 24.3 tp -66.98 -33.22 75.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.011 -0.541 . . . . 48.17 109.619 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 21' ' ' CYS . . . . . . . . . . . . . 78.1 m -63.25 -42.31 99.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.973 -0.558 . . . . 58.49 109.707 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 22' ' ' ILE . . . . . . . . . . . . . 3.1 mt -55.68 -37.87 48.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.011 -0.541 . . . . 47.35 109.616 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' ILE . . . . . . . . . . . . . 57.2 mt -64.8 -45.92 93.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.059 -0.519 . . . . 62.1 109.668 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -64.08 -32.7 74.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 70.77 109.713 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' MET . . . . . . . . . . . . . 32.5 mtp -76.19 -31.08 58.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.011 -0.541 . . . . 63.56 111.646 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' LEU . . . . . . . . . . . . . 92.5 mt -80.84 -23.09 39.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.368 -0.378 . . . . 70.65 111.274 -179.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 27' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -83.9 -27.08 28.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 98.01 111.27 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 28' ' ' ARG . . . . . . . . . . . . . 34.8 ptt85 -73.41 2.8 6.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 89.32 111.289 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 CA-C-N 116.201 -0.454 . . . . 67.47 112.528 -179.99 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 121.31 0.576 . . . . 71.92 109.651 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 4' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -62.41 -34.71 77.28 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 119.395 -0.922 . . . . 59.74 110.902 162.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.73 -35.84 81.89 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 121.002 -0.279 . . . . 52.93 111.615 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mttt -53.67 -43.19 68.66 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 120.089 -0.644 . . . . 74.62 111.128 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 7' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -71.01 -42.89 68.99 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 120.696 -0.402 . . . . 85.09 111.043 -175.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 8' ' ' ILE . . . . . . . . . . . . . 49.7 mt -51.84 -41.32 29.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.557 -0.457 . . . . 49.69 110.314 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 9' ' ' SER . . . . . . . . . . . . . 67.4 m -70.4 -40.72 73.74 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 120.678 0.275 . . . . 42.73 111.545 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 10' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -65.5 -31.06 71.93 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 118.284 -1.366 . . . . 49.07 112.258 172.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -72.11 -44.5 63.1 Favored 'General case' 0 C--O 1.238 0.463 0 O-C-N 121.932 -0.48 . . . . 42.96 111.767 -178.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 12' ' ' LEU . . . . . . . . . . . . . 68.9 mt -59.57 -39.21 83.31 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.993 -0.683 . . . . 37.23 111.346 176.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 13' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -58.98 -45.83 89.6 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 120.308 -0.557 . . . . 42.89 111.666 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 14' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.78 -45.13 95.55 Favored 'General case' 0 C--N 1.352 0.695 0 N-CA-C 111.945 0.35 . . . . 41.94 111.945 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 15' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.56 -35.51 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 119.09 -1.044 . . . . 34.33 110.561 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 16' ' ' CYS . . . . . . . . . . . . . 70.8 m -70.11 -36.52 74.9 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.48 -0.888 . . . . 40.46 111.324 178.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 17' ' ' LEU . . . . . . . . . . . . . 51.6 mt -68.64 -41.99 78.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.944 -0.702 . . . . 36.85 111.555 175.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 18' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.72 -41.12 99.01 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.563 -0.744 . . . . 35.39 110.079 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 19' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.64 -35.28 77.47 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.335 -0.546 . . . . 34.79 110.434 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 20' ' ' LEU . . . . . . . . . . . . . 6.4 mt -69.55 -41.73 75.53 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 113.62 0.97 . . . . 45.61 113.62 -178.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 21' ' ' CYS . . . . . . . . . . . . . 86.3 m -62.33 -43.7 98.22 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.708 -0.849 . . . . 49.03 108.708 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 22' ' ' ILE . . . . . . . . . . . . . 69.1 mt -57.3 -46.37 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 108.075 -1.083 . . . . 36.67 108.075 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 23' ' ' ILE . . . . . . . . . . . . . 54.2 mt -61.76 -52.04 65.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-O 120.967 0.413 . . . . 36.51 110.559 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -52.98 -45.25 67.73 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.981 -0.45 . . . . 40.93 111.381 178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 25' ' ' MET . . . . . . . . . . . . . 34.7 mtt -62.22 -45.49 93.13 Favored 'General case' 0 CA--C 1.512 -0.49 0 C-N-CA 120.587 -0.445 . . . . 80.86 111.5 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 26' ' ' LEU . . . . . . . . . . . . . 82.6 mt -55.3 -36.57 66.32 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 120.0 -0.68 . . . . 43.47 111.492 176.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -65.0 -41.85 95.01 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.792 0.33 . . . . 53.08 111.361 174.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 28' ' ' ARG . . . . . . . . . . . . . 57.8 mmm-85 -61.63 -0.11 0.39 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.776 1.028 . . . . 65.92 113.776 175.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.081 0 CA-C-O 122.9 1.278 . . . . 45.56 114.384 174.666 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 3' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 C--O 1.235 0.334 0 N-CA-C 112.157 0.429 . . . . 70.34 112.157 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 4' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -79.73 -34.15 40.27 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 113.725 1.009 . . . . 58.04 113.725 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 5' ' ' LEU . . . . . . . . . . . . . 11.6 mt -63.38 -35.76 81.46 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 118.842 -1.143 . . . . 46.39 111.012 170.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -61.6 -42.01 98.26 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.534 0.207 . . . . 74.24 111.264 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 7' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -62.64 -44.37 96.45 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.679 0.276 . . . . 41.86 111.381 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 8' ' ' ILE . . . . . . . . . . . . . 12.7 mt -61.05 -49.21 85.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 C-N-CA 120.056 -0.657 . . . . 39.61 110.006 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 9' ' ' SER . . . . . 0.435 ' OG ' ' OE1' ' I' ' 4' ' ' GLN . 68.7 m -57.55 -43.27 84.29 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 122.894 0.477 . . . . 43.24 111.597 -179.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 10' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -51.69 -59.11 4.66 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.831 0.348 . . . . 38.26 111.793 168.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 m -57.74 -49.57 76.13 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 116.605 -0.271 . . . . 34.36 111.468 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 12' ' ' LEU . . . . . . . . . . . . . 20.3 mt -48.6 -44.32 36.86 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 116.566 -0.288 . . . . 29.99 111.667 172.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 13' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -58.54 -47.54 83.87 Favored 'General case' 0 CA--C 1.514 -0.44 0 C-N-CA 120.632 -0.427 . . . . 38.46 111.222 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tp -60.0 -40.86 90.67 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 120.627 0.251 . . . . 41.3 111.339 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 mt -62.78 -51.52 70.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 CA-C-N 116.375 -0.375 . . . . 27.42 111.036 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' CYS . . . . . . . . . . . . . 80.5 m -55.57 -39.96 71.34 Favored 'General case' 0 C--N 1.35 0.59 0 O-C-N 122.298 -0.251 . . . . 44.56 111.571 177.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' LEU . . . . . . . . . . . . . 42.9 tp -65.26 -36.67 84.83 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 119.2 -1.0 . . . . 37.47 109.914 -177.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' LEU . . . . . . . . . . . . . 86.3 mt -81.84 -33.67 30.56 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.719 0.637 . . . . 31.76 112.719 -177.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mt -58.78 -40.49 84.15 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 119.812 -0.755 . . . . 36.47 110.677 169.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.02 -39.38 89.53 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.348 -0.387 . . . . 35.2 111.594 175.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' CYS . . . . . . . . . . . . . 56.7 m -63.24 -50.87 68.48 Favored 'General case' 0 CA--C 1.513 -0.481 0 C-N-CA 119.215 -0.994 . . . . 38.28 110.696 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -45.31 -54.35 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.444 0 C-N-CA 123.298 0.639 . . . . 39.98 111.219 170.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' ILE . . . . . . . . . . . . . 70.4 mt -56.69 -45.32 82.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 O-C-N 122.274 -0.266 . . . . 43.1 111.327 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -67.91 -21.9 65.1 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 119.099 -1.041 . . . . 45.02 112.962 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' MET . . . . . . . . . . . . . 84.2 mtp -81.1 -37.77 28.39 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 118.468 0.576 . . . . 41.11 111.028 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.35 -46.25 67.46 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 119.661 -0.816 . . . . 44.19 111.481 173.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -45.5 -48.25 14.09 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.058 0.456 . . . . 50.28 111.593 169.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' ARG . . . . . . . . . . . . . 50.6 ttt-85 -63.68 -49.18 74.2 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.589 -0.278 . . . . 81.25 110.912 -176.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.569 0 N-CA-C 114.864 0.706 . . . . 62.75 114.864 -177.927 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 3' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.797 0.332 . . . . 76.43 111.207 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 4' ' ' GLN . . . . . 0.435 ' OE1' ' OG ' ' H' ' 9' ' ' SER . 61.6 mm-40 -62.48 -30.77 71.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 65.71 111.213 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 5' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -55.63 -46.85 77.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 59.5 110.893 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 6' ' ' LYS . . . . . . . . . . . . . 8.4 mttp -51.82 -48.78 63.74 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.075 0.398 . . . . 54.05 112.075 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 7' ' ' TRP . . . . . . . . . . . . . 37.5 t-105 -60.18 -30.07 69.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 50.24 110.615 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 8' ' ' ILE . . . . . . . . . . . . . 37.8 mt -79.37 -44.67 23.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.022 -0.733 . . . . 41.13 109.022 179.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 9' ' ' SER . . . . . . . . . . . . . 63.0 m -58.72 -35.99 73.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.879 -0.786 . . . . 61.22 108.879 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -72.17 -45.48 60.24 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.84 -0.618 . . . . 40.35 111.609 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 11' ' ' CYS . . . . . . . . . . . . . 10.0 m -63.76 -42.96 97.72 Favored 'General case' 0 C--O 1.241 0.643 0 O-C-N 122.416 -0.178 . . . . 40.2 111.447 -176.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 12' ' ' LEU . . . . . . . . . . . . . 61.9 mt -55.18 -60.7 3.02 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.859 0.361 . . . . 41.82 110.859 170.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 13' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -41.72 -44.74 3.29 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.17 1.388 . . . . 65.4 109.627 173.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 14' ' ' LEU . . . . . . . . . . . . . 60.5 tp -70.72 -35.14 72.56 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.296 -0.411 . . . . 43.4 112.097 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mt -67.8 -43.08 86.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 119.693 -0.803 . . . . 44.18 110.806 -176.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.94 -42.54 76.32 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 121.668 -0.645 . . . . 58.53 111.534 175.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mp -51.0 -53.74 30.7 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.283 -0.567 . . . . 52.69 111.148 169.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -67.52 -32.87 73.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.479 -0.889 . . . . 44.17 111.077 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 19' ' ' LEU . . . . . . . . . . . . . 33.4 mt -71.13 -42.52 69.09 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.815 -0.354 . . . . 41.65 111.774 175.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 20' ' ' LEU . . . . . . . . . . . . . 19.9 mt -52.41 -42.06 63.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.537 -0.865 . . . . 49.79 111.827 170.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 21' ' ' CYS . . . . . . . . . . . . . 59.0 m -63.49 -44.62 93.83 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 120.021 -0.672 . . . . 63.68 111.139 -178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 22' ' ' ILE . . . . . . . . . . . . . 87.9 mt -55.19 -37.34 43.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.134 0.492 . . . . 49.12 110.226 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 23' ' ' ILE . . . . . . . . . . . . . 18.4 mt -63.74 -53.48 44.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.131 0.491 . . . . 59.81 110.143 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 24' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -49.23 -42.36 40.31 Favored 'General case' 0 C--N 1.334 -0.083 0 N-CA-C 112.385 0.513 . . . . 75.54 112.385 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 25' ' ' MET . . . . . . . . . . . . . 15.3 mtp -81.3 -21.57 39.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.708 0.633 . . . . 75.84 112.708 -171.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 26' ' ' LEU . . . . . . . . . . . . . 65.1 mt -80.41 -25.23 39.15 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.707 -0.397 . . . . 76.04 111.487 169.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.47 -68.71 0.62 Allowed 'General case' 0 C--O 1.235 0.3 0 N-CA-C 110.29 -0.263 . . . . 92.09 110.29 172.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 28' ' ' ARG . . . . . . . . . . . . . 34.2 ttp180 -53.17 -27.0 19.13 Favored 'General case' 0 C--N 1.348 0.502 0 C-N-CA 122.673 0.389 . . . . 99.6 112.01 -177.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 O-C-N 121.878 -0.514 . . . . 75.58 112.279 177.809 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 4' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.823 0.344 . . . . 69.32 111.231 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -62.78 -33.13 74.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 70.58 111.181 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 6' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -51.62 -38.6 55.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 65.05 111.158 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 7' ' ' TRP . . . . . . . . . . . . . 68.8 m95 -75.05 -41.38 59.21 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.18 -0.463 . . . . 95.72 111.752 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 8' ' ' ILE . . . . . . . . . . . . . 7.3 mt -58.75 -41.84 83.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 C-N-CA 120.688 -0.405 . . . . 50.59 110.586 168.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 9' ' ' SER . . . . . . . . . . . . . 2.7 m -64.06 -40.2 95.75 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 122.103 -0.373 . . . . 56.94 111.525 176.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 10' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -76.31 -44.29 37.58 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.347 -0.941 . . . . 49.83 112.199 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 11' ' ' CYS . . . . . . . . . . . . . 92.2 m -55.68 -39.38 70.9 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.3 -0.56 . . . . 50.89 111.427 174.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 12' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.49 -49.78 74.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.991 -0.684 . . . . 43.14 111.185 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 13' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -49.82 -48.83 50.58 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.34 0.591 . . . . 50.92 110.56 171.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 tp -60.72 -31.74 71.03 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.34 0.496 . . . . 47.03 112.34 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 15' ' ' ILE . . . . . . . . . . . . . 27.9 mt -73.63 -43.66 54.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 C-N-CA 119.363 -0.935 . . . . 44.22 110.161 -175.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 16' ' ' CYS . . . . . . . . . . . . . 12.0 m -55.94 -46.11 78.6 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 120.936 0.398 . . . . 47.42 111.287 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 17' ' ' LEU . . . . . . . . . . . . . 67.7 tp -54.53 -53.89 48.48 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.308 -0.957 . . . . 55.98 110.132 172.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 18' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.25 -30.34 68.21 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 111.796 0.295 . . . . 46.35 111.796 -176.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 19' ' ' LEU . . . . . . . . . . . . . 36.6 mt -72.92 -50.76 21.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 119.41 -0.916 . . . . 43.13 110.584 175.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -52.77 -35.0 55.75 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.426 -0.583 . . . . 48.71 109.426 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 21' ' ' CYS . . . . . . . . . . . . . 71.9 m -66.03 -52.34 50.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.945 -0.57 . . . . 61.23 109.778 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 22' ' ' ILE . . . . . . . . . . . . . 93.7 mt -56.74 -41.66 75.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 109.295 -0.631 . . . . 54.28 109.295 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 23' ' ' ILE . . . . . . . . . . . . . 21.6 mt -61.58 -34.73 63.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 106.219 -1.771 . . . . 52.66 106.219 179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 24' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -64.12 -46.51 83.82 Favored 'General case' 0 C--N 1.343 0.326 0 C-N-CA 118.84 -1.144 . . . . 63.57 110.767 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 25' ' ' MET . . . . . . . . . . . . . 62.6 mtt -66.2 -32.84 74.51 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.947 -0.701 . . . . 78.09 111.633 -175.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 26' ' ' LEU . . . . . . . . . . . . . 32.8 mt -72.39 -33.89 67.51 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.786 -0.766 . . . . 60.69 111.022 176.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 27' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -82.2 11.78 4.98 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.82 0.848 . . . . 75.82 112.682 171.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 28' ' ' ARG . . . . . . . . . . . . . 72.9 ttp85 -106.11 -23.0 12.72 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 119.12 0.873 . . . . 89.03 112.941 -178.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 118.053 0.388 . . . . 76.18 112.723 174.82 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 C--O 1.235 0.341 0 N-CA-C 110.379 -0.23 . . . . 83.86 110.379 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -61.05 -26.64 67.77 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.428 -0.509 . . . . 74.3 111.539 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.6 mt -58.95 -42.51 90.04 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 119.826 -0.75 . . . . 58.18 111.902 177.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.5 mttt -72.25 -38.16 68.95 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.247 -0.581 . . . . 68.93 111.143 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 37.9 t-105 -52.65 -55.51 22.02 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 119.832 -0.747 . . . . 54.88 110.614 172.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . 0.428 HG23 HD11 ' E' ' 12' ' ' LEU . 80.1 mt -49.08 -49.06 16.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 121.198 0.523 . . . . 50.17 110.724 177.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.8 m -62.23 -34.42 76.47 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 120.437 -0.505 . . . . 50.37 111.509 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -61.2 -68.18 0.34 Allowed 'General case' 0 C--O 1.238 0.449 0 C-N-CA 118.592 -1.243 . . . . 42.79 110.926 174.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.1 m -33.59 -43.23 0.12 Allowed 'General case' 0 C--O 1.238 0.47 0 N-CA-C 114.661 1.356 . . . . 46.13 114.661 173.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 45.6 mt -69.68 -53.8 16.89 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 120.482 -0.487 . . . . 36.91 111.554 -175.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -45.7 -41.55 10.65 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 120.927 0.394 . . . . 44.9 111.796 168.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 tp -64.94 -49.78 69.01 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 122.0 -0.438 . . . . 40.47 111.485 178.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.5 mt -57.76 -34.27 47.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 O-C-N 122.319 -0.238 . . . . 36.7 110.512 178.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.1 m -59.71 -54.69 43.46 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.878 0.37 . . . . 49.03 111.35 172.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.9 tp -61.36 -37.88 84.96 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.35 -0.54 . . . . 50.23 111.131 -178.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . 0.412 HD22 ' CD1' ' E' ' 23' ' ' ILE . 16.6 mt -66.95 -54.9 17.42 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.289 -0.565 . . . . 39.66 111.158 179.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.9 mt -48.52 -48.11 38.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.458 -0.497 . . . . 38.42 111.179 170.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.0 tp -57.33 -38.94 74.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 42.25 109.869 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.5 t -68.21 -36.73 79.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.97 -0.559 . . . . 75.86 109.887 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.2 mt -62.43 -39.85 85.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.992 -0.549 . . . . 47.68 109.985 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.7 mt -62.33 -29.44 46.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.099 -0.501 . . . . 55.29 110.305 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -75.47 -40.67 57.11 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 111.966 0.358 . . . . 58.62 111.966 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.4 mtp -60.59 -40.08 90.46 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 111.883 0.327 . . . . 61.47 111.883 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.0 mt -68.15 -43.26 78.68 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 118.682 -1.207 . . . . 62.73 111.159 -175.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -68.69 -15.47 63.53 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 123.295 0.372 . . . . 97.53 111.235 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.4 ttp85 -72.41 -37.62 68.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 85.33 111.226 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 CA-C-N 116.197 -0.456 . . . . 72.2 112.536 179.998 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.464 0.254 0 CA-C-O 121.284 0.564 . . . . 73.32 109.641 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -62.42 -34.72 77.32 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.374 -0.931 . . . . 55.45 110.954 162.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.72 -35.84 81.91 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.984 -0.286 . . . . 51.88 111.602 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mttt -53.58 -43.19 68.34 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.037 -0.665 . . . . 61.6 111.187 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -71.04 -42.88 68.9 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 120.633 -0.427 . . . . 77.78 111.075 -175.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 49.4 mt -51.84 -41.34 29.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 120.583 -0.447 . . . . 47.36 110.303 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 67.6 m -70.35 -40.82 73.86 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.706 0.288 . . . . 43.99 111.547 -178.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -65.45 -31.08 71.97 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 118.297 -1.361 . . . . 49.58 112.275 172.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -72.09 -44.47 63.2 Favored 'General case' 0 C--O 1.238 0.461 0 O-C-N 121.916 -0.49 . . . . 45.4 111.802 -178.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . 0.425 ' CD1' HG23 ' C' ' 8' ' ' ILE . 68.7 mt -59.59 -39.19 83.37 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 119.98 -0.688 . . . . 37.73 111.352 176.596 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' PHE . . . . . 0.472 ' CZ ' HD11 ' B' ' 17' ' ' LEU . 14.3 t80 -58.99 -45.78 89.78 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 120.232 -0.587 . . . . 41.97 111.683 177.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.74 -45.2 95.18 Favored 'General case' 0 C--N 1.352 0.686 0 N-CA-C 111.921 0.341 . . . . 39.26 111.921 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.56 -35.46 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 C-N-CA 119.094 -1.043 . . . . 36.62 110.576 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 70.9 m -70.13 -36.52 74.84 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.464 -0.894 . . . . 40.85 111.327 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . 0.472 HD11 ' CZ ' ' B' ' 13' ' ' PHE . 51.3 mt -69.04 -41.45 77.65 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 119.965 -0.694 . . . . 33.7 110.975 175.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.15 -35.32 77.89 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 119.826 -0.75 . . . . 32.3 110.421 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LEU . . . . . 0.412 ' O ' HG13 ' B' ' 23' ' ' ILE . 26.9 mt -61.64 -35.02 76.71 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.132 -1.027 . . . . 33.95 111.219 176.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 6.4 mt -70.38 -43.13 70.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 112.477 0.547 . . . . 42.42 112.477 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' CYS . . . . . . . . . . . . . 4.3 m -65.86 -33.81 76.69 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 119.416 -0.914 . . . . 48.32 111.75 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 73.5 mt -60.86 -45.89 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 120.073 -0.651 . . . . 33.62 109.425 173.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ILE . . . . . 0.454 HD12 HD22 ' C' ' 18' ' ' LEU . 54.3 mt -61.75 -52.02 65.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 CA-C-O 120.99 0.424 . . . . 36.24 110.549 -179.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -52.99 -45.24 67.76 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.923 -0.485 . . . . 37.5 111.394 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' MET . . . . . . . . . . . . . 34.8 mtt -62.18 -45.53 92.98 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.555 -0.458 . . . . 80.38 111.541 -178.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 82.5 mt -55.21 -36.69 66.23 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.979 -0.689 . . . . 35.06 111.505 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -64.95 -41.79 95.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.834 0.35 . . . . 55.6 111.376 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -61.64 -0.16 0.4 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.749 1.018 . . . . 72.8 113.749 175.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.047 0 CA-C-O 122.851 1.251 . . . . 38.46 114.407 174.657 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo . . . . . 0 C--O 1.231 0.132 0 N-CA-C 111.788 -0.12 . . . . 57.7 111.788 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 3' ' ' GLU . . . . . . . . . . . . . . . -60.38 -28.74 68.45 Favored 'General case' 0 C--N 1.329 -0.32 0 O-C-N 123.322 0.389 . . . . 59.79 111.26 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -81.52 -33.99 31.48 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.743 1.016 . . . . 53.01 113.743 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' LEU . . . . . 0.4 ' HB3' ' OE1' ' D' ' 4' ' ' GLN . 11.6 mt -63.41 -35.82 81.67 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 118.876 -1.13 . . . . 45.71 110.968 170.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -61.59 -42.02 98.27 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 120.547 0.213 . . . . 76.68 111.27 177.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' TRP . . . . . . . . . . . . . 61.2 t-105 -62.58 -44.4 96.42 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 120.69 0.281 . . . . 43.04 111.392 177.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' B' ' 12' ' ' LEU . 12.7 mt -61.09 -49.19 85.7 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 120.08 -0.648 . . . . 37.48 109.971 -179.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 68.5 m -57.55 -43.27 84.29 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 122.887 0.475 . . . . 44.87 111.613 -179.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' PHE . . . . . 0.433 ' O ' ' HB3' ' C' ' 13' ' ' PHE . 79.9 t80 -51.66 -59.17 4.58 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.858 0.361 . . . . 35.65 111.796 168.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 19.1 m -57.65 -49.62 75.88 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 116.549 -0.296 . . . . 37.99 111.485 -174.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' C' ' 12' ' ' LEU . 20.4 mt -48.61 -44.28 37.02 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.527 -0.306 . . . . 27.89 111.643 172.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 13' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' C' ' 10' ' ' PHE . 70.3 t80 -58.54 -47.57 83.74 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 120.664 -0.414 . . . . 35.82 111.158 176.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tp -60.03 -40.86 90.79 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.605 0.24 . . . . 42.55 111.295 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' ILE . . . . . . . . . . . . . 14.0 mt -62.84 -51.43 72.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 116.393 -0.367 . . . . 27.71 111.017 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' CYS . . . . . . . . . . . . . 80.8 m -55.56 -40.01 71.38 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-O 120.607 0.241 . . . . 33.57 111.62 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 43.2 tp -65.19 -36.72 85.08 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 119.243 -0.983 . . . . 34.97 109.942 -177.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' LEU . . . . . 0.454 HD22 HD12 ' B' ' 23' ' ' ILE . 86.0 mt -81.81 -33.67 30.68 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.735 0.643 . . . . 31.81 112.735 -177.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 19' ' ' LEU . . . . . 0.452 ' HA ' HD23 ' C' ' 19' ' ' LEU . 7.0 mt -58.77 -40.49 84.12 Favored 'General case' 0 C--O 1.24 0.587 0 O-C-N 121.437 -0.79 . . . . 36.01 110.746 169.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -61.03 -39.39 89.58 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.339 -0.391 . . . . 36.1 111.539 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' CYS . . . . . . . . . . . . . 56.7 m -63.24 -50.86 68.55 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 119.133 -1.027 . . . . 42.21 110.701 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -45.36 -54.34 1.53 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 123.319 0.647 . . . . 35.86 111.167 171.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' ILE . . . . . . . . . . . . . 70.6 mt -56.62 -45.36 82.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 O-C-N 122.201 -0.312 . . . . 42.07 111.358 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.95 -21.9 65.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.089 -1.045 . . . . 46.11 112.952 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' MET . . . . . . . . . . . . . 84.2 mtp -81.1 -37.71 28.48 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 118.439 0.563 . . . . 38.05 111.108 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.28 -46.35 67.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 119.681 -0.808 . . . . 45.03 111.459 173.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -45.39 -48.35 13.53 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.107 0.479 . . . . 52.75 111.551 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ARG . . . . . . . . . . . . . 50.5 ttt-85 -63.62 -49.23 74.1 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.587 -0.279 . . . . 75.47 110.899 -176.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.55 0 N-CA-C 114.903 0.721 . . . . 57.65 114.903 -177.95 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 3' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.797 0.332 . . . . 69.65 111.185 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 4' ' ' GLN . . . . . 0.534 ' O ' HD12 ' D' ' 8' ' ' ILE . 75.2 mt-30 -83.09 -17.97 41.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 64.38 111.183 -179.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 5' ' ' LEU . . . . . 0.642 HD23 HD13 ' D' ' 8' ' ' ILE . 17.7 mt -56.28 -21.62 25.0 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.166 -0.925 . . . . 51.63 110.396 -179.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -71.92 -25.06 61.75 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.07 -1.085 . . . . 64.15 108.07 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -82.46 -44.38 16.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.988 -0.551 . . . . 49.19 111.223 179.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ILE . . . . . 0.642 HD13 HD23 ' D' ' 5' ' ' LEU . 3.7 mp -59.3 -57.36 11.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 107.111 -1.44 . . . . 47.75 107.111 178.474 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 17.0 m -44.5 -56.03 4.62 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.558 -0.747 . . . . 53.44 110.566 176.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -59.17 -45.47 90.92 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.245 -0.582 . . . . 43.54 111.58 -176.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' CYS . . . . . . . . . . . . . 10.0 m -63.76 -42.93 97.72 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 120.493 0.187 . . . . 41.6 111.461 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' LEU . . . . . . . . . . . . . 61.3 mt -56.12 -59.54 4.78 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 109.783 -0.451 . . . . 41.37 109.783 170.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -40.41 -47.26 2.55 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.185 1.394 . . . . 69.01 109.13 173.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' LEU . . . . . . . . . . . . . 63.1 tp -70.31 -34.38 72.64 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 113.583 0.957 . . . . 40.35 113.583 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' ILE . . . . . 0.414 HG23 ' CD1' ' C' ' 19' ' ' LEU . 18.4 mt -67.82 -43.08 86.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 119.637 -0.825 . . . . 41.65 110.774 -176.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.9 -42.57 76.2 Favored 'General case' 0 C--O 1.241 0.616 0 O-C-N 121.668 -0.645 . . . . 48.52 111.566 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mp -50.99 -53.75 30.5 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 120.354 -0.538 . . . . 47.95 111.076 170.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.55 -32.88 73.95 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 119.475 -0.89 . . . . 46.14 111.085 -175.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' LEU . . . . . . . . . . . . . 33.6 mt -71.11 -42.52 69.17 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.776 -0.369 . . . . 43.0 111.791 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 20.0 mt -52.44 -42.07 63.81 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.445 -0.902 . . . . 51.87 111.823 170.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' CYS . . . . . . . . . . . . . 58.9 m -63.39 -44.67 94.05 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 120.084 -0.646 . . . . 59.47 111.136 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ILE . . . . . . . . . . . . . 88.0 mt -55.22 -37.36 43.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.133 0.492 . . . . 52.58 110.19 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' ILE . . . . . . . . . . . . . 18.4 mt -63.78 -53.41 44.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 121.082 0.468 . . . . 57.76 110.138 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -49.24 -42.33 40.26 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.343 0.498 . . . . 71.47 112.343 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' MET . . . . . . . . . . . . . 15.3 mtp -81.35 -21.6 39.01 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.689 0.626 . . . . 62.21 112.689 -171.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 65.2 mt -80.43 -25.22 39.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.705 -0.398 . . . . 70.1 111.463 169.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.54 -68.62 0.63 Allowed 'General case' 0 C--O 1.235 0.302 0 N-CA-C 110.287 -0.264 . . . . 84.33 110.287 172.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -53.25 -27.01 20.22 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 122.671 0.388 . . . . 93.44 111.977 -177.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 O-C-N 121.818 -0.551 . . . . 82.23 112.278 177.801 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 4' ' ' GLN . . . . . 0.557 ' O ' ' HB2' ' E' ' 7' ' ' TRP . 5.0 tt0 . . . . . 0 C--O 1.231 0.109 0 N-CA-C 109.332 -0.618 . . . . 62.36 109.332 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 5' ' ' LEU . . . . . 0.424 ' O ' ' N ' ' E' ' 9' ' ' SER . 4.2 mm? -54.7 -42.66 71.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 60.96 110.758 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 6' ' ' LYS . . . . . 0.682 ' O ' ' N ' ' E' ' 10' ' ' PHE . 2.9 tptm -51.65 -42.1 61.82 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.332 -0.988 . . . . 65.35 108.332 178.917 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 7' ' ' TRP . . . . . 0.557 ' HB2' ' O ' ' E' ' 4' ' ' GLN . 14.6 m95 -58.34 -43.32 88.23 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.199 -1.037 . . . . 98.1 108.199 178.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 8' ' ' ILE . . . . . . . . . . . . . 96.8 mt -70.32 -28.86 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.547 -0.909 . . . . 53.61 108.547 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 9' ' ' SER . . . . . 0.424 ' N ' ' O ' ' E' ' 5' ' ' LEU . 44.8 m -84.46 -32.13 24.19 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.33 -0.395 . . . . 54.14 110.117 179.275 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 10' ' ' PHE . . . . . 0.682 ' N ' ' O ' ' E' ' 6' ' ' LYS . 64.8 t80 -72.71 -52.56 14.68 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.176 -0.609 . . . . 70.04 109.977 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 11' ' ' CYS . . . . . . . . . . . . . 96.6 m -57.92 -38.93 76.79 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.819 0.674 . . . . 52.98 112.819 178.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 12' ' ' LEU . . . . . 0.428 HD11 HG23 ' A' ' 8' ' ' ILE . 7.1 mt -62.48 -49.8 73.96 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.007 -0.677 . . . . 42.06 111.185 178.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 13' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -49.78 -48.85 50.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.324 0.583 . . . . 51.25 110.551 171.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 14' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' E' ' 14' ' ' LEU . 9.5 tp -60.72 -31.69 70.97 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.378 0.51 . . . . 48.83 112.378 -176.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 15' ' ' ILE . . . . . . . . . . . . . 27.9 mt -73.71 -43.66 53.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 C-N-CA 119.363 -0.935 . . . . 38.93 110.159 -175.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 11.9 m -55.91 -46.14 78.49 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 120.904 0.383 . . . . 47.06 111.238 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 17' ' ' LEU . . . . . 0.636 HD22 HD13 ' J' ' 17' ' ' LEU . 11.3 mt -54.47 -53.92 47.78 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.377 -0.929 . . . . 47.84 110.163 172.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 18' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.26 -30.36 68.23 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 111.809 0.3 . . . . 42.72 111.809 -176.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 36.8 mt -72.87 -51.03 20.28 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 119.463 -0.895 . . . . 45.25 110.635 175.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 20' ' ' LEU . . . . . . . . . . . . . 10.6 mt -49.28 -36.7 21.41 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.39 0.614 . . . . 45.28 111.194 171.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 21' ' ' CYS . . . . . . . . . . . . . 49.3 t -66.34 -42.17 88.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.037 -0.983 . . . . 61.37 109.369 178.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 22' ' ' ILE . . . . . . . . . . . . . 60.4 mt -71.23 -41.15 74.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.33 -0.548 . . . . 53.42 110.639 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 23' ' ' ILE . . . . . 0.412 ' CD1' HD22 ' A' ' 18' ' ' LEU . 22.6 mt -60.61 -32.09 50.72 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 119.985 -0.686 . . . . 53.0 110.904 176.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 24' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -64.12 -46.56 83.62 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 118.82 -1.152 . . . . 64.21 110.811 176.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 25' ' ' MET . . . . . . . . . . . . . 62.6 mtt -66.16 -32.81 74.48 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.931 -0.708 . . . . 86.29 111.63 -175.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 26' ' ' LEU . . . . . . . . . . . . . 33.1 mt -72.48 -33.82 67.25 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 119.744 -0.782 . . . . 72.84 111.026 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 27' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -82.19 11.8 4.96 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.868 0.867 . . . . 80.59 112.73 171.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 28' ' ' ARG . . . . . . . . . . . . . 72.9 ttp85 -106.19 -22.95 12.71 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 119.052 0.842 . . . . 90.55 112.876 -178.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 118.041 0.382 . . . . 82.02 112.686 174.836 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 C--O 1.236 0.38 0 N-CA-C 110.411 -0.218 . . . . 81.92 110.411 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -60.96 -26.68 67.71 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.423 -0.511 . . . . 78.19 111.564 174.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 5' ' ' LEU . . . . . . . . . . . . . 6.6 mt -58.97 -42.46 89.97 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.78 -0.768 . . . . 54.85 111.933 177.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 6' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -72.32 -38.09 68.77 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.247 -0.581 . . . . 65.32 111.128 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 7' ' ' TRP . . . . . . . . . . . . . 37.8 t-105 -52.66 -55.49 22.16 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 119.813 -0.755 . . . . 51.34 110.664 172.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 8' ' ' ILE . . . . . 0.428 HG23 HD11 ' J' ' 12' ' ' LEU . 80.1 mt -49.11 -48.99 16.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 121.179 0.514 . . . . 51.75 110.738 177.276 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 9' ' ' SER . . . . . . . . . . . . . 63.8 m -62.29 -34.44 76.59 Favored 'General case' 0 CA--C 1.511 -0.54 0 C-N-CA 120.473 -0.491 . . . . 57.67 111.464 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 10' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -61.25 -68.11 0.34 Allowed 'General case' 0 C--O 1.237 0.417 0 C-N-CA 118.579 -1.248 . . . . 43.82 110.905 174.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 11' ' ' CYS . . . . . . . . . . . . . 61.4 m -33.6 -43.27 0.12 Allowed 'General case' 0 C--O 1.238 0.479 0 N-CA-C 114.682 1.364 . . . . 45.48 114.682 173.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 12' ' ' LEU . . . . . . . . . . . . . 45.4 mt -69.65 -53.84 16.76 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.509 -0.476 . . . . 42.07 111.552 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 13' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -45.71 -41.51 10.62 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 120.958 0.408 . . . . 45.97 111.79 168.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 tp -64.99 -49.72 69.12 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.898 -0.501 . . . . 42.11 111.507 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 15' ' ' ILE . . . . . 0.488 ' O ' ' HG ' ' F' ' 19' ' ' LEU . 27.6 mt -57.73 -34.29 47.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 122.295 -0.253 . . . . 39.59 110.536 178.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 16' ' ' CYS . . . . . . . . . . . . . 36.1 m -59.68 -54.72 43.08 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.918 0.389 . . . . 46.06 111.356 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 17' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.41 -37.85 84.96 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.312 -0.555 . . . . 44.31 111.131 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 18' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' F' ' 18' ' ' LEU . 16.6 mt -66.89 -53.6 30.59 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 120.259 -0.576 . . . . 43.57 111.251 179.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 19' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' F' ' 15' ' ' ILE . 96.0 mt -53.85 -36.15 62.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 44.84 110.042 179.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 20' ' ' LEU . . . . . . . . . . . . . 24.3 tp -66.98 -33.22 75.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.011 -0.541 . . . . 48.17 109.619 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 21' ' ' CYS . . . . . . . . . . . . . 78.1 m -63.25 -42.31 99.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.973 -0.558 . . . . 58.49 109.707 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 22' ' ' ILE . . . . . 0.486 ' O ' ' HG ' ' F' ' 26' ' ' LEU . 3.1 mt -55.68 -37.87 48.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.011 -0.541 . . . . 47.35 109.616 179.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 23' ' ' ILE . . . . . . . . . . . . . 57.2 mt -64.8 -45.92 93.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.059 -0.519 . . . . 62.1 109.668 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 24' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -64.08 -32.7 74.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 70.77 109.713 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 25' ' ' MET . . . . . 0.431 ' O ' ' HG2' ' F' ' 28' ' ' ARG . 32.5 mtp -76.19 -31.08 58.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.011 -0.541 . . . . 63.56 111.646 179.535 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 26' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' F' ' 22' ' ' ILE . 92.5 mt -80.84 -23.09 39.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.368 -0.378 . . . . 70.65 111.274 -179.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 27' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -83.9 -27.08 28.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 98.01 111.27 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 28' ' ' ARG . . . . . 0.431 ' HG2' ' O ' ' F' ' 25' ' ' MET . 34.8 ptt85 -73.41 2.8 6.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 89.32 111.289 -179.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 CA-C-N 116.201 -0.454 . . . . 67.47 112.528 -179.99 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 121.31 0.576 . . . . 71.92 109.651 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 4' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -62.41 -34.71 77.28 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 119.395 -0.922 . . . . 59.74 110.902 162.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.73 -35.84 81.89 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 121.002 -0.279 . . . . 52.93 111.615 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mttt -53.67 -43.19 68.66 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 120.089 -0.644 . . . . 74.62 111.128 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 7' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -71.01 -42.89 68.99 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 120.696 -0.402 . . . . 85.09 111.043 -175.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 8' ' ' ILE . . . . . . . . . . . . . 49.7 mt -51.84 -41.32 29.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.557 -0.457 . . . . 49.69 110.314 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 9' ' ' SER . . . . . . . . . . . . . 67.4 m -70.4 -40.72 73.74 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 120.678 0.275 . . . . 42.73 111.545 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 10' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -65.5 -31.06 71.93 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 118.284 -1.366 . . . . 49.07 112.258 172.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -72.11 -44.5 63.1 Favored 'General case' 0 C--O 1.238 0.463 0 O-C-N 121.932 -0.48 . . . . 42.96 111.767 -178.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 12' ' ' LEU . . . . . 0.425 ' CD1' HG23 ' H' ' 8' ' ' ILE . 68.9 mt -59.57 -39.21 83.31 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.993 -0.683 . . . . 37.23 111.346 176.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 13' ' ' PHE . . . . . 0.473 ' CZ ' HD11 ' G' ' 17' ' ' LEU . 14.3 t80 -58.98 -45.83 89.6 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 120.308 -0.557 . . . . 42.89 111.666 177.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 14' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.78 -45.13 95.55 Favored 'General case' 0 C--N 1.352 0.695 0 N-CA-C 111.945 0.35 . . . . 41.94 111.945 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 15' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.56 -35.51 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 119.09 -1.044 . . . . 34.33 110.561 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 16' ' ' CYS . . . . . . . . . . . . . 70.8 m -70.11 -36.52 74.9 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.48 -0.888 . . . . 40.46 111.324 178.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 17' ' ' LEU . . . . . 0.473 HD11 ' CZ ' ' G' ' 13' ' ' PHE . 51.6 mt -68.64 -41.99 78.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.944 -0.702 . . . . 36.85 111.555 175.192 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 18' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.72 -41.12 99.01 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.563 -0.744 . . . . 35.39 110.079 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 19' ' ' LEU . . . . . 0.413 ' O ' HG13 ' G' ' 23' ' ' ILE . 25.3 mt -61.64 -35.28 77.47 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.335 -0.546 . . . . 34.79 110.434 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 20' ' ' LEU . . . . . . . . . . . . . 6.4 mt -69.55 -41.73 75.53 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 113.62 0.97 . . . . 45.61 113.62 -178.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 21' ' ' CYS . . . . . . . . . . . . . 86.3 m -62.33 -43.7 98.22 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.708 -0.849 . . . . 49.03 108.708 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 22' ' ' ILE . . . . . . . . . . . . . 69.1 mt -57.3 -46.37 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 108.075 -1.083 . . . . 36.67 108.075 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 23' ' ' ILE . . . . . 0.454 HD12 HD22 ' H' ' 18' ' ' LEU . 54.2 mt -61.76 -52.04 65.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-O 120.967 0.413 . . . . 36.51 110.559 179.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -52.98 -45.25 67.73 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.981 -0.45 . . . . 40.93 111.381 178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 25' ' ' MET . . . . . . . . . . . . . 34.7 mtt -62.22 -45.49 93.13 Favored 'General case' 0 CA--C 1.512 -0.49 0 C-N-CA 120.587 -0.445 . . . . 80.86 111.5 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 26' ' ' LEU . . . . . . . . . . . . . 82.6 mt -55.3 -36.57 66.32 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 120.0 -0.68 . . . . 43.47 111.492 176.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -65.0 -41.85 95.01 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.792 0.33 . . . . 53.08 111.361 174.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 28' ' ' ARG . . . . . . . . . . . . . 57.8 mmm-85 -61.63 -0.11 0.39 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.776 1.028 . . . . 65.92 113.776 175.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.081 0 CA-C-O 122.9 1.278 . . . . 45.56 114.384 174.666 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 3' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 C--O 1.235 0.334 0 N-CA-C 112.157 0.429 . . . . 70.34 112.157 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 4' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -79.73 -34.15 40.27 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 113.725 1.009 . . . . 58.04 113.725 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 5' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' H' ' 5' ' ' LEU . 11.6 mt -63.38 -35.76 81.46 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 118.842 -1.143 . . . . 46.39 111.012 170.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -61.6 -42.01 98.26 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.534 0.207 . . . . 74.24 111.264 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 7' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -62.64 -44.37 96.45 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.679 0.276 . . . . 41.86 111.381 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 8' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' G' ' 12' ' ' LEU . 12.7 mt -61.05 -49.21 85.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 C-N-CA 120.056 -0.657 . . . . 39.61 110.006 -179.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 9' ' ' SER . . . . . . . . . . . . . 68.7 m -57.55 -43.27 84.29 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 122.894 0.477 . . . . 43.24 111.597 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 10' ' ' PHE . . . . . 0.433 ' O ' ' HB3' ' H' ' 13' ' ' PHE . 79.8 t80 -51.69 -59.11 4.66 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.831 0.348 . . . . 38.26 111.793 168.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 m -57.74 -49.57 76.13 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 116.605 -0.271 . . . . 34.36 111.468 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 12' ' ' LEU . . . . . 0.601 HD11 HG23 ' I' ' 8' ' ' ILE . 20.3 mt -48.6 -44.32 36.86 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 116.566 -0.288 . . . . 29.99 111.667 172.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 13' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' H' ' 10' ' ' PHE . 70.2 t80 -58.54 -47.54 83.87 Favored 'General case' 0 CA--C 1.514 -0.44 0 C-N-CA 120.632 -0.427 . . . . 38.46 111.222 176.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tp -60.0 -40.86 90.67 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 120.627 0.251 . . . . 41.3 111.339 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 mt -62.78 -51.52 70.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 CA-C-N 116.375 -0.375 . . . . 27.42 111.036 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 16' ' ' CYS . . . . . . . . . . . . . 80.5 m -55.57 -39.96 71.34 Favored 'General case' 0 C--N 1.35 0.59 0 O-C-N 122.298 -0.251 . . . . 44.56 111.571 177.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' LEU . . . . . . . . . . . . . 42.9 tp -65.26 -36.67 84.83 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 119.2 -1.0 . . . . 37.47 109.914 -177.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 18' ' ' LEU . . . . . 0.454 HD22 HD12 ' G' ' 23' ' ' ILE . 86.3 mt -81.84 -33.67 30.56 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.719 0.637 . . . . 31.76 112.719 -177.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 19' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' H' ' 19' ' ' LEU . 7.0 mt -58.78 -40.49 84.15 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 119.812 -0.755 . . . . 36.47 110.677 169.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 20' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.02 -39.38 89.53 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.348 -0.387 . . . . 35.2 111.594 175.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' CYS . . . . . . . . . . . . . 56.7 m -63.24 -50.87 68.48 Favored 'General case' 0 CA--C 1.513 -0.481 0 C-N-CA 119.215 -0.994 . . . . 38.28 110.696 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -45.31 -54.35 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.444 0 C-N-CA 123.298 0.639 . . . . 39.98 111.219 170.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 23' ' ' ILE . . . . . . . . . . . . . 70.4 mt -56.69 -45.32 82.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 O-C-N 122.274 -0.266 . . . . 43.1 111.327 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 24' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -67.91 -21.9 65.1 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 119.099 -1.041 . . . . 45.02 112.962 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' MET . . . . . . . . . . . . . 84.2 mtp -81.1 -37.77 28.39 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 118.468 0.576 . . . . 41.11 111.028 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.35 -46.25 67.46 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 119.661 -0.816 . . . . 44.19 111.481 173.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 27' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -45.5 -48.25 14.09 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.058 0.456 . . . . 50.28 111.593 169.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 28' ' ' ARG . . . . . . . . . . . . . 50.6 ttt-85 -63.68 -49.18 74.2 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.589 -0.278 . . . . 81.25 110.912 -176.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.569 0 N-CA-C 114.864 0.706 . . . . 62.75 114.864 -177.927 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 3' ' ' GLU . . . . . 0.534 ' HG2' ' H ' ' I' ' 4' ' ' GLN . 5.5 tt0 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.797 0.332 . . . . 76.43 111.207 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 4' ' ' GLN . . . . . 0.534 ' H ' ' HG2' ' I' ' 3' ' ' GLU . 61.6 mm-40 -62.48 -30.77 71.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 65.71 111.213 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 5' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -55.63 -46.85 77.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 59.5 110.893 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 6' ' ' LYS . . . . . . . . . . . . . 8.4 mttp -51.82 -48.78 63.74 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.075 0.398 . . . . 54.05 112.075 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 7' ' ' TRP . . . . . . . . . . . . . 37.5 t-105 -60.18 -30.07 69.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 50.24 110.615 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 8' ' ' ILE . . . . . 0.601 HG23 HD11 ' H' ' 12' ' ' LEU . 37.8 mt -79.37 -44.67 23.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.022 -0.733 . . . . 41.13 109.022 179.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 9' ' ' SER . . . . . . . . . . . . . 63.0 m -58.72 -35.99 73.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.879 -0.786 . . . . 61.22 108.879 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -72.17 -45.48 60.24 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.84 -0.618 . . . . 40.35 111.609 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 11' ' ' CYS . . . . . . . . . . . . . 10.0 m -63.76 -42.96 97.72 Favored 'General case' 0 C--O 1.241 0.643 0 O-C-N 122.416 -0.178 . . . . 40.2 111.447 -176.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 12' ' ' LEU . . . . . . . . . . . . . 61.9 mt -55.18 -60.7 3.02 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.859 0.361 . . . . 41.82 110.859 170.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 13' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -41.72 -44.74 3.29 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.17 1.388 . . . . 65.4 109.627 173.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 14' ' ' LEU . . . . . . . . . . . . . 60.5 tp -70.72 -35.14 72.56 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.296 -0.411 . . . . 43.4 112.097 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 15' ' ' ILE . . . . . 0.414 HG23 ' CD1' ' H' ' 19' ' ' LEU . 18.5 mt -67.8 -43.08 86.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 119.693 -0.803 . . . . 44.18 110.806 -176.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.94 -42.54 76.32 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 121.668 -0.645 . . . . 58.53 111.534 175.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mp -51.0 -53.74 30.7 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.283 -0.567 . . . . 52.69 111.148 169.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -67.52 -32.87 73.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.479 -0.889 . . . . 44.17 111.077 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 19' ' ' LEU . . . . . . . . . . . . . 33.4 mt -71.13 -42.52 69.09 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.815 -0.354 . . . . 41.65 111.774 175.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 20' ' ' LEU . . . . . . . . . . . . . 19.9 mt -52.41 -42.06 63.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.537 -0.865 . . . . 49.79 111.827 170.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 21' ' ' CYS . . . . . . . . . . . . . 59.0 m -63.49 -44.62 93.83 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 120.021 -0.672 . . . . 63.68 111.139 -178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 22' ' ' ILE . . . . . . . . . . . . . 87.9 mt -55.19 -37.34 43.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.134 0.492 . . . . 49.12 110.226 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 23' ' ' ILE . . . . . . . . . . . . . 18.4 mt -63.74 -53.48 44.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.131 0.491 . . . . 59.81 110.143 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 24' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -49.23 -42.36 40.31 Favored 'General case' 0 C--N 1.334 -0.083 0 N-CA-C 112.385 0.513 . . . . 75.54 112.385 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 25' ' ' MET . . . . . . . . . . . . . 15.3 mtp -81.3 -21.57 39.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.708 0.633 . . . . 75.84 112.708 -171.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 26' ' ' LEU . . . . . . . . . . . . . 65.1 mt -80.41 -25.23 39.15 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.707 -0.397 . . . . 76.04 111.487 169.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.47 -68.71 0.62 Allowed 'General case' 0 C--O 1.235 0.3 0 N-CA-C 110.29 -0.263 . . . . 92.09 110.29 172.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 28' ' ' ARG . . . . . . . . . . . . . 34.2 ttp180 -53.17 -27.0 19.13 Favored 'General case' 0 C--N 1.348 0.502 0 C-N-CA 122.673 0.389 . . . . 99.6 112.01 -177.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 O-C-N 121.878 -0.514 . . . . 75.58 112.279 177.809 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 4' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.823 0.344 . . . . 69.32 111.231 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -62.78 -33.13 74.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 70.58 111.181 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 6' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -51.62 -38.6 55.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 65.05 111.158 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 7' ' ' TRP . . . . . . . . . . . . . 68.8 m95 -75.05 -41.38 59.21 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.18 -0.463 . . . . 95.72 111.752 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 8' ' ' ILE . . . . . . . . . . . . . 7.3 mt -58.75 -41.84 83.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 C-N-CA 120.688 -0.405 . . . . 50.59 110.586 168.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 9' ' ' SER . . . . . . . . . . . . . 2.7 m -64.06 -40.2 95.75 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 122.103 -0.373 . . . . 56.94 111.525 176.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 10' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -76.31 -44.29 37.58 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.347 -0.941 . . . . 49.83 112.199 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 11' ' ' CYS . . . . . . . . . . . . . 92.2 m -55.68 -39.38 70.9 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.3 -0.56 . . . . 50.89 111.427 174.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 12' ' ' LEU . . . . . 0.428 HD11 HG23 ' F' ' 8' ' ' ILE . 7.1 mt -62.49 -49.78 74.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.991 -0.684 . . . . 43.14 111.185 178.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 13' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -49.82 -48.83 50.58 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.34 0.591 . . . . 50.92 110.56 171.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 tp -60.72 -31.74 71.03 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.34 0.496 . . . . 47.03 112.34 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 15' ' ' ILE . . . . . . . . . . . . . 27.9 mt -73.63 -43.66 54.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 C-N-CA 119.363 -0.935 . . . . 44.22 110.161 -175.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 16' ' ' CYS . . . . . . . . . . . . . 12.0 m -55.94 -46.11 78.6 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 120.936 0.398 . . . . 47.42 111.287 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 17' ' ' LEU . . . . . 0.636 HD13 HD22 ' E' ' 17' ' ' LEU . 67.7 tp -54.53 -53.89 48.48 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.308 -0.957 . . . . 55.98 110.132 172.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 18' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.25 -30.34 68.21 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 111.796 0.295 . . . . 46.35 111.796 -176.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 19' ' ' LEU . . . . . . . . . . . . . 36.6 mt -72.92 -50.76 21.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 119.41 -0.916 . . . . 43.13 110.584 175.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -52.77 -35.0 55.75 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.426 -0.583 . . . . 48.71 109.426 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 21' ' ' CYS . . . . . . . . . . . . . 71.9 m -66.03 -52.34 50.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.945 -0.57 . . . . 61.23 109.778 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 22' ' ' ILE . . . . . . . . . . . . . 93.7 mt -56.74 -41.66 75.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 109.295 -0.631 . . . . 54.28 109.295 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 23' ' ' ILE . . . . . 0.413 ' CD1' HD22 ' F' ' 18' ' ' LEU . 21.6 mt -61.58 -34.73 63.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 106.219 -1.771 . . . . 52.66 106.219 179.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 24' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -64.12 -46.51 83.82 Favored 'General case' 0 C--N 1.343 0.326 0 C-N-CA 118.84 -1.144 . . . . 63.57 110.767 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 25' ' ' MET . . . . . . . . . . . . . 62.6 mtt -66.2 -32.84 74.51 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.947 -0.701 . . . . 78.09 111.633 -175.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 26' ' ' LEU . . . . . . . . . . . . . 32.8 mt -72.39 -33.89 67.51 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.786 -0.766 . . . . 60.69 111.022 176.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 27' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -82.2 11.78 4.98 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.82 0.848 . . . . 75.82 112.682 171.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 28' ' ' ARG . . . . . . . . . . . . . 72.9 ttp85 -106.11 -23.0 12.72 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 119.12 0.873 . . . . 89.03 112.941 -178.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 118.053 0.388 . . . . 76.18 112.723 174.82 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 C--O 1.235 0.341 0 N-CA-C 110.379 -0.23 . . . . 83.86 110.379 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -61.05 -26.64 67.77 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.428 -0.509 . . . . 74.3 111.539 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.6 mt -58.95 -42.51 90.04 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 119.826 -0.75 . . . . 58.18 111.902 177.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.5 mttt -72.25 -38.16 68.95 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.247 -0.581 . . . . 68.93 111.143 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 37.9 t-105 -52.65 -55.51 22.02 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 119.832 -0.747 . . . . 54.88 110.614 172.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.428 HG23 HD11 ' E' ' 12' ' ' LEU . 80.1 mt -49.08 -49.06 16.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 121.198 0.523 . . . . 50.17 110.724 177.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.8 m -62.23 -34.42 76.47 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 120.437 -0.505 . . . . 50.37 111.509 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -61.2 -68.18 0.34 Allowed 'General case' 0 C--O 1.238 0.449 0 C-N-CA 118.592 -1.243 . . . . 42.79 110.926 174.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.1 m -33.59 -43.23 0.12 Allowed 'General case' 0 C--O 1.238 0.47 0 N-CA-C 114.661 1.356 . . . . 46.13 114.661 173.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 45.6 mt -69.68 -53.8 16.89 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 120.482 -0.487 . . . . 36.91 111.554 -175.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -45.7 -41.55 10.65 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 120.927 0.394 . . . . 44.9 111.796 168.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 tp -64.94 -49.78 69.01 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 122.0 -0.438 . . . . 40.47 111.485 178.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.5 mt -57.76 -34.27 47.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 O-C-N 122.319 -0.238 . . . . 36.7 110.512 178.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.1 m -59.71 -54.69 43.46 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.878 0.37 . . . . 49.03 111.35 172.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.9 tp -61.36 -37.88 84.96 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.35 -0.54 . . . . 50.23 111.131 -178.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.412 HD22 ' CD1' ' E' ' 23' ' ' ILE . 16.6 mt -66.95 -54.9 17.42 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.289 -0.565 . . . . 39.66 111.158 179.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.9 mt -48.52 -48.11 38.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.458 -0.497 . . . . 38.42 111.179 170.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.0 tp -57.33 -38.94 74.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 42.25 109.869 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.5 t -68.21 -36.73 79.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.97 -0.559 . . . . 75.86 109.887 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.2 mt -62.43 -39.85 85.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.992 -0.549 . . . . 47.68 109.985 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.7 mt -62.33 -29.44 46.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.099 -0.501 . . . . 55.29 110.305 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -75.47 -40.67 57.11 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 111.966 0.358 . . . . 58.62 111.966 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 65.4 mtp -60.59 -40.08 90.46 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 111.883 0.327 . . . . 61.47 111.883 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.0 mt -68.15 -43.26 78.68 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 118.682 -1.207 . . . . 62.73 111.159 -175.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -68.69 -15.47 63.53 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 123.295 0.372 . . . . 97.53 111.235 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.4 ttp85 -72.41 -37.62 68.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 85.33 111.226 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 CA-C-N 116.197 -0.456 . . . . 72.2 112.536 179.998 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.464 0.254 0 CA-C-O 121.284 0.564 . . . . 73.32 109.641 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -62.42 -34.72 77.32 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.374 -0.931 . . . . 55.45 110.954 162.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.72 -35.84 81.91 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.984 -0.286 . . . . 51.88 111.602 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mttt -53.58 -43.19 68.34 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.037 -0.665 . . . . 61.6 111.187 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -71.04 -42.88 68.9 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 120.633 -0.427 . . . . 77.78 111.075 -175.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ILE . . . . . . . . . . . . . 49.4 mt -51.84 -41.34 29.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 120.583 -0.447 . . . . 47.36 110.303 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 67.6 m -70.35 -40.82 73.86 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.706 0.288 . . . . 43.99 111.547 -178.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -65.45 -31.08 71.97 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 118.297 -1.361 . . . . 49.58 112.275 172.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -72.09 -44.47 63.2 Favored 'General case' 0 C--O 1.238 0.461 0 O-C-N 121.916 -0.49 . . . . 45.4 111.802 -178.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.425 ' CD1' HG23 ' C' ' 8' ' ' ILE . 68.7 mt -59.59 -39.19 83.37 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 119.98 -0.688 . . . . 37.73 111.352 176.596 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.472 ' CZ ' HD11 ' B' ' 17' ' ' LEU . 14.3 t80 -58.99 -45.78 89.78 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 120.232 -0.587 . . . . 41.97 111.683 177.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.74 -45.2 95.18 Favored 'General case' 0 C--N 1.352 0.686 0 N-CA-C 111.921 0.341 . . . . 39.26 111.921 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.56 -35.46 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 C-N-CA 119.094 -1.043 . . . . 36.62 110.576 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 70.9 m -70.13 -36.52 74.84 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.464 -0.894 . . . . 40.85 111.327 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.472 HD11 ' CZ ' ' B' ' 13' ' ' PHE . 51.3 mt -69.04 -41.45 77.65 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 119.965 -0.694 . . . . 33.7 110.975 175.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.15 -35.32 77.89 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 119.826 -0.75 . . . . 32.3 110.421 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.412 ' O ' HG13 ' B' ' 23' ' ' ILE . 26.9 mt -61.64 -35.02 76.71 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.132 -1.027 . . . . 33.95 111.219 176.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 6.4 mt -70.38 -43.13 70.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 112.477 0.547 . . . . 42.42 112.477 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' CYS . . . . . . . . . . . . . 4.3 m -65.86 -33.81 76.69 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 119.416 -0.914 . . . . 48.32 111.75 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 73.5 mt -60.86 -45.89 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 120.073 -0.651 . . . . 33.62 109.425 173.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.454 HD12 HD22 ' C' ' 18' ' ' LEU . 54.3 mt -61.75 -52.02 65.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.465 0 CA-C-O 120.99 0.424 . . . . 36.24 110.549 -179.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -52.99 -45.24 67.76 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.923 -0.485 . . . . 37.5 111.394 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' MET . . . . . . . . . . . . . 34.8 mtt -62.18 -45.53 92.98 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.555 -0.458 . . . . 80.38 111.541 -178.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 82.5 mt -55.21 -36.69 66.23 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.979 -0.689 . . . . 35.06 111.505 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -64.95 -41.79 95.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.834 0.35 . . . . 55.6 111.376 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -61.64 -0.16 0.4 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.749 1.018 . . . . 72.8 113.749 175.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.047 0 CA-C-O 122.851 1.251 . . . . 38.46 114.407 174.657 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo . . . . . 0 C--O 1.231 0.132 0 N-CA-C 111.788 -0.12 . . . . 57.7 111.788 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' GLU . . . . . . . . . . . . . . . -60.38 -28.74 68.45 Favored 'General case' 0 C--N 1.329 -0.32 0 O-C-N 123.322 0.389 . . . . 59.79 111.26 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -81.52 -33.99 31.48 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.743 1.016 . . . . 53.01 113.743 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' LEU . . . . . 0.4 ' HB3' ' OE1' ' D' ' 4' ' ' GLN . 11.6 mt -63.41 -35.82 81.67 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 118.876 -1.13 . . . . 45.71 110.968 170.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -61.59 -42.02 98.27 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 120.547 0.213 . . . . 76.68 111.27 177.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' TRP . . . . . . . . . . . . . 61.2 t-105 -62.58 -44.4 96.42 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 120.69 0.281 . . . . 43.04 111.392 177.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' B' ' 12' ' ' LEU . 12.7 mt -61.09 -49.19 85.7 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 120.08 -0.648 . . . . 37.48 109.971 -179.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 68.5 m -57.55 -43.27 84.29 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 122.887 0.475 . . . . 44.87 111.613 -179.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' PHE . . . . . 0.433 ' O ' ' HB3' ' C' ' 13' ' ' PHE . 79.9 t80 -51.66 -59.17 4.58 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.858 0.361 . . . . 35.65 111.796 168.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 19.1 m -57.65 -49.62 75.88 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 116.549 -0.296 . . . . 37.99 111.485 -174.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' C' ' 12' ' ' LEU . 20.4 mt -48.61 -44.28 37.02 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.527 -0.306 . . . . 27.89 111.643 172.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' C' ' 10' ' ' PHE . 70.3 t80 -58.54 -47.57 83.74 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 120.664 -0.414 . . . . 35.82 111.158 176.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tp -60.03 -40.86 90.79 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.605 0.24 . . . . 42.55 111.295 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' ILE . . . . . . . . . . . . . 14.0 mt -62.84 -51.43 72.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 116.393 -0.367 . . . . 27.71 111.017 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' CYS . . . . . . . . . . . . . 80.8 m -55.56 -40.01 71.38 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-O 120.607 0.241 . . . . 33.57 111.62 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 43.2 tp -65.19 -36.72 85.08 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 119.243 -0.983 . . . . 34.97 109.942 -177.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' LEU . . . . . 0.454 HD22 HD12 ' B' ' 23' ' ' ILE . 86.0 mt -81.81 -33.67 30.68 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.735 0.643 . . . . 31.81 112.735 -177.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' LEU . . . . . 0.452 ' HA ' HD23 ' C' ' 19' ' ' LEU . 7.0 mt -58.77 -40.49 84.12 Favored 'General case' 0 C--O 1.24 0.587 0 O-C-N 121.437 -0.79 . . . . 36.01 110.746 169.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -61.03 -39.39 89.58 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.339 -0.391 . . . . 36.1 111.539 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' CYS . . . . . . . . . . . . . 56.7 m -63.24 -50.86 68.55 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 119.133 -1.027 . . . . 42.21 110.701 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -45.36 -54.34 1.53 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 123.319 0.647 . . . . 35.86 111.167 171.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' ILE . . . . . . . . . . . . . 70.6 mt -56.62 -45.36 82.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 O-C-N 122.201 -0.312 . . . . 42.07 111.358 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -67.95 -21.9 65.07 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.089 -1.045 . . . . 46.11 112.952 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' MET . . . . . . . . . . . . . 84.2 mtp -81.1 -37.71 28.48 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 118.439 0.563 . . . . 38.05 111.108 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.28 -46.35 67.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 119.681 -0.808 . . . . 45.03 111.459 173.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -45.39 -48.35 13.53 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.107 0.479 . . . . 52.75 111.551 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ARG . . . . . . . . . . . . . 50.5 ttt-85 -63.62 -49.23 74.1 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.587 -0.279 . . . . 75.47 110.899 -176.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.55 0 N-CA-C 114.903 0.721 . . . . 57.65 114.903 -177.95 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.797 0.332 . . . . 69.65 111.185 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' GLN . . . . . 0.534 ' O ' HD12 ' D' ' 8' ' ' ILE . 75.2 mt-30 -83.09 -17.97 41.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 64.38 111.183 -179.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' LEU . . . . . 0.642 HD23 HD13 ' D' ' 8' ' ' ILE . 17.7 mt -56.28 -21.62 25.0 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.166 -0.925 . . . . 51.63 110.396 -179.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -71.92 -25.06 61.75 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.07 -1.085 . . . . 64.15 108.07 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -82.46 -44.38 16.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.988 -0.551 . . . . 49.19 111.223 179.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ILE . . . . . 0.642 HD13 HD23 ' D' ' 5' ' ' LEU . 3.7 mp -59.3 -57.36 11.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 107.111 -1.44 . . . . 47.75 107.111 178.474 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 17.0 m -44.5 -56.03 4.62 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.558 -0.747 . . . . 53.44 110.566 176.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -59.17 -45.47 90.92 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.245 -0.582 . . . . 43.54 111.58 -176.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' CYS . . . . . . . . . . . . . 10.0 m -63.76 -42.93 97.72 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 120.493 0.187 . . . . 41.6 111.461 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' LEU . . . . . . . . . . . . . 61.3 mt -56.12 -59.54 4.78 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 109.783 -0.451 . . . . 41.37 109.783 170.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -40.41 -47.26 2.55 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.185 1.394 . . . . 69.01 109.13 173.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' LEU . . . . . . . . . . . . . 63.1 tp -70.31 -34.38 72.64 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 113.583 0.957 . . . . 40.35 113.583 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' ILE . . . . . 0.414 HG23 ' CD1' ' C' ' 19' ' ' LEU . 18.4 mt -67.82 -43.08 86.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 119.637 -0.825 . . . . 41.65 110.774 -176.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.9 -42.57 76.2 Favored 'General case' 0 C--O 1.241 0.616 0 O-C-N 121.668 -0.645 . . . . 48.52 111.566 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mp -50.99 -53.75 30.5 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 120.354 -0.538 . . . . 47.95 111.076 170.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.55 -32.88 73.95 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 119.475 -0.89 . . . . 46.14 111.085 -175.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' LEU . . . . . . . . . . . . . 33.6 mt -71.11 -42.52 69.17 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.776 -0.369 . . . . 43.0 111.791 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 20.0 mt -52.44 -42.07 63.81 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.445 -0.902 . . . . 51.87 111.823 170.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' CYS . . . . . . . . . . . . . 58.9 m -63.39 -44.67 94.05 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 120.084 -0.646 . . . . 59.47 111.136 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ILE . . . . . . . . . . . . . 88.0 mt -55.22 -37.36 43.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.133 0.492 . . . . 52.58 110.19 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' ILE . . . . . . . . . . . . . 18.4 mt -63.78 -53.41 44.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 121.082 0.468 . . . . 57.76 110.138 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -49.24 -42.33 40.26 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.343 0.498 . . . . 71.47 112.343 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' MET . . . . . . . . . . . . . 15.3 mtp -81.35 -21.6 39.01 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.689 0.626 . . . . 62.21 112.689 -171.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 65.2 mt -80.43 -25.22 39.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.705 -0.398 . . . . 70.1 111.463 169.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.54 -68.62 0.63 Allowed 'General case' 0 C--O 1.235 0.302 0 N-CA-C 110.287 -0.264 . . . . 84.33 110.287 172.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -53.25 -27.01 20.22 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 122.671 0.388 . . . . 93.44 111.977 -177.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 O-C-N 121.818 -0.551 . . . . 82.23 112.278 177.801 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' GLN . . . . . 0.557 ' O ' ' HB2' ' E' ' 7' ' ' TRP . 5.0 tt0 . . . . . 0 C--O 1.231 0.109 0 N-CA-C 109.332 -0.618 . . . . 62.36 109.332 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' LEU . . . . . 0.424 ' O ' ' N ' ' E' ' 9' ' ' SER . 4.2 mm? -54.7 -42.66 71.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 60.96 110.758 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' LYS . . . . . 0.682 ' O ' ' N ' ' E' ' 10' ' ' PHE . 2.9 tptm -51.65 -42.1 61.82 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.332 -0.988 . . . . 65.35 108.332 178.917 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' TRP . . . . . 0.557 ' HB2' ' O ' ' E' ' 4' ' ' GLN . 14.6 m95 -58.34 -43.32 88.23 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.199 -1.037 . . . . 98.1 108.199 178.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' ILE . . . . . . . . . . . . . 96.8 mt -70.32 -28.86 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.547 -0.909 . . . . 53.61 108.547 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 9' ' ' SER . . . . . 0.424 ' N ' ' O ' ' E' ' 5' ' ' LEU . 44.8 m -84.46 -32.13 24.19 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.33 -0.395 . . . . 54.14 110.117 179.275 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 10' ' ' PHE . . . . . 0.682 ' N ' ' O ' ' E' ' 6' ' ' LYS . 64.8 t80 -72.71 -52.56 14.68 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.176 -0.609 . . . . 70.04 109.977 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 11' ' ' CYS . . . . . . . . . . . . . 96.6 m -57.92 -38.93 76.79 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.819 0.674 . . . . 52.98 112.819 178.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 12' ' ' LEU . . . . . 0.428 HD11 HG23 ' A' ' 8' ' ' ILE . 7.1 mt -62.48 -49.8 73.96 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.007 -0.677 . . . . 42.06 111.185 178.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 13' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -49.78 -48.85 50.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.324 0.583 . . . . 51.25 110.551 171.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 14' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' E' ' 14' ' ' LEU . 9.5 tp -60.72 -31.69 70.97 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.378 0.51 . . . . 48.83 112.378 -176.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 15' ' ' ILE . . . . . . . . . . . . . 27.9 mt -73.71 -43.66 53.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 C-N-CA 119.363 -0.935 . . . . 38.93 110.159 -175.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 16' ' ' CYS . . . . . . . . . . . . . 11.9 m -55.91 -46.14 78.49 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 120.904 0.383 . . . . 47.06 111.238 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 17' ' ' LEU . . . . . 0.636 HD22 HD13 ' J' ' 17' ' ' LEU . 11.3 mt -54.47 -53.92 47.78 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.377 -0.929 . . . . 47.84 110.163 172.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 18' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.26 -30.36 68.23 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 111.809 0.3 . . . . 42.72 111.809 -176.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 36.8 mt -72.87 -51.03 20.28 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 119.463 -0.895 . . . . 45.25 110.635 175.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 20' ' ' LEU . . . . . . . . . . . . . 10.6 mt -49.28 -36.7 21.41 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.39 0.614 . . . . 45.28 111.194 171.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 21' ' ' CYS . . . . . . . . . . . . . 49.3 t -66.34 -42.17 88.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.037 -0.983 . . . . 61.37 109.369 178.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' ILE . . . . . . . . . . . . . 60.4 mt -71.23 -41.15 74.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 C-N-CA 120.33 -0.548 . . . . 53.42 110.639 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' ILE . . . . . 0.412 ' CD1' HD22 ' A' ' 18' ' ' LEU . 22.6 mt -60.61 -32.09 50.72 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 119.985 -0.686 . . . . 53.0 110.904 176.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -64.12 -46.56 83.62 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 118.82 -1.152 . . . . 64.21 110.811 176.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' MET . . . . . . . . . . . . . 62.6 mtt -66.16 -32.81 74.48 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.931 -0.708 . . . . 86.29 111.63 -175.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' LEU . . . . . . . . . . . . . 33.1 mt -72.48 -33.82 67.25 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 119.744 -0.782 . . . . 72.84 111.026 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 27' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -82.19 11.8 4.96 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.868 0.867 . . . . 80.59 112.73 171.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 28' ' ' ARG . . . . . . . . . . . . . 72.9 ttp85 -106.19 -22.95 12.71 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 119.052 0.842 . . . . 90.55 112.876 -178.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 118.041 0.382 . . . . 82.02 112.686 174.836 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 C--O 1.236 0.38 0 N-CA-C 110.411 -0.218 . . . . 81.92 110.411 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -60.96 -26.68 67.71 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.423 -0.511 . . . . 78.19 111.564 174.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' LEU . . . . . . . . . . . . . 6.6 mt -58.97 -42.46 89.97 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.78 -0.768 . . . . 54.85 111.933 177.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -72.32 -38.09 68.77 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.247 -0.581 . . . . 65.32 111.128 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 7' ' ' TRP . . . . . . . . . . . . . 37.8 t-105 -52.66 -55.49 22.16 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 119.813 -0.755 . . . . 51.34 110.664 172.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 8' ' ' ILE . . . . . 0.428 HG23 HD11 ' J' ' 12' ' ' LEU . 80.1 mt -49.11 -48.99 16.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 121.179 0.514 . . . . 51.75 110.738 177.276 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 9' ' ' SER . . . . . . . . . . . . . 63.8 m -62.29 -34.44 76.59 Favored 'General case' 0 CA--C 1.511 -0.54 0 C-N-CA 120.473 -0.491 . . . . 57.67 111.464 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 10' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -61.25 -68.11 0.34 Allowed 'General case' 0 C--O 1.237 0.417 0 C-N-CA 118.579 -1.248 . . . . 43.82 110.905 174.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 11' ' ' CYS . . . . . . . . . . . . . 61.4 m -33.6 -43.27 0.12 Allowed 'General case' 0 C--O 1.238 0.479 0 N-CA-C 114.682 1.364 . . . . 45.48 114.682 173.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 12' ' ' LEU . . . . . . . . . . . . . 45.4 mt -69.65 -53.84 16.76 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.509 -0.476 . . . . 42.07 111.552 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 13' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -45.71 -41.51 10.62 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 120.958 0.408 . . . . 45.97 111.79 168.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 tp -64.99 -49.72 69.12 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.898 -0.501 . . . . 42.11 111.507 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 15' ' ' ILE . . . . . 0.488 ' O ' ' HG ' ' F' ' 19' ' ' LEU . 27.6 mt -57.73 -34.29 47.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 122.295 -0.253 . . . . 39.59 110.536 178.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 16' ' ' CYS . . . . . . . . . . . . . 36.1 m -59.68 -54.72 43.08 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.918 0.389 . . . . 46.06 111.356 172.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 17' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.41 -37.85 84.96 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.312 -0.555 . . . . 44.31 111.131 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 18' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' F' ' 18' ' ' LEU . 16.6 mt -66.89 -53.6 30.59 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 120.259 -0.576 . . . . 43.57 111.251 179.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' F' ' 15' ' ' ILE . 96.0 mt -53.85 -36.15 62.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 44.84 110.042 179.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 20' ' ' LEU . . . . . . . . . . . . . 24.3 tp -66.98 -33.22 75.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.011 -0.541 . . . . 48.17 109.619 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 21' ' ' CYS . . . . . . . . . . . . . 78.1 m -63.25 -42.31 99.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.973 -0.558 . . . . 58.49 109.707 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 22' ' ' ILE . . . . . 0.486 ' O ' ' HG ' ' F' ' 26' ' ' LEU . 3.1 mt -55.68 -37.87 48.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.011 -0.541 . . . . 47.35 109.616 179.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' ILE . . . . . . . . . . . . . 57.2 mt -64.8 -45.92 93.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.059 -0.519 . . . . 62.1 109.668 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -64.08 -32.7 74.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 70.77 109.713 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' MET . . . . . 0.431 ' O ' ' HG2' ' F' ' 28' ' ' ARG . 32.5 mtp -76.19 -31.08 58.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.011 -0.541 . . . . 63.56 111.646 179.535 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' F' ' 22' ' ' ILE . 92.5 mt -80.84 -23.09 39.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.368 -0.378 . . . . 70.65 111.274 -179.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 27' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -83.9 -27.08 28.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 98.01 111.27 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 28' ' ' ARG . . . . . 0.431 ' HG2' ' O ' ' F' ' 25' ' ' MET . 34.8 ptt85 -73.41 2.8 6.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 89.32 111.289 -179.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 CA-C-N 116.201 -0.454 . . . . 67.47 112.528 -179.99 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 121.31 0.576 . . . . 71.92 109.651 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 4' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -62.41 -34.71 77.28 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 119.395 -0.922 . . . . 59.74 110.902 162.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.73 -35.84 81.89 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 121.002 -0.279 . . . . 52.93 111.615 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mttt -53.67 -43.19 68.66 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 120.089 -0.644 . . . . 74.62 111.128 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 7' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -71.01 -42.89 68.99 Favored 'General case' 0 C--N 1.348 0.503 0 C-N-CA 120.696 -0.402 . . . . 85.09 111.043 -175.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 8' ' ' ILE . . . . . . . . . . . . . 49.7 mt -51.84 -41.32 29.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.557 -0.457 . . . . 49.69 110.314 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 9' ' ' SER . . . . . . . . . . . . . 67.4 m -70.4 -40.72 73.74 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 120.678 0.275 . . . . 42.73 111.545 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 10' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -65.5 -31.06 71.93 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 118.284 -1.366 . . . . 49.07 112.258 172.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -72.11 -44.5 63.1 Favored 'General case' 0 C--O 1.238 0.463 0 O-C-N 121.932 -0.48 . . . . 42.96 111.767 -178.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 12' ' ' LEU . . . . . 0.425 ' CD1' HG23 ' H' ' 8' ' ' ILE . 68.9 mt -59.57 -39.21 83.31 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.993 -0.683 . . . . 37.23 111.346 176.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 13' ' ' PHE . . . . . 0.473 ' CZ ' HD11 ' G' ' 17' ' ' LEU . 14.3 t80 -58.98 -45.83 89.6 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 120.308 -0.557 . . . . 42.89 111.666 177.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 14' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.78 -45.13 95.55 Favored 'General case' 0 C--N 1.352 0.695 0 N-CA-C 111.945 0.35 . . . . 41.94 111.945 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 15' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.56 -35.51 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 119.09 -1.044 . . . . 34.33 110.561 177.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 16' ' ' CYS . . . . . . . . . . . . . 70.8 m -70.11 -36.52 74.9 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.48 -0.888 . . . . 40.46 111.324 178.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 17' ' ' LEU . . . . . 0.473 HD11 ' CZ ' ' G' ' 13' ' ' PHE . 51.6 mt -68.64 -41.99 78.64 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.944 -0.702 . . . . 36.85 111.555 175.192 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 18' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.72 -41.12 99.01 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.563 -0.744 . . . . 35.39 110.079 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 19' ' ' LEU . . . . . 0.413 ' O ' HG13 ' G' ' 23' ' ' ILE . 25.3 mt -61.64 -35.28 77.47 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.335 -0.546 . . . . 34.79 110.434 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 20' ' ' LEU . . . . . . . . . . . . . 6.4 mt -69.55 -41.73 75.53 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 113.62 0.97 . . . . 45.61 113.62 -178.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 21' ' ' CYS . . . . . . . . . . . . . 86.3 m -62.33 -43.7 98.22 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.708 -0.849 . . . . 49.03 108.708 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 22' ' ' ILE . . . . . . . . . . . . . 69.1 mt -57.3 -46.37 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 108.075 -1.083 . . . . 36.67 108.075 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 23' ' ' ILE . . . . . 0.454 HD12 HD22 ' H' ' 18' ' ' LEU . 54.2 mt -61.76 -52.04 65.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-O 120.967 0.413 . . . . 36.51 110.559 179.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 24' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -52.98 -45.25 67.73 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.981 -0.45 . . . . 40.93 111.381 178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 25' ' ' MET . . . . . . . . . . . . . 34.7 mtt -62.22 -45.49 93.13 Favored 'General case' 0 CA--C 1.512 -0.49 0 C-N-CA 120.587 -0.445 . . . . 80.86 111.5 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 26' ' ' LEU . . . . . . . . . . . . . 82.6 mt -55.3 -36.57 66.32 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 120.0 -0.68 . . . . 43.47 111.492 176.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -65.0 -41.85 95.01 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.792 0.33 . . . . 53.08 111.361 174.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 28' ' ' ARG . . . . . . . . . . . . . 57.8 mmm-85 -61.63 -0.11 0.39 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.776 1.028 . . . . 65.92 113.776 175.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.081 0 CA-C-O 122.9 1.278 . . . . 45.56 114.384 174.666 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 3' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 C--O 1.235 0.334 0 N-CA-C 112.157 0.429 . . . . 70.34 112.157 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 4' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -79.73 -34.15 40.27 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 113.725 1.009 . . . . 58.04 113.725 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 5' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' H' ' 5' ' ' LEU . 11.6 mt -63.38 -35.76 81.46 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 118.842 -1.143 . . . . 46.39 111.012 170.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 6' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -61.6 -42.01 98.26 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.534 0.207 . . . . 74.24 111.264 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 7' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -62.64 -44.37 96.45 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.679 0.276 . . . . 41.86 111.381 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 8' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' G' ' 12' ' ' LEU . 12.7 mt -61.05 -49.21 85.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 C-N-CA 120.056 -0.657 . . . . 39.61 110.006 -179.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 9' ' ' SER . . . . . . . . . . . . . 68.7 m -57.55 -43.27 84.29 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 122.894 0.477 . . . . 43.24 111.597 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 10' ' ' PHE . . . . . 0.433 ' O ' ' HB3' ' H' ' 13' ' ' PHE . 79.8 t80 -51.69 -59.11 4.66 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.831 0.348 . . . . 38.26 111.793 168.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 m -57.74 -49.57 76.13 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 116.605 -0.271 . . . . 34.36 111.468 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 12' ' ' LEU . . . . . 0.601 HD11 HG23 ' I' ' 8' ' ' ILE . 20.3 mt -48.6 -44.32 36.86 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 116.566 -0.288 . . . . 29.99 111.667 172.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 13' ' ' PHE . . . . . 0.433 ' HB3' ' O ' ' H' ' 10' ' ' PHE . 70.2 t80 -58.54 -47.54 83.87 Favored 'General case' 0 CA--C 1.514 -0.44 0 C-N-CA 120.632 -0.427 . . . . 38.46 111.222 176.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tp -60.0 -40.86 90.67 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 120.627 0.251 . . . . 41.3 111.339 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 mt -62.78 -51.52 70.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 CA-C-N 116.375 -0.375 . . . . 27.42 111.036 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' CYS . . . . . . . . . . . . . 80.5 m -55.57 -39.96 71.34 Favored 'General case' 0 C--N 1.35 0.59 0 O-C-N 122.298 -0.251 . . . . 44.56 111.571 177.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' LEU . . . . . . . . . . . . . 42.9 tp -65.26 -36.67 84.83 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 119.2 -1.0 . . . . 37.47 109.914 -177.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' LEU . . . . . 0.454 HD22 HD12 ' G' ' 23' ' ' ILE . 86.3 mt -81.84 -33.67 30.56 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.719 0.637 . . . . 31.76 112.719 -177.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' H' ' 19' ' ' LEU . 7.0 mt -58.78 -40.49 84.15 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 119.812 -0.755 . . . . 36.47 110.677 169.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.02 -39.38 89.53 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.348 -0.387 . . . . 35.2 111.594 175.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' CYS . . . . . . . . . . . . . 56.7 m -63.24 -50.87 68.48 Favored 'General case' 0 CA--C 1.513 -0.481 0 C-N-CA 119.215 -0.994 . . . . 38.28 110.696 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -45.31 -54.35 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.444 0 C-N-CA 123.298 0.639 . . . . 39.98 111.219 170.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' ILE . . . . . . . . . . . . . 70.4 mt -56.69 -45.32 82.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 O-C-N 122.274 -0.266 . . . . 43.1 111.327 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -67.91 -21.9 65.1 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 119.099 -1.041 . . . . 45.02 112.962 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' MET . . . . . . . . . . . . . 84.2 mtp -81.1 -37.77 28.39 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 118.468 0.576 . . . . 41.11 111.028 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.35 -46.25 67.46 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 119.661 -0.816 . . . . 44.19 111.481 173.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -45.5 -48.25 14.09 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.058 0.456 . . . . 50.28 111.593 169.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' ARG . . . . . . . . . . . . . 50.6 ttt-85 -63.68 -49.18 74.2 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.589 -0.278 . . . . 81.25 110.912 -176.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.569 0 N-CA-C 114.864 0.706 . . . . 62.75 114.864 -177.927 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 3' ' ' GLU . . . . . 0.534 ' HG2' ' H ' ' I' ' 4' ' ' GLN . 5.5 tt0 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.797 0.332 . . . . 76.43 111.207 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 4' ' ' GLN . . . . . 0.534 ' H ' ' HG2' ' I' ' 3' ' ' GLU . 61.6 mm-40 -62.48 -30.77 71.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 65.71 111.213 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 5' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -55.63 -46.85 77.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 59.5 110.893 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 6' ' ' LYS . . . . . . . . . . . . . 8.4 mttp -51.82 -48.78 63.74 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.075 0.398 . . . . 54.05 112.075 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 7' ' ' TRP . . . . . . . . . . . . . 37.5 t-105 -60.18 -30.07 69.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 50.24 110.615 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 8' ' ' ILE . . . . . 0.601 HG23 HD11 ' H' ' 12' ' ' LEU . 37.8 mt -79.37 -44.67 23.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.022 -0.733 . . . . 41.13 109.022 179.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 9' ' ' SER . . . . . . . . . . . . . 63.0 m -58.72 -35.99 73.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.879 -0.786 . . . . 61.22 108.879 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 10' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -72.17 -45.48 60.24 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.84 -0.618 . . . . 40.35 111.609 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 11' ' ' CYS . . . . . . . . . . . . . 10.0 m -63.76 -42.96 97.72 Favored 'General case' 0 C--O 1.241 0.643 0 O-C-N 122.416 -0.178 . . . . 40.2 111.447 -176.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 12' ' ' LEU . . . . . . . . . . . . . 61.9 mt -55.18 -60.7 3.02 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.859 0.361 . . . . 41.82 110.859 170.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 13' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -41.72 -44.74 3.29 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.17 1.388 . . . . 65.4 109.627 173.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 14' ' ' LEU . . . . . . . . . . . . . 60.5 tp -70.72 -35.14 72.56 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.296 -0.411 . . . . 43.4 112.097 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 15' ' ' ILE . . . . . 0.414 HG23 ' CD1' ' H' ' 19' ' ' LEU . 18.5 mt -67.8 -43.08 86.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 119.693 -0.803 . . . . 44.18 110.806 -176.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.94 -42.54 76.32 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 121.668 -0.645 . . . . 58.53 111.534 175.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mp -51.0 -53.74 30.7 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.283 -0.567 . . . . 52.69 111.148 169.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -67.52 -32.87 73.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.479 -0.889 . . . . 44.17 111.077 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 19' ' ' LEU . . . . . . . . . . . . . 33.4 mt -71.13 -42.52 69.09 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.815 -0.354 . . . . 41.65 111.774 175.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 20' ' ' LEU . . . . . . . . . . . . . 19.9 mt -52.41 -42.06 63.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.537 -0.865 . . . . 49.79 111.827 170.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 21' ' ' CYS . . . . . . . . . . . . . 59.0 m -63.49 -44.62 93.83 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 120.021 -0.672 . . . . 63.68 111.139 -178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 22' ' ' ILE . . . . . . . . . . . . . 87.9 mt -55.19 -37.34 43.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.134 0.492 . . . . 49.12 110.226 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 23' ' ' ILE . . . . . . . . . . . . . 18.4 mt -63.74 -53.48 44.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.131 0.491 . . . . 59.81 110.143 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 24' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -49.23 -42.36 40.31 Favored 'General case' 0 C--N 1.334 -0.083 0 N-CA-C 112.385 0.513 . . . . 75.54 112.385 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 25' ' ' MET . . . . . . . . . . . . . 15.3 mtp -81.3 -21.57 39.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.708 0.633 . . . . 75.84 112.708 -171.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 26' ' ' LEU . . . . . . . . . . . . . 65.1 mt -80.41 -25.23 39.15 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.707 -0.397 . . . . 76.04 111.487 169.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.47 -68.71 0.62 Allowed 'General case' 0 C--O 1.235 0.3 0 N-CA-C 110.29 -0.263 . . . . 92.09 110.29 172.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 28' ' ' ARG . . . . . . . . . . . . . 34.2 ttp180 -53.17 -27.0 19.13 Favored 'General case' 0 C--N 1.348 0.502 0 C-N-CA 122.673 0.389 . . . . 99.6 112.01 -177.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 O-C-N 121.878 -0.514 . . . . 75.58 112.279 177.809 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 4' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.823 0.344 . . . . 69.32 111.231 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -62.78 -33.13 74.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 70.58 111.181 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 6' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -51.62 -38.6 55.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 65.05 111.158 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 7' ' ' TRP . . . . . . . . . . . . . 68.8 m95 -75.05 -41.38 59.21 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.18 -0.463 . . . . 95.72 111.752 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 8' ' ' ILE . . . . . . . . . . . . . 7.3 mt -58.75 -41.84 83.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 C-N-CA 120.688 -0.405 . . . . 50.59 110.586 168.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 9' ' ' SER . . . . . . . . . . . . . 2.7 m -64.06 -40.2 95.75 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 122.103 -0.373 . . . . 56.94 111.525 176.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 10' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -76.31 -44.29 37.58 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.347 -0.941 . . . . 49.83 112.199 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 11' ' ' CYS . . . . . . . . . . . . . 92.2 m -55.68 -39.38 70.9 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.3 -0.56 . . . . 50.89 111.427 174.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 12' ' ' LEU . . . . . 0.428 HD11 HG23 ' F' ' 8' ' ' ILE . 7.1 mt -62.49 -49.78 74.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.991 -0.684 . . . . 43.14 111.185 178.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 13' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -49.82 -48.83 50.58 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.34 0.591 . . . . 50.92 110.56 171.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 tp -60.72 -31.74 71.03 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.34 0.496 . . . . 47.03 112.34 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 15' ' ' ILE . . . . . . . . . . . . . 27.9 mt -73.63 -43.66 54.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 C-N-CA 119.363 -0.935 . . . . 44.22 110.161 -175.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 16' ' ' CYS . . . . . . . . . . . . . 12.0 m -55.94 -46.11 78.6 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 120.936 0.398 . . . . 47.42 111.287 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 17' ' ' LEU . . . . . 0.636 HD13 HD22 ' E' ' 17' ' ' LEU . 67.7 tp -54.53 -53.89 48.48 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.308 -0.957 . . . . 55.98 110.132 172.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 18' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.25 -30.34 68.21 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 111.796 0.295 . . . . 46.35 111.796 -176.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 19' ' ' LEU . . . . . . . . . . . . . 36.6 mt -72.92 -50.76 21.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 119.41 -0.916 . . . . 43.13 110.584 175.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -52.77 -35.0 55.75 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.426 -0.583 . . . . 48.71 109.426 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 21' ' ' CYS . . . . . . . . . . . . . 71.9 m -66.03 -52.34 50.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.945 -0.57 . . . . 61.23 109.778 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 22' ' ' ILE . . . . . . . . . . . . . 93.7 mt -56.74 -41.66 75.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 109.295 -0.631 . . . . 54.28 109.295 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 23' ' ' ILE . . . . . 0.413 ' CD1' HD22 ' F' ' 18' ' ' LEU . 21.6 mt -61.58 -34.73 63.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 106.219 -1.771 . . . . 52.66 106.219 179.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 24' ' ' PHE . . . . . . . . . . . . . 92.4 t80 -64.12 -46.51 83.82 Favored 'General case' 0 C--N 1.343 0.326 0 C-N-CA 118.84 -1.144 . . . . 63.57 110.767 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 25' ' ' MET . . . . . . . . . . . . . 62.6 mtt -66.2 -32.84 74.51 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.947 -0.701 . . . . 78.09 111.633 -175.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 26' ' ' LEU . . . . . . . . . . . . . 32.8 mt -72.39 -33.89 67.51 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.786 -0.766 . . . . 60.69 111.022 176.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 27' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -82.2 11.78 4.98 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.82 0.848 . . . . 75.82 112.682 171.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 28' ' ' ARG . . . . . . . . . . . . . 72.9 ttp85 -106.11 -23.0 12.72 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 119.12 0.873 . . . . 89.03 112.941 -178.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.415 0 CA-C-N 118.053 0.388 . . . . 76.18 112.723 174.82 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_