data_6iit_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 6iit _Structure_validation_residue.Date_analyzed 2019-04-19 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 ' 1' ' ' MET . . . . . . . . . . . . . 56.3 ttm . . . . . 0 C--O 1.233 0.229 0 N-CA-C 110.154 -0.313 . . . . 88.34 110.154 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.18 117.56 6.94 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.108 -0.497 . . . . 61.79 110.96 -173.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -65.04 129.5 94.51 Favored Pre-proline 0 C--O 1.215 -0.726 0 N-CA-C 109.306 -0.627 . . . . 95.15 109.306 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -71.0 155.78 61.26 Favored 'Trans proline' 0 C--O 1.219 -0.431 0 C-N-CA 116.566 -1.823 . . . . 48.87 111.926 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 44.8 mtm180 -73.88 160.6 81.51 Favored Pre-proline 0 C--N 1.327 -0.413 0 N-CA-C 107.79 -1.189 . . . . 46.24 107.79 169.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -66.94 152.06 81.04 Favored 'Trans proline' 0 C--O 1.244 0.819 0 C-N-CA 116.377 -1.949 . . . . 44.78 112.918 -175.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -100.88 -8.1 22.87 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 120.048 -0.661 . . . . 77.11 111.217 173.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -128.67 147.6 50.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.81 0.338 . . . . 75.96 110.576 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -131.24 163.23 28.22 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.065 -0.654 . . . . 42.77 109.471 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -122.9 150.76 42.5 Favored 'General case' 0 C--O 1.241 0.651 0 O-C-N 123.571 0.544 . . . . 76.76 110.36 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.88 129.0 14.12 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-N 115.986 -0.552 . . . . 37.74 109.832 174.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.45 -16.63 56.45 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 115.511 0.964 . . . . 39.78 115.511 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.0 140.03 57.04 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 117.481 0.641 . . . . 44.52 110.246 178.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.2 mt -101.15 134.03 44.79 Favored 'General case' 0 C--O 1.242 0.673 0 N-CA-C 108.734 -0.839 . . . . 39.68 108.734 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.0 m -143.74 167.89 12.3 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 CA-C-N 115.891 -0.595 . . . . 31.33 112.225 -174.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -96.94 131.56 43.6 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 106.654 -1.609 . . . . 35.12 106.654 155.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -115.43 136.0 53.54 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.133 -0.691 . . . . 29.25 109.133 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -111.86 121.35 44.8 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.637 0.606 . . . . 41.08 112.637 -175.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 1.9 mtm -122.14 156.41 33.7 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.81 -0.441 . . . . 72.61 109.81 169.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -60.3 132.7 54.74 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.828 -0.624 . . . . 55.87 111.727 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.45 -3.88 86.25 Favored Glycine 0 C--O 1.225 -0.468 0 C-N-CA 120.222 -0.989 . . . . 42.71 113.803 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -124.08 147.97 55.97 Favored Pre-proline 0 C--O 1.221 -0.421 0 N-CA-C 111.778 0.288 . . . . 56.42 111.778 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -66.86 159.11 53.14 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 N-CA-C 109.995 -0.809 . . . . 34.1 109.995 172.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -54.95 129.02 36.12 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.588 -0.523 . . . . 42.63 109.588 173.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -122.53 131.25 24.41 Favored Pre-proline 0 C--O 1.241 0.64 0 CA-C-O 119.489 -0.291 . . . . 31.13 111.212 -160.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -59.98 131.29 38.62 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 121.072 1.181 . . . . 28.99 109.98 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -158.27 173.44 16.68 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.315 -0.554 . . . . 28.86 110.883 -166.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -138.3 144.84 40.62 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 123.478 0.486 . . . . 34.22 111.03 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.6 mm -78.73 114.68 19.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 N-CA-C 110.101 -0.333 . . . . 33.85 110.101 169.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -81.6 174.28 11.56 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.871 -0.418 . . . . 43.61 109.871 175.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' OE2' ' OG1' ' A' ' 97' ' ' THR . 15.6 pm0 -93.61 152.63 18.88 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 118.108 -1.437 . . . . 90.88 109.227 177.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.21 105.04 26.11 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 108.894 -0.78 . . . . 75.39 108.894 171.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -64.97 128.23 20.28 Favored 'Trans proline' 0 C--N 1.341 0.174 0 O-C-N 122.594 0.786 . . . . 70.81 112.466 -178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.32 151.61 19.27 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 106.709 -1.589 . . . . 93.68 106.709 167.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.92 32.58 32.21 Favored Glycine 0 N--CA 1.452 -0.255 0 N-CA-C 110.035 -1.226 . . . . 65.27 110.035 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -137.71 168.27 20.01 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.761 -0.719 . . . . 57.42 109.141 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.68 131.34 25.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 108.874 -0.787 . . . . 49.65 108.874 169.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -75.89 135.14 71.06 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.089 -0.505 . . . . 74.79 111.22 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -73.35 168.96 23.43 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 123.843 3.028 . . . . 64.57 110.35 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -67.31 155.96 68.25 Favored 'Trans proline' 0 C--O 1.235 0.333 0 O-C-N 123.189 1.099 . . . . 66.9 109.89 175.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.4 144.01 43.31 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 123.641 0.588 . . . . 54.91 111.469 -176.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 53.22 28.18 6.85 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 114.808 1.41 . . . . 72.7 114.808 176.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.4 mttt -117.86 144.73 45.15 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.018 -1.104 . . . . 57.06 108.018 172.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -119.24 142.68 32.75 Favored Pre-proline 0 CA--C 1.509 -0.601 0 O-C-N 123.746 0.654 . . . . 59.75 111.434 -172.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.3 119.5 6.03 Favored 'Trans proline' 0 CA--C 1.507 -0.875 0 N-CA-C 108.675 -1.317 . . . . 43.24 108.675 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.1 mm -106.37 139.24 28.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 O-C-N 124.244 0.965 . . . . 33.09 111.186 -175.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -112.77 121.3 44.3 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 108.059 -1.089 . . . . 35.29 108.059 171.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -92.26 124.91 36.68 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.284 0.564 . . . . 35.85 109.69 -178.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -73.48 158.81 34.21 Favored 'General case' 0 C--O 1.249 1.039 0 C-N-CA 118.389 -1.324 . . . . 30.16 108.137 179.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 85.2 -53.77 4.82 Favored Glycine 0 CA--C 1.523 0.535 0 CA-C-N 115.135 -0.939 . . . . 35.62 114.356 -177.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.5 p -99.06 -18.88 17.52 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.387 -0.525 . . . . 37.8 111.336 -179.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 28.0 m170 59.37 24.42 12.99 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.434 0.693 . . . . 39.39 112.565 -175.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -75.48 167.63 21.53 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.274 -0.57 . . . . 53.82 110.827 173.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 74.7 p -132.26 157.66 43.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 49.1 110.202 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -164.74 173.21 12.08 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.43 -0.952 . . . . 41.29 108.43 170.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -110.08 132.3 54.29 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.261 -1.385 . . . . 47.86 107.261 173.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 81.6 mt -141.34 148.92 40.47 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 124.135 0.897 . . . . 38.0 110.211 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -92.54 164.43 27.99 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.913 -0.875 . . . . 36.08 110.913 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.47 -16.82 31.13 Favored 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.94 3.76 . . . . 47.28 113.671 -174.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 pttm -69.04 -20.16 64.11 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 109.639 -0.504 . . . . 64.14 109.639 177.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -109.61 11.95 24.51 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.092 -0.643 . . . . 49.62 112.136 -179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.3 mt -118.74 138.1 52.89 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.008 0.433 . . . . 36.75 111.93 -174.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -134.1 114.48 12.75 Favored Pre-proline 0 C--O 1.238 0.49 0 CA-C-N 115.265 -0.879 . . . . 37.07 110.116 -175.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -49.74 128.01 20.27 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.426 2.751 . . . . 41.75 111.581 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -60.25 -46.24 90.49 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 114.909 1.448 . . . . 41.56 114.909 -165.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -70.0 -43.61 71.03 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.125 -1.03 . . . . 66.42 110.889 -174.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -63.63 -28.17 69.73 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.51 0.93 . . . . 78.69 113.51 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -112.56 3.44 16.74 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.697 0.999 . . . . 45.25 113.697 -175.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -54.72 -43.36 72.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.554 0.946 . . . . 74.64 113.554 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -68.53 -24.62 64.67 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 119.963 -0.695 . . . . 88.77 111.833 -175.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -90.58 -40.44 11.94 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 120.087 -0.645 . . . . 69.02 112.183 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -107.29 -8.11 16.49 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.014 1.116 . . . . 44.46 114.014 -170.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -91.89 27.01 10.64 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 114.918 0.727 . . . . 47.81 114.918 -171.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -87.79 151.23 23.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.356 -0.609 . . . . 63.84 109.356 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 53.9 p -63.26 150.49 43.01 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.248 0.547 . . . . 63.82 111.098 -174.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -151.83 141.59 21.9 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.728 -1.582 . . . . 52.41 106.728 -172.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -78.42 -12.14 59.99 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.123 1.527 . . . . 64.04 115.123 -177.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 33.0 mmm-85 -54.99 134.14 48.8 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.421 -0.799 . . . . 61.81 111.206 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -48.38 123.39 6.48 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.274 0.842 . . . . 89.51 113.274 -177.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 106' ' ' HOH . . . 88.75 -15.9 56.03 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 119.911 -1.138 . . . . 36.46 114.795 176.886 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -61.81 -53.63 53.28 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 118.509 1.155 . . . . 31.36 113.774 -176.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -65.63 -30.81 71.57 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 112.46 0.541 . . . . 41.67 112.46 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 52.0 mp0 -64.17 -44.01 93.35 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.664 -0.814 . . . . 76.58 108.988 171.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.36 -40.47 85.56 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 116.017 -0.538 . . . . 32.56 114.299 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.6 mt -61.16 -35.82 78.15 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.857 0.837 . . . . 32.44 110.744 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -68.18 -47.56 67.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.429 -0.805 . . . . 51.89 111.31 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -65.12 -39.34 92.96 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.351 0.871 . . . . 39.28 113.351 -178.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.0 tt -66.16 -23.08 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 117.951 -1.5 . . . . 39.78 109.704 -176.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -90.6 -41.02 11.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.316 0.858 . . . . 64.8 113.316 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -108.02 -23.21 12.1 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 114.997 1.481 . . . . 51.64 114.997 -167.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -145.57 53.96 2.14 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 120.169 -0.612 . . . . 41.48 111.99 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.71 -13.18 32.08 Favored 'Trans proline' 0 C--N 1.347 0.467 0 O-C-N 122.325 0.645 . . . . 43.13 112.486 -169.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -91.34 7.85 79.86 Favored Glycine 0 C--O 1.242 0.598 0 N-CA-C 116.141 1.216 . . . . 38.1 116.141 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.3 p -57.11 129.64 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-N 117.71 0.755 . . . . 38.98 109.727 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt 55.84 17.59 2.57 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.457 1.651 . . . . 54.51 115.457 -177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -81.13 129.31 34.51 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 120.845 -0.342 . . . . 49.05 111.13 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . 0.516 ' OG1' ' OE2' ' A' ' 31' ' ' GLU . 42.9 p -113.75 -4.54 13.37 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.471 0.915 . . . . 58.93 113.471 -177.26 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.43 97.62 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 114.075 0.39 . . . . 60.84 114.075 -175.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 28.5 p90 . . . . . 0 C--N 1.329 -0.288 0 C-N-CA 123.897 0.879 . . . . 54.25 108.815 175.834 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 113.052 0.76 . . . . 81.94 113.052 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 38.6 ttm -52.79 138.91 28.17 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.668 -1.151 . . . . 84.55 111.393 164.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.74 119.91 15.65 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.073 0.768 . . . . 56.51 113.073 -176.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ARG . . . . . . . . . . . . . 26.8 ttp85 -68.55 128.16 93.06 Favored Pre-proline 0 C--O 1.211 -0.95 0 O-C-N 121.402 -0.811 . . . . 85.65 110.37 -176.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -68.11 158.22 58.38 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 118.092 -0.805 . . . . 45.86 112.354 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ARG . . . . . . . . . . . . . 44.5 mtm180 -77.31 162.9 67.51 Favored Pre-proline 0 C--O 1.234 0.28 0 N-CA-C 108.803 -0.814 . . . . 45.54 108.803 169.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -61.4 149.66 88.55 Favored 'Trans proline' 0 C--O 1.237 0.459 0 N-CA-C 114.235 0.821 . . . . 46.03 114.235 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . 41.2 mtp85 -101.73 -8.91 21.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 66.68 109.973 172.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -139.05 141.66 38.22 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.488 0.661 . . . . 90.1 111.9 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -125.55 160.82 28.61 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.5 -0.926 . . . . 42.22 108.5 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -118.4 153.91 33.29 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 123.869 0.73 . . . . 71.22 110.317 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.83 129.83 23.91 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.935 -0.394 . . . . 39.07 109.935 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.8 -14.55 49.45 Favored Glycine 0 C--O 1.223 -0.591 0 O-C-N 123.668 0.605 . . . . 38.56 113.572 175.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.29 134.93 54.66 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 117.333 0.566 . . . . 50.95 111.936 177.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 54.1 mt -97.33 133.42 41.97 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.355 0.598 . . . . 40.17 110.436 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 35.3 m -142.61 168.65 13.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.809 -0.632 . . . . 32.48 111.398 -171.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -99.12 129.94 45.41 Favored 'General case' 0 C--O 1.253 1.248 0 N-CA-C 106.053 -1.832 . . . . 34.16 106.053 155.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.02 132.98 55.17 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.661 -0.496 . . . . 29.63 109.661 -178.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -106.96 123.8 48.71 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 112.918 0.71 . . . . 41.56 112.918 -176.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' MET . . . . . . . . . . . . . 1.9 mtp -125.89 145.35 50.29 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.409 -1.33 . . . . 73.39 107.409 173.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -54.8 129.19 36.23 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.719 0.637 . . . . 59.0 112.017 -177.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 91.25 -3.82 80.15 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 116.079 -0.51 . . . . 43.61 113.968 177.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -124.47 151.88 67.6 Favored Pre-proline 0 N--CA 1.45 -0.459 0 N-CA-C 109.675 -0.491 . . . . 56.34 109.675 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.75 158.59 56.45 Favored 'Trans proline' 0 C--O 1.238 0.524 0 O-C-N 122.638 0.81 . . . . 33.43 110.094 172.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -50.32 127.19 16.7 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 120.219 -0.592 . . . . 41.78 109.919 170.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' TRP . . . . . . . . . . . . . 6.7 t-105 -122.42 130.51 24.64 Favored Pre-proline 0 C--O 1.245 0.816 0 CA-C-O 119.001 -0.524 . . . . 33.34 110.403 -161.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -55.99 129.13 33.26 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.024 1.816 . . . . 27.09 110.569 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.89 175.35 14.05 Favored 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 123.953 0.783 . . . . 28.12 112.844 -171.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -141.69 140.29 33.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.165 -0.471 . . . . 35.38 109.91 -177.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ILE . . . . . . . . . . . . . 25.8 mm -73.84 116.59 16.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 108.538 -0.912 . . . . 36.42 108.538 173.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -83.45 178.12 8.17 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.955 0.883 . . . . 46.26 112.84 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLU . . . . . 0.583 ' OE1' ' OG1' ' B' ' 97' ' ' THR . 15.6 tt0 -70.36 134.85 48.29 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 113.995 -1.457 . . . . 90.81 113.412 170.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -105.22 96.0 10.59 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.238 -0.653 . . . . 79.15 109.238 164.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -61.22 130.25 31.55 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.018 1.812 . . . . 79.75 112.217 -174.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.35 140.56 54.28 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 106.62 -1.622 . . . . 116.34 106.62 168.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 95.81 18.44 32.26 Favored Glycine 0 C--N 1.328 0.114 0 N-CA-C 108.731 -1.748 . . . . 71.65 108.731 -174.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -119.65 167.3 12.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.335 0.588 . . . . 52.71 109.765 171.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 77.9 t -56.66 130.54 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 N-CA-C 108.186 -1.042 . . . . 56.62 108.186 166.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -71.48 137.84 83.6 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 116.283 -0.417 . . . . 72.89 110.103 -177.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.09 166.34 29.48 Favored 'Trans proline' 0 CA--C 1.519 -0.264 0 C-N-CA 124.399 3.4 . . . . 64.66 112.272 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -57.84 149.03 72.03 Favored 'Trans proline' 0 C--O 1.231 0.151 0 N-CA-C 108.851 -1.25 . . . . 65.76 108.851 169.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.54 148.24 42.8 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.378 -0.929 . . . . 50.34 111.59 -178.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 48.24 32.35 3.07 Favored 'General case' 0 C--O 1.224 -0.253 0 N-CA-C 114.442 1.275 . . . . 71.75 114.442 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -120.2 149.42 42.28 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.573 -0.899 . . . . 61.14 108.573 170.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -121.21 142.71 35.63 Favored Pre-proline 0 CA--C 1.505 -0.753 0 CA-C-N 115.688 -0.687 . . . . 60.37 109.88 -172.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -71.92 124.4 10.1 Favored 'Trans proline' 0 CA--C 1.511 -0.672 0 N-CA-C 108.436 -1.409 . . . . 45.11 108.436 174.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 28.7 mm -112.96 137.19 46.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 O-C-N 124.194 0.934 . . . . 34.31 111.846 -175.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -111.54 118.84 36.83 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 106.682 -1.599 . . . . 34.38 106.682 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -90.05 120.54 31.34 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 121.665 0.745 . . . . 34.72 109.938 179.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -68.05 151.65 46.73 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 119.131 -1.028 . . . . 38.37 110.089 176.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.49 -47.85 2.59 Favored Glycine 0 C--O 1.237 0.317 0 CA-C-N 116.211 -0.449 . . . . 37.5 113.613 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 69.4 p -105.23 -21.55 13.23 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.943 0.401 . . . . 39.46 110.848 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' HIS . . . . . . . . . . . . . 18.4 m170 61.29 23.25 13.5 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.261 -0.881 . . . . 40.51 111.665 -176.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -71.02 166.19 21.86 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.212 -0.449 . . . . 54.26 111.647 170.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 64.9 p -133.46 161.36 34.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.359 -0.382 . . . . 50.39 110.908 177.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -170.94 175.0 4.57 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.175 -0.676 . . . . 44.1 109.175 172.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -114.05 130.68 56.54 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.06 -1.089 . . . . 44.97 108.06 175.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 92.3 mt -140.8 149.35 41.94 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.521 -0.918 . . . . 40.68 108.521 -176.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.08 164.66 26.2 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.007 -0.837 . . . . 37.5 111.007 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -52.4 -25.15 23.67 Favored 'Trans proline' 0 CA--C 1.53 0.324 1 C-N-CA 125.799 4.333 . . . . 45.49 114.398 -175.352 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -65.46 -21.87 66.69 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.936 -0.706 . . . . 53.63 110.735 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -106.64 12.81 28.91 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 113.288 0.847 . . . . 68.41 113.288 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 65.9 mt -118.45 141.32 48.67 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-O 121.176 0.512 . . . . 33.23 111.672 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -134.91 117.4 12.79 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.413 -0.812 . . . . 38.79 109.801 -176.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -49.2 127.15 16.93 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 121.702 1.601 . . . . 42.22 112.923 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -55.72 -56.49 19.9 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 112.805 0.668 . . . . 44.88 112.805 -168.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -58.67 -43.99 90.06 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.066 -0.515 . . . . 78.13 111.642 -173.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -67.61 -26.17 66.12 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.862 0.69 . . . . 89.59 112.862 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -120.08 6.68 10.79 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.215 0.82 . . . . 50.37 113.215 -172.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.12 -31.66 65.55 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 113.355 0.872 . . . . 64.61 113.355 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.56 -44.28 71.2 Favored 'General case' 0 CA--C 1.506 -0.712 0 C-N-CA 120.15 -0.62 . . . . 90.45 110.44 -175.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -75.29 -48.94 20.9 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.159 -0.473 . . . . 72.39 111.594 -178.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -96.81 -9.13 29.38 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.329 1.603 . . . . 43.64 115.329 -168.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -90.92 27.2 9.28 Favored Glycine 0 CA--C 1.516 0.152 0 N-CA-C 115.428 0.931 . . . . 48.45 115.428 -173.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -88.45 154.75 20.12 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.029 0.442 . . . . 74.28 109.944 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 13.1 t -62.61 146.41 52.08 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.354 0.872 . . . . 60.55 113.354 -177.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -147.63 144.43 28.39 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.055 -1.461 . . . . 52.69 107.055 -174.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LYS . . . . . 0.545 ' NZ ' ' O ' ' B' ' 101' ' ' HOH . 21.2 pttp -85.97 -8.42 57.99 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.629 0.974 . . . . 68.31 113.629 -175.135 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 53.8 mmm-85 -54.07 134.42 43.84 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.29 0.567 . . . . 48.4 110.8 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' LYS . . . . . . . . . . . . . 8.1 mmtt -50.05 129.34 20.61 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.723 1.009 . . . . 85.08 113.723 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 83.0 -9.78 59.54 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 115.549 -0.751 . . . . 33.4 114.735 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -64.41 -56.24 15.6 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 114.679 1.363 . . . . 35.69 114.679 -173.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -67.19 -29.04 68.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.229 -0.442 . . . . 38.0 111.879 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 59.5 mp0 -68.54 -34.27 75.57 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 118.944 -1.103 . . . . 62.82 108.182 173.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.94 -44.06 96.56 Favored Glycine 0 CA--C 1.522 0.525 0 CA-C-N 115.819 -0.628 . . . . 32.13 113.419 175.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 71.7 mt -55.49 -39.36 70.35 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.836 0.827 . . . . 34.52 111.383 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' TRP . . . . . . . . . . . . . 66.7 t90 -65.89 -49.37 68.31 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.431 -0.804 . . . . 49.86 110.747 178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.16 -38.98 93.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.996 0.739 . . . . 38.34 112.996 -176.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 14.9 tt -67.36 -25.14 32.8 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.25 0 C-N-CA 119.317 -0.953 . . . . 40.79 110.357 -174.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -85.89 -50.01 7.43 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.339 0.496 . . . . 63.68 112.339 174.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -96.99 -27.0 14.82 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 115.249 1.574 . . . . 53.69 115.249 -165.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -144.1 58.24 5.75 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 120.49 -0.484 . . . . 45.44 111.783 -179.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.24 -16.91 44.77 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 121.46 1.44 . . . . 53.04 113.459 -171.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . -90.81 13.37 66.08 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 116.972 1.549 . . . . 37.46 116.972 175.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 10.1 p -61.06 127.7 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 119.176 1.488 . . . . 39.59 110.21 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 5.7 mtpt 61.56 17.2 8.33 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.946 1.091 . . . . 55.18 113.946 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -85.57 121.75 28.71 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 121.183 -0.207 . . . . 48.95 111.326 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' THR . . . . . 0.583 ' OG1' ' OE1' ' B' ' 31' ' ' GLU . 29.1 p -105.68 3.3 28.91 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.024 0.75 . . . . 63.21 113.024 -175.152 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . -67.0 -40.24 93.33 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.377 -0.44 . . . . 61.62 114.163 -175.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 p90 . . . . . 0 C--N 1.328 -0.348 0 N-CA-C 108.213 -1.032 . . . . 51.9 108.213 -179.221 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.772 0 O4'-C1'-C2' 104.735 -1.241 . . . . 115.93 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.532 1.399 0 P-O3'-C3' 121.903 1.836 . . . . 77.95 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ' DT' . . . . . 0.535 ' N3 ' ' N1 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.553 3.542 0 N19-C1'-C2' 116.918 1.699 . . . . 126.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.394 -2.895 0 C3'-C2'-C1' 100.237 -1.759 . . . . 57.93 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ' DT' . . . . . 0.4 ' N3 ' ' N1 ' ' D' ' 6' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.404 -2.236 0 C3'-C2'-C1' 100.463 -1.598 . . . . 60.58 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ' DA' . . . . . 0.444 ' N1 ' ' N3 ' ' D' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.42 -1.277 0 P-O3'-C3' 121.975 1.896 . . . . 76.52 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ' DT' . . . . . 0.449 ' N3 ' ' N1 ' ' D' ' 4' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.534 1.609 0 P-O3'-C3' 121.375 1.396 . . . . 75.29 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.077 0 P-O3'-C3' 121.488 1.49 . . . . 114.31 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.546 2.814 0 OP1-P-OP2 123.477 2.585 . . . . 54.59 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ' DA' . . . . . 0.404 ' N1 ' ' N3 ' ' D' ' 1' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.379 -3.987 0 P-O5'-C5' 118.735 -1.353 . . . . 64.78 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' ' DT' . . . . . 0.404 ' N3 ' ' N1 ' ' C' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.405 -2.157 0 O5'-C5'-C4' 112.69 1.779 . . . . 129.74 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.074 0 C4'-C3'-C2' 104.983 1.783 . . . . 56.92 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.539 2.082 0 P-O5'-C5' 118.584 -1.448 . . . . 56.66 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' ' DA' . . . . . 0.449 ' N1 ' ' N3 ' ' C' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.379 -3.817 0 P-O3'-C3' 122.952 2.71 . . . . 65.43 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ' DT' . . . . . 0.444 ' N3 ' ' N1 ' ' C' ' 6' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 1.976 1 O4'-C1'-N19 111.003 4.004 . . . . 84.67 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' ' DA' . . . . . 0.4 ' N1 ' ' N3 ' ' C' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.4 -2.494 0 O4'-C1'-C2' 108.153 1.866 . . . . 88.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.416 -1.121 0 O4'-C1'-N19 109.174 1.717 . . . . 53.04 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.535 ' N1 ' ' N3 ' ' C' ' 3' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.404 -2.095 0 O4'-C1'-N19 106.681 -1.399 . . . . 57.55 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.903 0 P-O5'-C5' 118.194 -1.691 . . . . 60.62 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.538 1.982 0 OP1-P-OP2 122.141 1.694 . . . . 86.39 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.486 0 CA-C-O 120.673 0.041 . . . . 78.13 113.072 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.66 -173.42 14.87 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 115.63 1.012 . . . . 72.76 115.63 -173.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 35' ' ' VAL . . . . . . . . . . . . . 53.5 t -67.94 123.5 21.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 N-CA-C 113.205 0.817 . . . . 78.41 113.205 -176.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' MLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.469 0 N-CA-C 108.571 -0.9 . . . . 86.83 108.571 178.574 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' LYS . . . . . . . . . . . . . 7.2 mttp . . . . . 0 C--O 1.234 0.279 0 CA-C-N 115.538 -0.756 . . . . 99.66 111.019 -179.088 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 113.74 0.256 . . . . 72.42 113.74 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 34' ' ' GLY . . . . . . . . . . . . . . . -93.26 -176.67 40.52 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 116.084 1.193 . . . . 70.25 116.084 -175.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 35' ' ' VAL . . . . . . . . . . . . . 48.9 t -75.09 134.83 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 O-C-N 122.391 -0.476 . . . . 81.34 110.232 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 36' ' ' MLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 C-N-CA 119.841 -0.744 . . . . 81.0 109.908 177.888 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 114.9 -1.045 . . . . 96.05 112.016 178.941 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . 0.424 ' O ' ' N ' ' A' ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . 0.545 ' O ' ' NZ ' ' B' ' 77' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.3 ttm . . . . . 0 C--O 1.233 0.229 0 N-CA-C 110.154 -0.313 . . . . 88.34 110.154 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.18 117.56 6.94 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.108 -0.497 . . . . 61.79 110.96 -173.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -65.04 129.5 94.51 Favored Pre-proline 0 C--O 1.215 -0.726 0 N-CA-C 109.306 -0.627 . . . . 95.15 109.306 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -71.0 155.78 61.26 Favored 'Trans proline' 0 C--O 1.219 -0.431 0 C-N-CA 116.566 -1.823 . . . . 48.87 111.926 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 44.8 mtm180 -73.88 160.6 81.51 Favored Pre-proline 0 C--N 1.327 -0.413 0 N-CA-C 107.79 -1.189 . . . . 46.24 107.79 169.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -66.94 152.06 81.04 Favored 'Trans proline' 0 C--O 1.244 0.819 0 C-N-CA 116.377 -1.949 . . . . 44.78 112.918 -175.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -100.88 -8.1 22.87 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 120.048 -0.661 . . . . 77.11 111.217 173.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -128.67 147.6 50.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.81 0.338 . . . . 75.96 110.576 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -131.24 163.23 28.22 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.065 -0.654 . . . . 42.77 109.471 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -122.9 150.76 42.5 Favored 'General case' 0 C--O 1.241 0.651 0 O-C-N 123.571 0.544 . . . . 76.76 110.36 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.88 129.0 14.12 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-N 115.986 -0.552 . . . . 37.74 109.832 174.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.45 -16.63 56.45 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 115.511 0.964 . . . . 39.78 115.511 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.0 140.03 57.04 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 117.481 0.641 . . . . 44.52 110.246 178.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.2 mt -101.15 134.03 44.79 Favored 'General case' 0 C--O 1.242 0.673 0 N-CA-C 108.734 -0.839 . . . . 39.68 108.734 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.0 m -143.74 167.89 12.3 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 CA-C-N 115.891 -0.595 . . . . 31.33 112.225 -174.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -96.94 131.56 43.6 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 106.654 -1.609 . . . . 35.12 106.654 155.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -115.43 136.0 53.54 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.133 -0.691 . . . . 29.25 109.133 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -111.86 121.35 44.8 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.637 0.606 . . . . 41.08 112.637 -175.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 1.9 mtm -122.14 156.41 33.7 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.81 -0.441 . . . . 72.61 109.81 169.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -60.3 132.7 54.74 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.828 -0.624 . . . . 55.87 111.727 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.45 -3.88 86.25 Favored Glycine 0 C--O 1.225 -0.468 0 C-N-CA 120.222 -0.989 . . . . 42.71 113.803 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -124.08 147.97 55.97 Favored Pre-proline 0 C--O 1.221 -0.421 0 N-CA-C 111.778 0.288 . . . . 56.42 111.778 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PRO . . . . . 0.433 ' HB3' ' OP1' ' D' ' 1' ' ' ' DT' . 72.2 Cg_endo -66.86 159.11 53.14 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 N-CA-C 109.995 -0.809 . . . . 34.1 109.995 172.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -54.95 129.02 36.12 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.588 -0.523 . . . . 42.63 109.588 173.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -122.53 131.25 24.41 Favored Pre-proline 0 C--O 1.241 0.64 0 CA-C-O 119.489 -0.291 . . . . 31.13 111.212 -160.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -59.98 131.29 38.62 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 121.072 1.181 . . . . 28.99 109.98 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -158.27 173.44 16.68 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.315 -0.554 . . . . 28.86 110.883 -166.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -138.3 144.84 40.62 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 123.478 0.486 . . . . 34.22 111.03 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.6 mm -78.73 114.68 19.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 N-CA-C 110.101 -0.333 . . . . 33.85 110.101 169.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -81.6 174.28 11.56 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.871 -0.418 . . . . 43.61 109.871 175.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . 0.435 ' OE2' ' OG1' ' A' ' 97' ' ' THR . 15.6 pm0 -93.61 152.63 18.88 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 118.108 -1.437 . . . . 90.88 109.227 177.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.21 105.04 26.11 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 108.894 -0.78 . . . . 75.39 108.894 171.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -64.97 128.23 20.28 Favored 'Trans proline' 0 C--N 1.341 0.174 0 O-C-N 122.594 0.786 . . . . 70.81 112.466 -178.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.32 151.61 19.27 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 106.709 -1.589 . . . . 93.68 106.709 167.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.92 32.58 32.21 Favored Glycine 0 N--CA 1.452 -0.255 0 N-CA-C 110.035 -1.226 . . . . 65.27 110.035 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -137.71 168.27 20.01 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.761 -0.719 . . . . 57.42 109.141 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.68 131.34 25.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 108.874 -0.787 . . . . 49.65 108.874 169.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -75.89 135.14 71.06 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.089 -0.505 . . . . 74.79 111.22 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -73.35 168.96 23.43 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 123.843 3.028 . . . . 64.57 110.35 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -67.31 155.96 68.25 Favored 'Trans proline' 0 C--O 1.235 0.333 0 O-C-N 123.189 1.099 . . . . 66.9 109.89 175.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.4 144.01 43.31 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 123.641 0.588 . . . . 54.91 111.469 -176.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 53.22 28.18 6.85 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 114.808 1.41 . . . . 72.7 114.808 176.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.4 mttt -117.86 144.73 45.15 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.018 -1.104 . . . . 57.06 108.018 172.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 56' ' ' PHE . 66.9 m-85 -119.24 142.68 32.75 Favored Pre-proline 0 CA--C 1.509 -0.601 0 O-C-N 123.746 0.654 . . . . 59.75 111.434 -172.912 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.3 119.5 6.03 Favored 'Trans proline' 0 CA--C 1.507 -0.875 0 N-CA-C 108.675 -1.317 . . . . 43.24 108.675 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.1 mm -106.37 139.24 28.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 O-C-N 124.244 0.965 . . . . 33.09 111.186 -175.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -112.77 121.3 44.3 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 108.059 -1.089 . . . . 35.29 108.059 171.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -92.26 124.91 36.68 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.284 0.564 . . . . 35.85 109.69 -178.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -73.48 158.81 34.21 Favored 'General case' 0 C--O 1.249 1.039 0 C-N-CA 118.389 -1.324 . . . . 30.16 108.137 179.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 85.2 -53.77 4.82 Favored Glycine 0 CA--C 1.523 0.535 0 CA-C-N 115.135 -0.939 . . . . 35.62 114.356 -177.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.5 p -99.06 -18.88 17.52 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.387 -0.525 . . . . 37.8 111.336 -179.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 28.0 m170 59.37 24.42 12.99 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.434 0.693 . . . . 39.39 112.565 -175.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -75.48 167.63 21.53 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.274 -0.57 . . . . 53.82 110.827 173.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 74.7 p -132.26 157.66 43.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 49.1 110.202 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -164.74 173.21 12.08 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.43 -0.952 . . . . 41.29 108.43 170.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . 0.435 ' O ' HD23 ' A' ' 57' ' ' LEU . 25.7 m-85 -110.08 132.3 54.29 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.261 -1.385 . . . . 47.86 107.261 173.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . 0.435 HD23 ' O ' ' A' ' 56' ' ' PHE . 81.6 mt -141.34 148.92 40.47 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 124.135 0.897 . . . . 38.0 110.211 -177.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -92.54 164.43 27.99 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.913 -0.875 . . . . 36.08 110.913 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.47 -16.82 31.13 Favored 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.94 3.76 . . . . 47.28 113.671 -174.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 pttm -69.04 -20.16 64.11 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 109.639 -0.504 . . . . 64.14 109.639 177.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -109.61 11.95 24.51 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.092 -0.643 . . . . 49.62 112.136 -179.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.3 mt -118.74 138.1 52.89 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.008 0.433 . . . . 36.75 111.93 -174.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -134.1 114.48 12.75 Favored Pre-proline 0 C--O 1.238 0.49 0 CA-C-N 115.265 -0.879 . . . . 37.07 110.116 -175.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -49.74 128.01 20.27 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.426 2.751 . . . . 41.75 111.581 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -60.25 -46.24 90.49 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 114.909 1.448 . . . . 41.56 114.909 -165.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -70.0 -43.61 71.03 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.125 -1.03 . . . . 66.42 110.889 -174.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -63.63 -28.17 69.73 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.51 0.93 . . . . 78.69 113.51 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -112.56 3.44 16.74 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.697 0.999 . . . . 45.25 113.697 -175.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -54.72 -43.36 72.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.554 0.946 . . . . 74.64 113.554 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -68.53 -24.62 64.67 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 119.963 -0.695 . . . . 88.77 111.833 -175.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -90.58 -40.44 11.94 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 120.087 -0.645 . . . . 69.02 112.183 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -107.29 -8.11 16.49 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.014 1.116 . . . . 44.46 114.014 -170.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -91.89 27.01 10.64 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 114.918 0.727 . . . . 47.81 114.918 -171.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -87.79 151.23 23.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.356 -0.609 . . . . 63.84 109.356 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 53.9 p -63.26 150.49 43.01 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.248 0.547 . . . . 63.82 111.098 -174.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -151.83 141.59 21.9 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.728 -1.582 . . . . 52.41 106.728 -172.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -78.42 -12.14 59.99 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.123 1.527 . . . . 64.04 115.123 -177.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 33.0 mmm-85 -54.99 134.14 48.8 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.421 -0.799 . . . . 61.81 111.206 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -48.38 123.39 6.48 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.274 0.842 . . . . 89.51 113.274 -177.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.75 -15.9 56.03 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 119.911 -1.138 . . . . 36.46 114.795 176.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -61.81 -53.63 53.28 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 118.509 1.155 . . . . 31.36 113.774 -176.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -65.63 -30.81 71.57 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 112.46 0.541 . . . . 41.67 112.46 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 52.0 mp0 -64.17 -44.01 93.35 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.664 -0.814 . . . . 76.58 108.988 171.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.36 -40.47 85.56 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 116.017 -0.538 . . . . 32.56 114.299 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.6 mt -61.16 -35.82 78.15 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.857 0.837 . . . . 32.44 110.744 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -68.18 -47.56 67.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.429 -0.805 . . . . 51.89 111.31 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -65.12 -39.34 92.96 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.351 0.871 . . . . 39.28 113.351 -178.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.0 tt -66.16 -23.08 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 117.951 -1.5 . . . . 39.78 109.704 -176.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -90.6 -41.02 11.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.316 0.858 . . . . 64.8 113.316 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -108.02 -23.21 12.1 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 114.997 1.481 . . . . 51.64 114.997 -167.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -145.57 53.96 2.14 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 120.169 -0.612 . . . . 41.48 111.99 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.71 -13.18 32.08 Favored 'Trans proline' 0 C--N 1.347 0.467 0 O-C-N 122.325 0.645 . . . . 43.13 112.486 -169.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -91.34 7.85 79.86 Favored Glycine 0 C--O 1.242 0.598 0 N-CA-C 116.141 1.216 . . . . 38.1 116.141 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.3 p -57.11 129.64 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-N 117.71 0.755 . . . . 38.98 109.727 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt 55.84 17.59 2.57 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.457 1.651 . . . . 54.51 115.457 -177.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -81.13 129.31 34.51 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 120.845 -0.342 . . . . 49.05 111.13 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . 0.435 ' OG1' ' OE2' ' A' ' 31' ' ' GLU . 42.9 p -113.75 -4.54 13.37 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.471 0.915 . . . . 58.93 113.471 -177.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.43 97.62 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 114.075 0.39 . . . . 60.84 114.075 -175.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 28.5 p90 . . . . . 0 C--N 1.329 -0.288 0 C-N-CA 123.897 0.879 . . . . 54.25 108.815 175.834 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 113.052 0.76 . . . . 81.94 113.052 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 38.6 ttm -52.79 138.91 28.17 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.668 -1.151 . . . . 84.55 111.393 164.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.74 119.91 15.65 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.073 0.768 . . . . 56.51 113.073 -176.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ARG . . . . . . . . . . . . . 26.8 ttp85 -68.55 128.16 93.06 Favored Pre-proline 0 C--O 1.211 -0.95 0 O-C-N 121.402 -0.811 . . . . 85.65 110.37 -176.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -68.11 158.22 58.38 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 118.092 -0.805 . . . . 45.86 112.354 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ARG . . . . . . . . . . . . . 44.5 mtm180 -77.31 162.9 67.51 Favored Pre-proline 0 C--O 1.234 0.28 0 N-CA-C 108.803 -0.814 . . . . 45.54 108.803 169.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -61.4 149.66 88.55 Favored 'Trans proline' 0 C--O 1.237 0.459 0 N-CA-C 114.235 0.821 . . . . 46.03 114.235 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . 41.2 mtp85 -101.73 -8.91 21.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 66.68 109.973 172.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -139.05 141.66 38.22 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.488 0.661 . . . . 90.1 111.9 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -125.55 160.82 28.61 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.5 -0.926 . . . . 42.22 108.5 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -118.4 153.91 33.29 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 123.869 0.73 . . . . 71.22 110.317 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.83 129.83 23.91 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.935 -0.394 . . . . 39.07 109.935 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.8 -14.55 49.45 Favored Glycine 0 C--O 1.223 -0.591 0 O-C-N 123.668 0.605 . . . . 38.56 113.572 175.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.29 134.93 54.66 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 117.333 0.566 . . . . 50.95 111.936 177.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 54.1 mt -97.33 133.42 41.97 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.355 0.598 . . . . 40.17 110.436 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 35.3 m -142.61 168.65 13.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.809 -0.632 . . . . 32.48 111.398 -171.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -99.12 129.94 45.41 Favored 'General case' 0 C--O 1.253 1.248 0 N-CA-C 106.053 -1.832 . . . . 34.16 106.053 155.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.02 132.98 55.17 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.661 -0.496 . . . . 29.63 109.661 -178.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -106.96 123.8 48.71 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 112.918 0.71 . . . . 41.56 112.918 -176.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' MET . . . . . . . . . . . . . 1.9 mtp -125.89 145.35 50.29 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.409 -1.33 . . . . 73.39 107.409 173.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -54.8 129.19 36.23 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.719 0.637 . . . . 59.0 112.017 -177.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 91.25 -3.82 80.15 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 116.079 -0.51 . . . . 43.61 113.968 177.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -124.47 151.88 67.6 Favored Pre-proline 0 N--CA 1.45 -0.459 0 N-CA-C 109.675 -0.491 . . . . 56.34 109.675 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.75 158.59 56.45 Favored 'Trans proline' 0 C--O 1.238 0.524 0 O-C-N 122.638 0.81 . . . . 33.43 110.094 172.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -50.32 127.19 16.7 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 120.219 -0.592 . . . . 41.78 109.919 170.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' TRP . . . . . . . . . . . . . 6.7 t-105 -122.42 130.51 24.64 Favored Pre-proline 0 C--O 1.245 0.816 0 CA-C-O 119.001 -0.524 . . . . 33.34 110.403 -161.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -55.99 129.13 33.26 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.024 1.816 . . . . 27.09 110.569 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.89 175.35 14.05 Favored 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 123.953 0.783 . . . . 28.12 112.844 -171.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -141.69 140.29 33.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.165 -0.471 . . . . 35.38 109.91 -177.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ILE . . . . . . . . . . . . . 25.8 mm -73.84 116.59 16.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 108.538 -0.912 . . . . 36.42 108.538 173.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -83.45 178.12 8.17 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.955 0.883 . . . . 46.26 112.84 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLU . . . . . 0.564 ' OE1' ' OG1' ' B' ' 97' ' ' THR . 15.6 tt0 -70.36 134.85 48.29 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 113.995 -1.457 . . . . 90.81 113.412 170.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -105.22 96.0 10.59 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.238 -0.653 . . . . 79.15 109.238 164.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -61.22 130.25 31.55 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.018 1.812 . . . . 79.75 112.217 -174.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.35 140.56 54.28 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 106.62 -1.622 . . . . 116.34 106.62 168.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 95.81 18.44 32.26 Favored Glycine 0 C--N 1.328 0.114 0 N-CA-C 108.731 -1.748 . . . . 71.65 108.731 -174.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -119.65 167.3 12.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.335 0.588 . . . . 52.71 109.765 171.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 77.9 t -56.66 130.54 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 N-CA-C 108.186 -1.042 . . . . 56.62 108.186 166.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' B' ' 38' ' ' LYS . 1.5 mptt -71.48 137.84 83.6 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 116.283 -0.417 . . . . 72.89 110.103 -177.451 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.09 166.34 29.48 Favored 'Trans proline' 0 CA--C 1.519 -0.264 0 C-N-CA 124.399 3.4 . . . . 64.66 112.272 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -57.84 149.03 72.03 Favored 'Trans proline' 0 C--O 1.231 0.151 0 N-CA-C 108.851 -1.25 . . . . 65.76 108.851 169.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.54 148.24 42.8 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.378 -0.929 . . . . 50.34 111.59 -178.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 48.24 32.35 3.07 Favored 'General case' 0 C--O 1.224 -0.253 0 N-CA-C 114.442 1.275 . . . . 71.75 114.442 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -120.2 149.42 42.28 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.573 -0.899 . . . . 61.14 108.573 170.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' TYR . . . . . 0.421 ' O ' ' HA ' ' B' ' 56' ' ' PHE . 71.3 m-85 -121.21 142.71 35.63 Favored Pre-proline 0 CA--C 1.505 -0.753 0 CA-C-N 115.688 -0.687 . . . . 60.37 109.88 -172.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -71.92 124.4 10.1 Favored 'Trans proline' 0 CA--C 1.511 -0.672 0 N-CA-C 108.436 -1.409 . . . . 45.11 108.436 174.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 28.7 mm -112.96 137.19 46.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 O-C-N 124.194 0.934 . . . . 34.31 111.846 -175.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -111.54 118.84 36.83 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 106.682 -1.599 . . . . 34.38 106.682 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -90.05 120.54 31.34 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 121.665 0.745 . . . . 34.72 109.938 179.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -68.05 151.65 46.73 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 119.131 -1.028 . . . . 38.37 110.089 176.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.49 -47.85 2.59 Favored Glycine 0 C--O 1.237 0.317 0 CA-C-N 116.211 -0.449 . . . . 37.5 113.613 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 69.4 p -105.23 -21.55 13.23 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.943 0.401 . . . . 39.46 110.848 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' HIS . . . . . . . . . . . . . 18.4 m170 61.29 23.25 13.5 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.261 -0.881 . . . . 40.51 111.665 -176.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -71.02 166.19 21.86 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.212 -0.449 . . . . 54.26 111.647 170.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 64.9 p -133.46 161.36 34.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.359 -0.382 . . . . 50.39 110.908 177.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -170.94 175.0 4.57 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.175 -0.676 . . . . 44.1 109.175 172.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' PHE . . . . . 0.421 ' HA ' ' O ' ' B' ' 44' ' ' TYR . 22.5 m-85 -114.05 130.68 56.54 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.06 -1.089 . . . . 44.97 108.06 175.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 92.3 mt -140.8 149.35 41.94 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.521 -0.918 . . . . 40.68 108.521 -176.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.08 164.66 26.2 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.007 -0.837 . . . . 37.5 111.007 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -52.4 -25.15 23.67 Favored 'Trans proline' 0 CA--C 1.53 0.324 1 C-N-CA 125.799 4.333 . . . . 45.49 114.398 -175.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -65.46 -21.87 66.69 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.936 -0.706 . . . . 53.63 110.735 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -106.64 12.81 28.91 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 113.288 0.847 . . . . 68.41 113.288 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 65.9 mt -118.45 141.32 48.67 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-O 121.176 0.512 . . . . 33.23 111.672 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -134.91 117.4 12.79 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.413 -0.812 . . . . 38.79 109.801 -176.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -49.2 127.15 16.93 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 121.702 1.601 . . . . 42.22 112.923 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -55.72 -56.49 19.9 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 112.805 0.668 . . . . 44.88 112.805 -168.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -58.67 -43.99 90.06 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.066 -0.515 . . . . 78.13 111.642 -173.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -67.61 -26.17 66.12 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.862 0.69 . . . . 89.59 112.862 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -120.08 6.68 10.79 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.215 0.82 . . . . 50.37 113.215 -172.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.12 -31.66 65.55 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 113.355 0.872 . . . . 64.61 113.355 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.56 -44.28 71.2 Favored 'General case' 0 CA--C 1.506 -0.712 0 C-N-CA 120.15 -0.62 . . . . 90.45 110.44 -175.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -75.29 -48.94 20.9 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.159 -0.473 . . . . 72.39 111.594 -178.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -96.81 -9.13 29.38 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.329 1.603 . . . . 43.64 115.329 -168.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -90.92 27.2 9.28 Favored Glycine 0 CA--C 1.516 0.152 0 N-CA-C 115.428 0.931 . . . . 48.45 115.428 -173.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -88.45 154.75 20.12 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.029 0.442 . . . . 74.28 109.944 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 13.1 t -62.61 146.41 52.08 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.354 0.872 . . . . 60.55 113.354 -177.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -147.63 144.43 28.39 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.055 -1.461 . . . . 52.69 107.055 -174.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LYS . . . . . 0.545 ' NZ ' ' O ' ' B' ' 101' ' ' HOH . 21.2 pttp -85.97 -8.42 57.99 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.629 0.974 . . . . 68.31 113.629 -175.135 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 53.8 mmm-85 -54.07 134.42 43.84 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.29 0.567 . . . . 48.4 110.8 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' LYS . . . . . . . . . . . . . 8.1 mmtt -50.05 129.34 20.61 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.723 1.009 . . . . 85.08 113.723 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 83.0 -9.78 59.54 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 115.549 -0.751 . . . . 33.4 114.735 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -64.41 -56.24 15.6 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 114.679 1.363 . . . . 35.69 114.679 -173.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -67.19 -29.04 68.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.229 -0.442 . . . . 38.0 111.879 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 59.5 mp0 -68.54 -34.27 75.57 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 118.944 -1.103 . . . . 62.82 108.182 173.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.94 -44.06 96.56 Favored Glycine 0 CA--C 1.522 0.525 0 CA-C-N 115.819 -0.628 . . . . 32.13 113.419 175.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 71.7 mt -55.49 -39.36 70.35 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.836 0.827 . . . . 34.52 111.383 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' TRP . . . . . . . . . . . . . 66.7 t90 -65.89 -49.37 68.31 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.431 -0.804 . . . . 49.86 110.747 178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.16 -38.98 93.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.996 0.739 . . . . 38.34 112.996 -176.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 14.9 tt -67.36 -25.14 32.8 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.25 0 C-N-CA 119.317 -0.953 . . . . 40.79 110.357 -174.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -85.89 -50.01 7.43 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.339 0.496 . . . . 63.68 112.339 174.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -96.99 -27.0 14.82 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 115.249 1.574 . . . . 53.69 115.249 -165.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -144.1 58.24 5.75 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 120.49 -0.484 . . . . 45.44 111.783 -179.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.24 -16.91 44.77 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 121.46 1.44 . . . . 53.04 113.459 -171.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . -90.81 13.37 66.08 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 116.972 1.549 . . . . 37.46 116.972 175.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 10.1 p -61.06 127.7 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 119.176 1.488 . . . . 39.59 110.21 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 5.7 mtpt 61.56 17.2 8.33 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.946 1.091 . . . . 55.18 113.946 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -85.57 121.75 28.71 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 121.183 -0.207 . . . . 48.95 111.326 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' THR . . . . . 0.564 ' OG1' ' OE1' ' B' ' 31' ' ' GLU . 29.1 p -105.68 3.3 28.91 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.024 0.75 . . . . 63.21 113.024 -175.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . -67.0 -40.24 93.33 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.377 -0.44 . . . . 61.62 114.163 -175.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 p90 . . . . . 0 C--N 1.328 -0.348 0 N-CA-C 108.213 -1.032 . . . . 51.9 108.213 -179.221 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' ' DT' . . . . . 0.605 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.536 1.772 0 O4'-C1'-C2' 104.735 -1.241 . . . . 115.93 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ' DA' . . . . . 0.605 ' C8 ' H2'' ' C' ' 1' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.532 1.399 0 P-O3'-C3' 121.903 1.836 . . . . 77.95 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ' DT' . . . . . 0.412 ' N3 ' ' N1 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.553 3.542 0 N19-C1'-C2' 116.918 1.699 . . . . 126.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.394 -2.895 0 C3'-C2'-C1' 100.237 -1.759 . . . . 57.93 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.404 -2.236 0 C3'-C2'-C1' 100.463 -1.598 . . . . 60.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.42 -1.277 0 P-O3'-C3' 121.975 1.896 . . . . 76.52 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.534 1.609 0 P-O3'-C3' 121.375 1.396 . . . . 75.29 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.077 0 P-O3'-C3' 121.488 1.49 . . . . 114.31 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.546 2.814 0 OP1-P-OP2 123.477 2.585 . . . . 54.59 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.379 -3.987 0 P-O5'-C5' 118.735 -1.353 . . . . 64.78 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' ' DT' . . . . . 0.433 ' OP1' ' HB3' ' A' ' 23' ' ' PRO . . . . . . . . 0 O5'--C5' 1.405 -2.157 0 O5'-C5'-C4' 112.69 1.779 . . . . 129.74 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.074 0 C4'-C3'-C2' 104.983 1.783 . . . . 56.92 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ' DT' . . . . . 0.462 " H1'" H5'' ' D' ' 4' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.539 2.082 0 P-O5'-C5' 118.584 -1.448 . . . . 56.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' ' DA' . . . . . 0.498 ' H8 ' " H5'" ' D' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.379 -3.817 0 P-O3'-C3' 122.952 2.71 . . . . 65.43 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ' DT' . . . . . 0.515 " H1'" ' C8 ' ' D' ' 6' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 1.976 1 O4'-C1'-N19 111.003 4.004 . . . . 84.67 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' ' DA' . . . . . 0.515 ' C8 ' " H1'" ' D' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.4 -2.494 0 O4'-C1'-C2' 108.153 1.866 . . . . 88.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' ' DT' . . . . . 0.545 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.416 -1.121 0 O4'-C1'-N19 109.174 1.717 . . . . 53.04 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ' DA' . . . . . 0.545 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.404 -2.095 0 O4'-C1'-N19 106.681 -1.399 . . . . 57.55 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.903 0 P-O5'-C5' 118.194 -1.691 . . . . 60.62 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.538 1.982 0 OP1-P-OP2 122.141 1.694 . . . . 86.39 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.486 0 CA-C-O 120.673 0.041 . . . . 78.13 113.072 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.66 -173.42 14.87 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 115.63 1.012 . . . . 72.76 115.63 -173.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 35' ' ' VAL . . . . . . . . . . . . . 53.5 t -67.94 123.5 21.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 N-CA-C 113.205 0.817 . . . . 78.41 113.205 -176.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 36' ' ' MLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.469 0 N-CA-C 108.571 -0.9 . . . . 86.83 108.571 178.574 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 37' ' ' LYS . . . . . . . . . . . . . 7.2 mttp . . . . . 0 C--O 1.234 0.279 0 CA-C-N 115.538 -0.756 . . . . 99.66 111.019 -179.088 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 113.74 0.256 . . . . 72.42 113.74 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 34' ' ' GLY . . . . . . . . . . . . . . . -93.26 -176.67 40.52 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 116.084 1.193 . . . . 70.25 116.084 -175.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 35' ' ' VAL . . . . . . . . . . . . . 48.9 t -75.09 134.83 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 O-C-N 122.391 -0.476 . . . . 81.34 110.232 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 36' ' ' MLY . . . . . 0.411 ' HD2' HH22 ' F' ' 36' ' ' MLY . . . . . . . . 0 C--N 1.328 -0.334 0 C-N-CA 119.841 -0.744 . . . . 81.0 109.908 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 37' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 114.9 -1.045 . . . . 96.05 112.016 178.941 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . 0.545 ' O ' ' NZ ' ' B' ' 77' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.3 ttm . . . . . 0 C--O 1.233 0.229 0 N-CA-C 110.154 -0.313 . . . . 88.34 110.154 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.18 117.56 6.94 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.108 -0.497 . . . . 61.79 110.96 -173.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -65.04 129.5 94.51 Favored Pre-proline 0 C--O 1.215 -0.726 0 N-CA-C 109.306 -0.627 . . . . 95.15 109.306 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -71.0 155.78 61.26 Favored 'Trans proline' 0 C--O 1.219 -0.431 0 C-N-CA 116.566 -1.823 . . . . 48.87 111.926 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 44.8 mtm180 -73.88 160.6 81.51 Favored Pre-proline 0 C--N 1.327 -0.413 0 N-CA-C 107.79 -1.189 . . . . 46.24 107.79 169.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -66.94 152.06 81.04 Favored 'Trans proline' 0 C--O 1.244 0.819 0 C-N-CA 116.377 -1.949 . . . . 44.78 112.918 -175.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -100.88 -8.1 22.87 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 120.048 -0.661 . . . . 77.11 111.217 173.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -128.67 147.6 50.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.81 0.338 . . . . 75.96 110.576 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -131.24 163.23 28.22 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.065 -0.654 . . . . 42.77 109.471 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -122.9 150.76 42.5 Favored 'General case' 0 C--O 1.241 0.651 0 O-C-N 123.571 0.544 . . . . 76.76 110.36 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.88 129.0 14.12 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-N 115.986 -0.552 . . . . 37.74 109.832 174.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.45 -16.63 56.45 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 115.511 0.964 . . . . 39.78 115.511 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.0 140.03 57.04 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 117.481 0.641 . . . . 44.52 110.246 178.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.2 mt -101.15 134.03 44.79 Favored 'General case' 0 C--O 1.242 0.673 0 N-CA-C 108.734 -0.839 . . . . 39.68 108.734 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.0 m -143.74 167.89 12.3 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 CA-C-N 115.891 -0.595 . . . . 31.33 112.225 -174.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -96.94 131.56 43.6 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 106.654 -1.609 . . . . 35.12 106.654 155.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -115.43 136.0 53.54 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.133 -0.691 . . . . 29.25 109.133 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -111.86 121.35 44.8 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.637 0.606 . . . . 41.08 112.637 -175.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 1.9 mtm -122.14 156.41 33.7 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.81 -0.441 . . . . 72.61 109.81 169.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -60.3 132.7 54.74 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.828 -0.624 . . . . 55.87 111.727 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.45 -3.88 86.25 Favored Glycine 0 C--O 1.225 -0.468 0 C-N-CA 120.222 -0.989 . . . . 42.71 113.803 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -124.08 147.97 55.97 Favored Pre-proline 0 C--O 1.221 -0.421 0 N-CA-C 111.778 0.288 . . . . 56.42 111.778 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.433 ' HB3' ' OP1' ' D' ' 1' ' ' ' DT' . 72.2 Cg_endo -66.86 159.11 53.14 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 N-CA-C 109.995 -0.809 . . . . 34.1 109.995 172.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -54.95 129.02 36.12 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.588 -0.523 . . . . 42.63 109.588 173.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -122.53 131.25 24.41 Favored Pre-proline 0 C--O 1.241 0.64 0 CA-C-O 119.489 -0.291 . . . . 31.13 111.212 -160.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -59.98 131.29 38.62 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 121.072 1.181 . . . . 28.99 109.98 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -158.27 173.44 16.68 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.315 -0.554 . . . . 28.86 110.883 -166.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -138.3 144.84 40.62 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 123.478 0.486 . . . . 34.22 111.03 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.6 mm -78.73 114.68 19.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 N-CA-C 110.101 -0.333 . . . . 33.85 110.101 169.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -81.6 174.28 11.56 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.871 -0.418 . . . . 43.61 109.871 175.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.435 ' OE2' ' OG1' ' A' ' 97' ' ' THR . 15.6 pm0 -93.61 152.63 18.88 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 118.108 -1.437 . . . . 90.88 109.227 177.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.21 105.04 26.11 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 108.894 -0.78 . . . . 75.39 108.894 171.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -64.97 128.23 20.28 Favored 'Trans proline' 0 C--N 1.341 0.174 0 O-C-N 122.594 0.786 . . . . 70.81 112.466 -178.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.32 151.61 19.27 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 106.709 -1.589 . . . . 93.68 106.709 167.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.92 32.58 32.21 Favored Glycine 0 N--CA 1.452 -0.255 0 N-CA-C 110.035 -1.226 . . . . 65.27 110.035 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -137.71 168.27 20.01 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.761 -0.719 . . . . 57.42 109.141 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 74.4 t -60.68 131.34 25.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 108.874 -0.787 . . . . 49.65 108.874 169.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -75.89 135.14 71.06 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.089 -0.505 . . . . 74.79 111.22 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -73.35 168.96 23.43 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 123.843 3.028 . . . . 64.57 110.35 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -67.31 155.96 68.25 Favored 'Trans proline' 0 C--O 1.235 0.333 0 O-C-N 123.189 1.099 . . . . 66.9 109.89 175.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.4 144.01 43.31 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 123.641 0.588 . . . . 54.91 111.469 -176.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 53.22 28.18 6.85 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 114.808 1.41 . . . . 72.7 114.808 176.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.4 mttt -117.86 144.73 45.15 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.018 -1.104 . . . . 57.06 108.018 172.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 56' ' ' PHE . 66.9 m-85 -119.24 142.68 32.75 Favored Pre-proline 0 CA--C 1.509 -0.601 0 O-C-N 123.746 0.654 . . . . 59.75 111.434 -172.912 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.3 119.5 6.03 Favored 'Trans proline' 0 CA--C 1.507 -0.875 0 N-CA-C 108.675 -1.317 . . . . 43.24 108.675 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.1 mm -106.37 139.24 28.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 O-C-N 124.244 0.965 . . . . 33.09 111.186 -175.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -112.77 121.3 44.3 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 108.059 -1.089 . . . . 35.29 108.059 171.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -92.26 124.91 36.68 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.284 0.564 . . . . 35.85 109.69 -178.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -73.48 158.81 34.21 Favored 'General case' 0 C--O 1.249 1.039 0 C-N-CA 118.389 -1.324 . . . . 30.16 108.137 179.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 85.2 -53.77 4.82 Favored Glycine 0 CA--C 1.523 0.535 0 CA-C-N 115.135 -0.939 . . . . 35.62 114.356 -177.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.5 p -99.06 -18.88 17.52 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.387 -0.525 . . . . 37.8 111.336 -179.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 28.0 m170 59.37 24.42 12.99 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.434 0.693 . . . . 39.39 112.565 -175.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -75.48 167.63 21.53 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.274 -0.57 . . . . 53.82 110.827 173.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 74.7 p -132.26 157.66 43.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 49.1 110.202 178.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -164.74 173.21 12.08 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.43 -0.952 . . . . 41.29 108.43 170.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.435 ' O ' HD23 ' A' ' 57' ' ' LEU . 25.7 m-85 -110.08 132.3 54.29 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.261 -1.385 . . . . 47.86 107.261 173.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.435 HD23 ' O ' ' A' ' 56' ' ' PHE . 81.6 mt -141.34 148.92 40.47 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 124.135 0.897 . . . . 38.0 110.211 -177.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -92.54 164.43 27.99 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.913 -0.875 . . . . 36.08 110.913 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.47 -16.82 31.13 Favored 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.94 3.76 . . . . 47.28 113.671 -174.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 pttm -69.04 -20.16 64.11 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 109.639 -0.504 . . . . 64.14 109.639 177.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -109.61 11.95 24.51 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.092 -0.643 . . . . 49.62 112.136 -179.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.3 mt -118.74 138.1 52.89 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 121.008 0.433 . . . . 36.75 111.93 -174.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -134.1 114.48 12.75 Favored Pre-proline 0 C--O 1.238 0.49 0 CA-C-N 115.265 -0.879 . . . . 37.07 110.116 -175.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -49.74 128.01 20.27 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.426 2.751 . . . . 41.75 111.581 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -60.25 -46.24 90.49 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 114.909 1.448 . . . . 41.56 114.909 -165.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -70.0 -43.61 71.03 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.125 -1.03 . . . . 66.42 110.889 -174.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -63.63 -28.17 69.73 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.51 0.93 . . . . 78.69 113.51 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -112.56 3.44 16.74 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.697 0.999 . . . . 45.25 113.697 -175.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -54.72 -43.36 72.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.554 0.946 . . . . 74.64 113.554 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -68.53 -24.62 64.67 Favored 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 119.963 -0.695 . . . . 88.77 111.833 -175.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -90.58 -40.44 11.94 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 120.087 -0.645 . . . . 69.02 112.183 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -107.29 -8.11 16.49 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.014 1.116 . . . . 44.46 114.014 -170.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -91.89 27.01 10.64 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 114.918 0.727 . . . . 47.81 114.918 -171.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -87.79 151.23 23.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.356 -0.609 . . . . 63.84 109.356 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 53.9 p -63.26 150.49 43.01 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.248 0.547 . . . . 63.82 111.098 -174.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -151.83 141.59 21.9 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.728 -1.582 . . . . 52.41 106.728 -172.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -78.42 -12.14 59.99 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.123 1.527 . . . . 64.04 115.123 -177.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 33.0 mmm-85 -54.99 134.14 48.8 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.421 -0.799 . . . . 61.81 111.206 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -48.38 123.39 6.48 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.274 0.842 . . . . 89.51 113.274 -177.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.75 -15.9 56.03 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 119.911 -1.138 . . . . 36.46 114.795 176.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -61.81 -53.63 53.28 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 118.509 1.155 . . . . 31.36 113.774 -176.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -65.63 -30.81 71.57 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 112.46 0.541 . . . . 41.67 112.46 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 52.0 mp0 -64.17 -44.01 93.35 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.664 -0.814 . . . . 76.58 108.988 171.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.36 -40.47 85.56 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 116.017 -0.538 . . . . 32.56 114.299 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.6 mt -61.16 -35.82 78.15 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.857 0.837 . . . . 32.44 110.744 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -68.18 -47.56 67.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.429 -0.805 . . . . 51.89 111.31 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -65.12 -39.34 92.96 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.351 0.871 . . . . 39.28 113.351 -178.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.0 tt -66.16 -23.08 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 117.951 -1.5 . . . . 39.78 109.704 -176.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -90.6 -41.02 11.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.316 0.858 . . . . 64.8 113.316 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -108.02 -23.21 12.1 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 114.997 1.481 . . . . 51.64 114.997 -167.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -145.57 53.96 2.14 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 120.169 -0.612 . . . . 41.48 111.99 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.71 -13.18 32.08 Favored 'Trans proline' 0 C--N 1.347 0.467 0 O-C-N 122.325 0.645 . . . . 43.13 112.486 -169.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -91.34 7.85 79.86 Favored Glycine 0 C--O 1.242 0.598 0 N-CA-C 116.141 1.216 . . . . 38.1 116.141 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.3 p -57.11 129.64 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-N 117.71 0.755 . . . . 38.98 109.727 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt 55.84 17.59 2.57 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.457 1.651 . . . . 54.51 115.457 -177.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -81.13 129.31 34.51 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 120.845 -0.342 . . . . 49.05 111.13 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . 0.435 ' OG1' ' OE2' ' A' ' 31' ' ' GLU . 42.9 p -113.75 -4.54 13.37 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.471 0.915 . . . . 58.93 113.471 -177.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.43 97.62 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 114.075 0.39 . . . . 60.84 114.075 -175.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 28.5 p90 . . . . . 0 C--N 1.329 -0.288 0 C-N-CA 123.897 0.879 . . . . 54.25 108.815 175.834 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 113.052 0.76 . . . . 81.94 113.052 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 38.6 ttm -52.79 138.91 28.17 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.668 -1.151 . . . . 84.55 111.393 164.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.74 119.91 15.65 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.073 0.768 . . . . 56.51 113.073 -176.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ARG . . . . . . . . . . . . . 26.8 ttp85 -68.55 128.16 93.06 Favored Pre-proline 0 C--O 1.211 -0.95 0 O-C-N 121.402 -0.811 . . . . 85.65 110.37 -176.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -68.11 158.22 58.38 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 118.092 -0.805 . . . . 45.86 112.354 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ARG . . . . . . . . . . . . . 44.5 mtm180 -77.31 162.9 67.51 Favored Pre-proline 0 C--O 1.234 0.28 0 N-CA-C 108.803 -0.814 . . . . 45.54 108.803 169.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -61.4 149.66 88.55 Favored 'Trans proline' 0 C--O 1.237 0.459 0 N-CA-C 114.235 0.821 . . . . 46.03 114.235 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . 41.2 mtp85 -101.73 -8.91 21.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 66.68 109.973 172.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -139.05 141.66 38.22 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.488 0.661 . . . . 90.1 111.9 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -125.55 160.82 28.61 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.5 -0.926 . . . . 42.22 108.5 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -118.4 153.91 33.29 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 123.869 0.73 . . . . 71.22 110.317 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.83 129.83 23.91 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.935 -0.394 . . . . 39.07 109.935 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.8 -14.55 49.45 Favored Glycine 0 C--O 1.223 -0.591 0 O-C-N 123.668 0.605 . . . . 38.56 113.572 175.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.29 134.93 54.66 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 117.333 0.566 . . . . 50.95 111.936 177.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 54.1 mt -97.33 133.42 41.97 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.355 0.598 . . . . 40.17 110.436 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 35.3 m -142.61 168.65 13.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.809 -0.632 . . . . 32.48 111.398 -171.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -99.12 129.94 45.41 Favored 'General case' 0 C--O 1.253 1.248 0 N-CA-C 106.053 -1.832 . . . . 34.16 106.053 155.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.02 132.98 55.17 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.661 -0.496 . . . . 29.63 109.661 -178.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 24.2 tptp -106.96 123.8 48.71 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 112.918 0.71 . . . . 41.56 112.918 -176.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' MET . . . . . . . . . . . . . 1.9 mtp -125.89 145.35 50.29 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.409 -1.33 . . . . 73.39 107.409 173.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -54.8 129.19 36.23 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.719 0.637 . . . . 59.0 112.017 -177.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 91.25 -3.82 80.15 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 116.079 -0.51 . . . . 43.61 113.968 177.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -124.47 151.88 67.6 Favored Pre-proline 0 N--CA 1.45 -0.459 0 N-CA-C 109.675 -0.491 . . . . 56.34 109.675 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.75 158.59 56.45 Favored 'Trans proline' 0 C--O 1.238 0.524 0 O-C-N 122.638 0.81 . . . . 33.43 110.094 172.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -50.32 127.19 16.7 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 120.219 -0.592 . . . . 41.78 109.919 170.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' TRP . . . . . . . . . . . . . 6.7 t-105 -122.42 130.51 24.64 Favored Pre-proline 0 C--O 1.245 0.816 0 CA-C-O 119.001 -0.524 . . . . 33.34 110.403 -161.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -55.99 129.13 33.26 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.024 1.816 . . . . 27.09 110.569 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.89 175.35 14.05 Favored 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 123.953 0.783 . . . . 28.12 112.844 -171.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -141.69 140.29 33.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.165 -0.471 . . . . 35.38 109.91 -177.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ILE . . . . . . . . . . . . . 25.8 mm -73.84 116.59 16.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 108.538 -0.912 . . . . 36.42 108.538 173.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -83.45 178.12 8.17 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.955 0.883 . . . . 46.26 112.84 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.564 ' OE1' ' OG1' ' B' ' 97' ' ' THR . 15.6 tt0 -70.36 134.85 48.29 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 113.995 -1.457 . . . . 90.81 113.412 170.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -105.22 96.0 10.59 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.238 -0.653 . . . . 79.15 109.238 164.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -61.22 130.25 31.55 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.018 1.812 . . . . 79.75 112.217 -174.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.35 140.56 54.28 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 106.62 -1.622 . . . . 116.34 106.62 168.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 95.81 18.44 32.26 Favored Glycine 0 C--N 1.328 0.114 0 N-CA-C 108.731 -1.748 . . . . 71.65 108.731 -174.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -119.65 167.3 12.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.335 0.588 . . . . 52.71 109.765 171.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 77.9 t -56.66 130.54 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 N-CA-C 108.186 -1.042 . . . . 56.62 108.186 166.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' B' ' 38' ' ' LYS . 1.5 mptt -71.48 137.84 83.6 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 116.283 -0.417 . . . . 72.89 110.103 -177.451 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.09 166.34 29.48 Favored 'Trans proline' 0 CA--C 1.519 -0.264 0 C-N-CA 124.399 3.4 . . . . 64.66 112.272 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -57.84 149.03 72.03 Favored 'Trans proline' 0 C--O 1.231 0.151 0 N-CA-C 108.851 -1.25 . . . . 65.76 108.851 169.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.54 148.24 42.8 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.378 -0.929 . . . . 50.34 111.59 -178.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 48.24 32.35 3.07 Favored 'General case' 0 C--O 1.224 -0.253 0 N-CA-C 114.442 1.275 . . . . 71.75 114.442 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -120.2 149.42 42.28 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.573 -0.899 . . . . 61.14 108.573 170.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' TYR . . . . . 0.421 ' O ' ' HA ' ' B' ' 56' ' ' PHE . 71.3 m-85 -121.21 142.71 35.63 Favored Pre-proline 0 CA--C 1.505 -0.753 0 CA-C-N 115.688 -0.687 . . . . 60.37 109.88 -172.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -71.92 124.4 10.1 Favored 'Trans proline' 0 CA--C 1.511 -0.672 0 N-CA-C 108.436 -1.409 . . . . 45.11 108.436 174.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 28.7 mm -112.96 137.19 46.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 O-C-N 124.194 0.934 . . . . 34.31 111.846 -175.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -111.54 118.84 36.83 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 106.682 -1.599 . . . . 34.38 106.682 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -90.05 120.54 31.34 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 121.665 0.745 . . . . 34.72 109.938 179.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -68.05 151.65 46.73 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 119.131 -1.028 . . . . 38.37 110.089 176.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.49 -47.85 2.59 Favored Glycine 0 C--O 1.237 0.317 0 CA-C-N 116.211 -0.449 . . . . 37.5 113.613 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 69.4 p -105.23 -21.55 13.23 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.943 0.401 . . . . 39.46 110.848 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' HIS . . . . . . . . . . . . . 18.4 m170 61.29 23.25 13.5 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.261 -0.881 . . . . 40.51 111.665 -176.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -71.02 166.19 21.86 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.212 -0.449 . . . . 54.26 111.647 170.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 64.9 p -133.46 161.36 34.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.359 -0.382 . . . . 50.39 110.908 177.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -170.94 175.0 4.57 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.175 -0.676 . . . . 44.1 109.175 172.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' PHE . . . . . 0.421 ' HA ' ' O ' ' B' ' 44' ' ' TYR . 22.5 m-85 -114.05 130.68 56.54 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.06 -1.089 . . . . 44.97 108.06 175.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 92.3 mt -140.8 149.35 41.94 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.521 -0.918 . . . . 40.68 108.521 -176.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -94.08 164.66 26.2 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.007 -0.837 . . . . 37.5 111.007 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -52.4 -25.15 23.67 Favored 'Trans proline' 0 CA--C 1.53 0.324 1 C-N-CA 125.799 4.333 . . . . 45.49 114.398 -175.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -65.46 -21.87 66.69 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.936 -0.706 . . . . 53.63 110.735 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -106.64 12.81 28.91 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 113.288 0.847 . . . . 68.41 113.288 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 65.9 mt -118.45 141.32 48.67 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-O 121.176 0.512 . . . . 33.23 111.672 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -134.91 117.4 12.79 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.413 -0.812 . . . . 38.79 109.801 -176.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -49.2 127.15 16.93 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 121.702 1.601 . . . . 42.22 112.923 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -55.72 -56.49 19.9 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 112.805 0.668 . . . . 44.88 112.805 -168.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -58.67 -43.99 90.06 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.066 -0.515 . . . . 78.13 111.642 -173.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -67.61 -26.17 66.12 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.862 0.69 . . . . 89.59 112.862 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -120.08 6.68 10.79 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.215 0.82 . . . . 50.37 113.215 -172.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.12 -31.66 65.55 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 113.355 0.872 . . . . 64.61 113.355 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.56 -44.28 71.2 Favored 'General case' 0 CA--C 1.506 -0.712 0 C-N-CA 120.15 -0.62 . . . . 90.45 110.44 -175.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -75.29 -48.94 20.9 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.159 -0.473 . . . . 72.39 111.594 -178.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -96.81 -9.13 29.38 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.329 1.603 . . . . 43.64 115.329 -168.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -90.92 27.2 9.28 Favored Glycine 0 CA--C 1.516 0.152 0 N-CA-C 115.428 0.931 . . . . 48.45 115.428 -173.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -88.45 154.75 20.12 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.029 0.442 . . . . 74.28 109.944 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 13.1 t -62.61 146.41 52.08 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.354 0.872 . . . . 60.55 113.354 -177.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -147.63 144.43 28.39 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.055 -1.461 . . . . 52.69 107.055 -174.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LYS . . . . . 0.545 ' NZ ' ' O ' ' B' ' 101' ' ' HOH . 21.2 pttp -85.97 -8.42 57.99 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.629 0.974 . . . . 68.31 113.629 -175.135 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 53.8 mmm-85 -54.07 134.42 43.84 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.29 0.567 . . . . 48.4 110.8 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' LYS . . . . . . . . . . . . . 8.1 mmtt -50.05 129.34 20.61 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.723 1.009 . . . . 85.08 113.723 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 83.0 -9.78 59.54 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 115.549 -0.751 . . . . 33.4 114.735 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -64.41 -56.24 15.6 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 114.679 1.363 . . . . 35.69 114.679 -173.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -67.19 -29.04 68.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.229 -0.442 . . . . 38.0 111.879 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 59.5 mp0 -68.54 -34.27 75.57 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 118.944 -1.103 . . . . 62.82 108.182 173.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . -63.94 -44.06 96.56 Favored Glycine 0 CA--C 1.522 0.525 0 CA-C-N 115.819 -0.628 . . . . 32.13 113.419 175.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 71.7 mt -55.49 -39.36 70.35 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.836 0.827 . . . . 34.52 111.383 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' TRP . . . . . . . . . . . . . 66.7 t90 -65.89 -49.37 68.31 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.431 -0.804 . . . . 49.86 110.747 178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.16 -38.98 93.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.996 0.739 . . . . 38.34 112.996 -176.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 14.9 tt -67.36 -25.14 32.8 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.25 0 C-N-CA 119.317 -0.953 . . . . 40.79 110.357 -174.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -85.89 -50.01 7.43 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.339 0.496 . . . . 63.68 112.339 174.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -96.99 -27.0 14.82 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 115.249 1.574 . . . . 53.69 115.249 -165.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -144.1 58.24 5.75 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 120.49 -0.484 . . . . 45.44 111.783 -179.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.24 -16.91 44.77 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 121.46 1.44 . . . . 53.04 113.459 -171.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . -90.81 13.37 66.08 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 116.972 1.549 . . . . 37.46 116.972 175.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 10.1 p -61.06 127.7 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-N 119.176 1.488 . . . . 39.59 110.21 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 5.7 mtpt 61.56 17.2 8.33 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.946 1.091 . . . . 55.18 113.946 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -85.57 121.75 28.71 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 121.183 -0.207 . . . . 48.95 111.326 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' THR . . . . . 0.564 ' OG1' ' OE1' ' B' ' 31' ' ' GLU . 29.1 p -105.68 3.3 28.91 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.024 0.75 . . . . 63.21 113.024 -175.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . -67.0 -40.24 93.33 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.377 -0.44 . . . . 61.62 114.163 -175.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 22.8 p90 . . . . . 0 C--N 1.328 -0.348 0 N-CA-C 108.213 -1.032 . . . . 51.9 108.213 -179.221 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' ' DT' . . . . . 0.605 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.536 1.772 0 O4'-C1'-C2' 104.735 -1.241 . . . . 115.93 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.605 ' C8 ' H2'' ' C' ' 1' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.532 1.399 0 P-O3'-C3' 121.903 1.836 . . . . 77.95 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ' DT' . . . . . 0.412 ' N3 ' ' N1 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.553 3.542 0 N19-C1'-C2' 116.918 1.699 . . . . 126.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.394 -2.895 0 C3'-C2'-C1' 100.237 -1.759 . . . . 57.93 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.404 -2.236 0 C3'-C2'-C1' 100.463 -1.598 . . . . 60.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.42 -1.277 0 P-O3'-C3' 121.975 1.896 . . . . 76.52 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.534 1.609 0 P-O3'-C3' 121.375 1.396 . . . . 75.29 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.077 0 P-O3'-C3' 121.488 1.49 . . . . 114.31 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.546 2.814 0 OP1-P-OP2 123.477 2.585 . . . . 54.59 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.379 -3.987 0 P-O5'-C5' 118.735 -1.353 . . . . 64.78 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' ' DT' . . . . . 0.433 ' OP1' ' HB3' ' A' ' 23' ' ' PRO . . . . . . . . 0 O5'--C5' 1.405 -2.157 0 O5'-C5'-C4' 112.69 1.779 . . . . 129.74 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.074 0 C4'-C3'-C2' 104.983 1.783 . . . . 56.92 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.462 " H1'" H5'' ' D' ' 4' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.539 2.082 0 P-O5'-C5' 118.584 -1.448 . . . . 56.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' ' DA' . . . . . 0.498 ' H8 ' " H5'" ' D' ' 4' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.379 -3.817 0 P-O3'-C3' 122.952 2.71 . . . . 65.43 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ' DT' . . . . . 0.515 " H1'" ' C8 ' ' D' ' 6' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 1.976 1 O4'-C1'-N19 111.003 4.004 . . . . 84.67 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' ' DA' . . . . . 0.515 ' C8 ' " H1'" ' D' ' 5' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.4 -2.494 0 O4'-C1'-C2' 108.153 1.866 . . . . 88.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.545 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.416 -1.121 0 O4'-C1'-N19 109.174 1.717 . . . . 53.04 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.545 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.404 -2.095 0 O4'-C1'-N19 106.681 -1.399 . . . . 57.55 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.903 0 P-O5'-C5' 118.194 -1.691 . . . . 60.62 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.538 1.982 0 OP1-P-OP2 122.141 1.694 . . . . 86.39 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.486 0 CA-C-O 120.673 0.041 . . . . 78.13 113.072 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.66 -173.42 14.87 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 115.63 1.012 . . . . 72.76 115.63 -173.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 35' ' ' VAL . . . . . . . . . . . . . 53.5 t -67.94 123.5 21.34 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 N-CA-C 113.205 0.817 . . . . 78.41 113.205 -176.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' MLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.469 0 N-CA-C 108.571 -0.9 . . . . 86.83 108.571 178.574 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' LYS . . . . . . . . . . . . . 7.2 mttp . . . . . 0 C--O 1.234 0.279 0 CA-C-N 115.538 -0.756 . . . . 99.66 111.019 -179.088 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 113.74 0.256 . . . . 72.42 113.74 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 34' ' ' GLY . . . . . . . . . . . . . . . -93.26 -176.67 40.52 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 116.084 1.193 . . . . 70.25 116.084 -175.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 35' ' ' VAL . . . . . . . . . . . . . 48.9 t -75.09 134.83 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 O-C-N 122.391 -0.476 . . . . 81.34 110.232 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 36' ' ' MLY . . . . . 0.411 ' HD2' HH22 ' F' ' 36' ' ' MLY . . . . . . . . 0 C--N 1.328 -0.334 0 C-N-CA 119.841 -0.744 . . . . 81.0 109.908 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 114.9 -1.045 . . . . 96.05 112.016 178.941 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . 0.545 ' O ' ' NZ ' ' B' ' 77' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_