data_6kd1_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 6kd1 _Structure_validation_residue.Date_analyzed 2019-07-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.6 tttt . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 109.72 -0.474 . . . . 75.59 109.72 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 79.9 t -106.54 106.6 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 107.451 -1.314 . . . . 48.39 107.451 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -71.04 151.94 44.05 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 121.658 0.742 . . . . 54.17 110.405 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -82.95 161.35 39.79 Favored Glycine 0 C--N 1.353 1.476 0 C-N-CA 120.197 -1.002 . . . . 50.43 111.761 158.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.1 ttp85 -56.36 -54.88 40.29 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.882 -0.659 . . . . 64.71 111.765 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 73.8 m -73.08 -33.46 65.64 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 119.576 -0.85 . . . . 51.64 112.181 -178.322 -63.19 -61.601 -69.687 105.002 2.006 104.448 -62.267 -52.364 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -55.69 -44.58 77.51 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.757 -0.777 . . . . 53.61 111.172 173.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 63.4 tp -70.16 -42.77 72.06 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.676 -0.64 . . . . 45.57 111.177 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -51.96 -44.06 63.81 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.654 -0.418 . . . . 42.46 110.432 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.06 -37.69 72.5 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 120.107 -0.637 . . . . 46.86 111.25 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.64 89.4 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.689 -0.804 . . . . 49.0 111.767 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 34.2 mtt -65.84 -40.38 91.7 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 119.753 -0.779 . . . . 45.19 110.947 179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.2 tttt -63.43 -41.21 98.67 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 120.892 -0.323 . . . . 83.9 110.631 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -66.07 -28.52 68.9 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 118.943 -1.103 . . . . 85.7 111.452 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -90.96 12.69 18.83 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.912 0.708 . . . . 56.82 112.912 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.01 16.77 46.36 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 116.031 1.172 . . . . 51.87 116.031 167.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.9 mt -89.22 -15.11 34.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 114.713 1.375 . . . . 55.61 114.713 -174.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -71.8 120.94 18.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 120.405 1.457 . . . . 60.22 109.03 -177.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 64.8 19.84 11.95 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.622 1.169 . . . . 58.06 112.65 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.45 119.75 10.98 Favored 'General case' 0 C--O 1.245 0.846 0 O-C-N 121.524 -0.735 . . . . 58.83 109.677 175.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 9.4 mtp85 51.47 36.47 16.86 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.624 0.726 . . . . 91.28 112.717 -173.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.51 1.61 83.25 Favored Glycine 0 CA--C 1.508 -0.406 0 N-CA-C 115.911 1.125 . . . . 44.02 115.911 172.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -99.93 113.86 26.71 Favored 'General case' 0 C--O 1.244 0.78 0 CA-C-N 118.205 1.002 . . . . 41.88 110.084 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 96.1 p -66.74 162.29 21.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 122.129 0.966 . . . . 47.47 110.842 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.3 tp -56.76 -38.72 72.84 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-N 114.733 -1.121 . . . . 69.48 111.905 -173.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -55.24 -34.06 58.62 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 119.994 -1.098 . . . . 36.35 113.694 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -62.25 -43.31 99.12 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 121.61 -0.936 . . . . 41.7 111.081 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -69.38 -38.6 78.09 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 123.521 0.728 . . . . 45.44 111.141 -177.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 54.7 t -68.2 -43.99 84.44 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 O-C-N 121.409 -0.807 . . . . 41.91 111.206 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 47.9 t -58.47 -46.31 86.86 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 120.941 0.401 . . . . 34.92 110.322 177.37 -177.39 -89.933 -94.498 104.265 2.022 102.202 -79.255 -54.658 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.57 -42.43 92.45 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 120.542 -0.463 . . . . 38.3 111.618 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.3 -40.5 90.03 Favored 'General case' 0 C--O 1.245 0.855 0 C-N-CA 120.361 -0.535 . . . . 36.58 111.381 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -53.14 -51.48 61.82 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.512 0.673 . . . . 63.4 111.49 177.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -87.24 -16.73 34.37 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 118.769 -1.172 . . . . 48.02 112.899 -171.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -81.02 -38.59 27.21 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 118.919 -1.112 . . . . 41.13 112.201 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.1 p -135.56 -1.64 2.51 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 114.417 1.266 . . . . 41.03 114.417 -168.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.5 t30 50.21 38.31 17.01 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.27 1.028 . . . . 79.22 111.184 -169.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 69.08 20.56 7.65 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.7 1.2 . . . . 47.71 112.824 174.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 56.4 t-20 -104.14 116.69 32.65 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.719 -1.238 . . . . 42.62 109.494 -174.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.1 p -67.47 -17.02 64.53 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 118.421 -1.311 . . . . 42.35 111.761 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -95.05 5.63 51.34 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.193 1.183 . . . . 43.13 114.193 -175.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.31 138.26 57.5 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.556 -0.858 . . . . 41.44 112.28 -176.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 74.0 p -136.29 148.58 48.04 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 114.775 -1.102 . . . . 44.35 108.688 173.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -150.46 132.62 15.37 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.225 -0.657 . . . . 59.7 109.225 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -89.44 142.54 27.57 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.559 1.162 . . . . 83.59 110.006 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -107.75 163.5 13.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.516 0.674 . . . . 55.2 111.964 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 p -59.17 -36.34 75.13 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.124 -0.943 . . . . 78.58 111.31 -175.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 53.5 p30 -76.43 4.78 8.35 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.927 0.714 . . . . 58.6 112.927 -176.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.72 -8.03 80.64 Favored Glycine 0 C--O 1.243 0.669 0 N-CA-C 116.028 1.171 . . . . 50.66 116.028 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 91.4 p -80.03 167.94 19.8 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.519 1.152 . . . . 41.94 111.03 171.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 90.7 m -134.96 142.12 46.41 Favored 'General case' 0 C--O 1.245 0.852 0 N-CA-C 108.159 -1.052 . . . . 40.22 108.159 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -98.01 139.84 33.24 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.215 1.006 . . . . 44.13 110.765 174.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -129.89 129.36 43.81 Favored 'General case' 0 C--N 1.348 0.543 0 N-CA-C 112.392 0.516 . . . . 40.63 112.392 -167.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.41 -166.91 30.89 Favored Glycine 0 C--N 1.318 -0.424 0 CA-C-O 122.711 1.173 . . . . 36.9 115.849 161.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.4 tp -60.13 -32.01 49.42 Favored 'Isoleucine or valine' 0 C--O 1.246 0.91 0 CA-C-N 114.116 -1.042 . . . . 56.54 113.215 -175.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 71.5 mt -113.73 16.31 18.57 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.006 0.743 . . . . 44.48 113.006 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 49.86 58.61 5.26 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 122.634 1.206 . . . . 37.16 112.442 169.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 68.2 mt -84.08 134.52 26.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.714 0 CA-C-N 114.075 -1.42 . . . . 48.73 110.515 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -91.83 139.46 30.64 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 113.359 0.874 . . . . 49.24 113.359 -164.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.2 p -77.81 -13.28 59.94 Favored 'General case' 0 C--N 1.347 0.494 0 N-CA-C 114.018 1.118 . . . . 39.43 114.018 -174.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 22.9 ttm-85 -72.02 -30.63 65.4 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 117.238 -1.785 . . . . 99.64 112.022 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -111.93 -37.06 5.22 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 115.106 1.521 . . . . 90.3 115.106 -176.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TRP . . . . . 0.457 ' CE2' HG12 ' A' ' 116' ' ' ILE . 82.2 m95 -112.73 -23.12 10.36 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 116.321 1.971 . . . . 46.7 116.321 -155.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 32.0 p -148.85 158.52 44.22 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 107.899 -1.149 . . . . 39.33 107.899 -175.158 64.428 81.764 97.076 103.532 2.036 104.404 -66.681 -59.103 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -105.86 123.23 47.63 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 116.488 -0.324 . . . . 66.38 110.411 -175.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 54.9 p30 -119.49 6.61 11.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.617 0.599 . . . . 40.35 112.617 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.9 6.25 77.9 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-O 119.192 -0.782 . . . . 49.26 114.631 170.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.8 ptt180 -141.11 16.56 2.26 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-N 118.367 1.083 . . . . 50.12 113.903 179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.3 m -114.26 90.82 21.5 Favored Pre-proline 0 C--O 1.244 0.785 0 N-CA-C 106.769 -1.567 . . . . 53.61 106.769 177.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' PRO . . . . . 0.417 ' O ' ' O ' ' A' ' 301' ' ' HOH . 5.4 Cg_exo -46.52 -61.28 0.63 Allowed 'Trans proline' 0 C--N 1.35 0.637 0 N-CA-C 118.67 2.527 . . . . 85.57 118.67 -168.12 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -86.65 36.54 3.24 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 118.136 -1.983 . . . . 94.72 116.364 -170.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 90.5 p -102.05 147.15 26.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 122.143 0.973 . . . . 74.11 113.016 -158.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.73 169.34 11.73 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 122.567 1.175 . . . . 103.76 108.447 167.949 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -135.77 66.27 1.51 Allowed 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 105.056 -2.202 . . . . 59.22 105.056 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 53.5 mt -71.93 -23.97 61.55 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 113.996 1.11 . . . . 63.57 113.996 -168.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 88.8 m -89.66 -5.96 56.61 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 119.113 0.869 . . . . 42.88 111.243 174.447 -66.891 172.915 80.482 103.675 2.044 106.117 54.145 -173.745 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 60.04 48.78 8.22 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.617 1.167 . . . . 60.01 111.723 174.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.5 pt -142.52 151.5 57.69 Favored Pre-proline 0 C--O 1.238 0.495 0 CA-C-N 115.51 -0.768 . . . . 71.42 109.142 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.48 143.0 50.76 Favored 'Trans proline' 0 C--N 1.32 -0.959 0 N-CA-C 110.385 -0.66 . . . . 54.08 110.385 165.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 80.1 m -61.26 -27.2 68.29 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 119.69 -0.804 . . . . 41.2 111.863 -177.092 -59.103 -66.681 97.076 104.404 2.036 103.532 81.764 64.428 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 96.9 p -61.37 -26.96 68.18 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.977 -0.689 . . . . 47.5 111.882 177.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.28 -21.33 66.71 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 119.039 -1.064 . . . . 44.52 111.956 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 81.2 mt -80.89 -3.64 52.07 Favored 'General case' 0 C--O 1.245 0.857 0 N-CA-C 114.216 1.191 . . . . 53.44 114.216 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.0 mt -100.99 -1.19 34.99 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 113.208 0.818 . . . . 54.28 113.208 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.6 t -60.8 153.59 24.04 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.921 0.867 . . . . 55.51 112.698 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 73.3 p -71.12 -14.8 62.42 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.729 -0.669 . . . . 64.61 112.573 172.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -88.89 117.5 27.93 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 106.745 -1.576 . . . . 58.02 106.745 170.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.9 pt -83.1 4.15 2.5 Favored 'Isoleucine or valine' 0 C--O 1.248 0.999 0 C-N-CA 120.066 -0.654 . . . . 48.32 112.444 -172.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 47.5 m -58.15 -44.21 87.74 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 118.444 0.566 . . . . 55.53 111.108 -169.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.52 -37.94 86.12 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.131 -1.028 . . . . 52.65 111.176 -176.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.8 m -64.73 -40.7 95.77 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 120.857 -0.337 . . . . 44.61 111.485 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 41.4 t -66.29 -45.14 90.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-O 121.118 0.485 . . . . 48.43 110.341 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.75 -39.58 92.11 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 119.439 -0.905 . . . . 65.25 110.779 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 49.6 t -72.07 -40.07 68.56 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 122.059 -0.4 . . . . 41.13 111.036 179.397 -173.745 54.145 80.482 106.117 2.044 103.675 172.915 -66.891 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.31 -38.25 71.01 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 112.56 0.578 . . . . 39.11 112.56 174.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -63.27 -33.6 75.85 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.168 -1.013 . . . . 61.45 112.07 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -71.97 -38.54 69.72 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 120.035 -0.666 . . . . 89.65 110.801 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ILE . . . . . 0.457 HG12 ' CE2' ' A' ' 81' ' ' TRP . 89.8 mt -64.49 -48.47 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 120.159 -0.616 . . . . 42.6 110.838 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.0 p -69.0 -14.51 18.62 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 O-C-N 121.277 -0.89 . . . . 46.29 111.593 -173.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 70.6 m -92.49 -1.94 56.6 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 113.095 0.776 . . . . 57.23 113.095 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -86.37 4.0 41.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 118.756 -0.64 . . . . 62.98 112.686 -167.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 121.84 -28.92 5.76 Favored Glycine 0 C--N 1.336 0.581 0 CA-C-N 118.711 0.687 . . . . 58.42 114.346 171.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -103.64 5.76 36.64 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 118.189 0.994 . . . . 74.41 113.003 -175.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 58.09 -145.7 40.58 Favored Glycine 0 CA--C 1.501 -0.824 0 N-CA-C 110.21 -1.156 . . . . 39.82 110.21 174.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 56.4 mtp -80.08 1.15 29.0 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.968 0.729 . . . . 39.68 112.968 -175.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 -65.57 -13.74 59.63 Favored 'General case' 0 C--N 1.346 0.455 0 CA-C-N 119.021 0.828 . . . . 43.81 111.953 174.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.24 -23.33 63.99 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.889 0.7 . . . . 40.91 112.889 171.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -99.91 112.17 24.45 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.383 0.992 . . . . 43.26 109.189 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 56.5 t -62.65 -39.1 83.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.161 -0.472 . . . . 61.83 110.647 -171.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.45 -33.52 75.32 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.566 -0.854 . . . . 41.39 111.753 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 91.6 t90 -63.98 -47.67 79.44 Favored 'General case' 0 CA--C 1.511 -0.54 0 C-N-CA 119.01 -1.076 . . . . 40.91 110.465 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 25.9 ttp-105 -56.9 -44.15 82.06 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 116.46 -0.336 . . . . 80.58 111.161 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -90.65 -17.67 26.45 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 114.243 1.201 . . . . 42.12 114.243 -172.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -128.79 -12.21 4.82 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 115.373 1.62 . . . . 51.09 115.373 -172.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 58.1 m -118.67 -42.8 2.72 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 113.71 1.004 . . . . 37.87 113.71 -179.507 -54.658 -79.255 -94.498 102.202 2.022 104.265 -89.933 -177.39 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -54.88 130.17 40.22 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 122.883 0.473 . . . . 46.63 110.54 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 77.55 7.25 87.14 Favored Glycine 0 CA--C 1.507 -0.447 0 N-CA-C 115.152 0.821 . . . . 52.26 115.152 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 10.4 p -106.69 174.13 6.02 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 118.512 1.156 . . . . 58.81 108.049 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -80.65 87.46 5.79 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 107.462 -1.31 . . . . 59.74 107.462 178.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 15.7 m -78.91 -17.71 13.28 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 C-N-CA 119.328 -0.949 . . . . 54.74 111.85 -173.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -61.27 -26.04 67.5 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 120.19 -0.604 . . . . 114.2 111.599 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -53.22 -26.15 16.62 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.301 -0.56 . . . . 57.24 111.931 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -74.34 -17.84 60.78 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 113.178 0.807 . . . . 53.25 113.178 -174.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 39.7 pt -112.33 3.46 8.43 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 113.271 0.841 . . . . 65.16 113.271 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 6.5 mtt85 -66.23 143.42 57.24 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 119.017 0.826 . . . . 89.54 110.245 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 82.9 -9.9 58.84 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-O 118.675 -1.07 . . . . 58.24 115.277 -178.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 39.5 m -87.99 144.05 26.75 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 118.956 1.378 . . . . 56.56 111.005 -176.853 -52.364 -62.267 -69.687 104.448 2.006 105.002 -61.601 -63.19 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -88.08 109.64 20.02 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 107.352 -1.351 . . . . 89.47 107.352 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 17.7 mt . . . . . 0 C--O 1.236 0.373 0 O-C-N 123.422 0.451 . . . . 82.85 111.73 -177.393 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.417 ' O ' ' O ' ' A' ' 88' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.6 tttt . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 109.72 -0.474 . . . . 62.95 109.72 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 79.9 t -106.54 106.6 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 107.451 -1.314 . . . . 41.94 107.451 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -71.04 151.94 44.05 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 121.658 0.742 . . . . 45.1 110.405 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -82.95 161.35 39.79 Favored Glycine 0 C--N 1.353 1.476 0 C-N-CA 120.197 -1.002 . . . . 41.99 111.761 158.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.1 ttp85 -56.36 -54.88 40.29 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.882 -0.659 . . . . 53.99 111.765 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 73.8 m -73.08 -33.46 65.64 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 119.576 -0.85 . . . . 42.99 112.181 -178.322 -63.19 -61.601 -69.687 105.002 2.006 104.448 -62.267 -52.364 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -55.69 -44.58 77.51 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.757 -0.777 . . . . 53.61 111.172 173.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 63.4 tp -70.16 -42.77 72.06 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.676 -0.64 . . . . 37.93 111.177 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -51.96 -44.06 63.81 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.654 -0.418 . . . . 35.34 110.432 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.06 -37.69 72.5 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 120.107 -0.637 . . . . 39.01 111.25 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.64 89.4 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.689 -0.804 . . . . 40.79 111.767 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 34.2 mtt -65.84 -40.38 91.7 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 119.753 -0.779 . . . . 41.03 110.947 179.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.2 tttt -63.43 -41.21 98.67 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 120.892 -0.323 . . . . 69.88 110.631 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -66.07 -28.52 68.9 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 118.943 -1.103 . . . . 71.37 111.452 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -90.96 12.69 18.83 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.912 0.708 . . . . 51.04 112.912 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.01 16.77 46.36 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 116.031 1.172 . . . . 51.04 116.031 167.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.9 mt -89.22 -15.11 34.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 114.713 1.375 . . . . 46.3 114.713 -174.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -71.8 120.94 18.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 120.405 1.457 . . . . 60.22 109.03 -177.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 64.8 19.84 11.95 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.622 1.169 . . . . 52.2 112.65 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.45 119.75 10.98 Favored 'General case' 0 C--O 1.245 0.846 0 O-C-N 121.524 -0.735 . . . . 48.98 109.677 175.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 9.4 mtp85 51.47 36.47 16.86 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.624 0.726 . . . . 76.02 112.717 -173.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.51 1.61 83.25 Favored Glycine 0 CA--C 1.508 -0.406 0 N-CA-C 115.911 1.125 . . . . 37.71 115.911 172.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -99.93 113.86 26.71 Favored 'General case' 0 C--O 1.244 0.78 0 CA-C-N 118.205 1.002 . . . . 34.86 110.084 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 96.1 p -66.74 162.29 21.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 122.129 0.966 . . . . 39.52 110.842 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.3 tp -56.76 -38.72 72.84 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-N 114.733 -1.121 . . . . 57.86 111.905 -173.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -55.24 -34.06 58.62 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 119.994 -1.098 . . . . 30.96 113.694 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -62.25 -43.31 99.12 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 121.61 -0.936 . . . . 34.71 111.081 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -69.38 -38.6 78.09 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 123.521 0.728 . . . . 37.82 111.141 -177.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 54.7 t -68.2 -43.99 84.44 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 O-C-N 121.409 -0.807 . . . . 34.88 111.206 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 47.9 t -58.47 -46.31 86.86 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 120.941 0.401 . . . . 29.63 110.322 177.37 -177.39 -89.933 -94.498 104.265 2.022 102.202 -79.255 -54.658 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.57 -42.43 92.45 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 120.542 -0.463 . . . . 31.88 111.618 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.3 -40.5 90.03 Favored 'General case' 0 C--O 1.245 0.855 0 C-N-CA 120.361 -0.535 . . . . 33.92 111.381 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -53.14 -51.48 61.82 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.512 0.673 . . . . 52.79 111.49 177.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -87.24 -16.73 34.37 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 118.769 -1.172 . . . . 39.98 112.899 -171.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -81.02 -38.59 27.21 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 118.919 -1.112 . . . . 37.94 112.201 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.1 p -135.56 -1.64 2.51 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 114.417 1.266 . . . . 35.49 114.417 -168.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.5 t30 50.21 38.31 17.01 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.27 1.028 . . . . 65.98 111.184 -169.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 69.08 20.56 7.65 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.7 1.2 . . . . 39.72 112.824 174.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 56.4 t-20 -104.14 116.69 32.65 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.719 -1.238 . . . . 35.47 109.494 -174.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.1 p -67.47 -17.02 64.53 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 118.421 -1.311 . . . . 35.25 111.761 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -95.05 5.63 51.34 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.193 1.183 . . . . 43.13 114.193 -175.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.31 138.26 57.5 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.556 -0.858 . . . . 34.49 112.28 -176.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 74.0 p -136.29 148.58 48.04 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 114.775 -1.102 . . . . 36.92 108.688 173.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -150.46 132.62 15.37 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.225 -0.657 . . . . 59.7 109.225 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -89.44 142.54 27.57 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.559 1.162 . . . . 69.61 110.006 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -107.75 163.5 13.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.516 0.674 . . . . 50.74 111.964 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 p -59.17 -36.34 75.13 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.124 -0.943 . . . . 65.44 111.31 -175.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 53.5 p30 -76.43 4.78 8.35 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.927 0.714 . . . . 58.6 112.927 -176.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.72 -8.03 80.64 Favored Glycine 0 C--O 1.243 0.669 0 N-CA-C 116.028 1.171 . . . . 42.17 116.028 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 91.4 p -80.03 167.94 19.8 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.519 1.152 . . . . 34.91 111.03 171.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 90.7 m -134.96 142.12 46.41 Favored 'General case' 0 C--O 1.245 0.852 0 N-CA-C 108.159 -1.052 . . . . 33.48 108.159 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -98.01 139.84 33.24 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.215 1.006 . . . . 44.13 110.765 174.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -129.89 129.36 43.81 Favored 'General case' 0 C--N 1.348 0.543 0 N-CA-C 112.392 0.516 . . . . 33.81 112.392 -167.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.41 -166.91 30.89 Favored Glycine 0 C--N 1.318 -0.424 0 CA-C-O 122.711 1.173 . . . . 30.71 115.849 161.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.4 tp -60.13 -32.01 49.42 Favored 'Isoleucine or valine' 0 C--O 1.246 0.91 0 CA-C-N 114.116 -1.042 . . . . 47.07 113.215 -175.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 71.5 mt -113.73 16.31 18.57 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.006 0.743 . . . . 37.02 113.006 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 49.86 58.61 5.26 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 122.634 1.206 . . . . 34.51 112.442 169.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 68.2 mt -84.08 134.52 26.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.714 0 CA-C-N 114.075 -1.42 . . . . 40.56 110.515 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -91.83 139.46 30.64 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 113.359 0.874 . . . . 43.56 113.359 -164.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.2 p -77.81 -13.28 59.94 Favored 'General case' 0 C--N 1.347 0.494 0 N-CA-C 114.018 1.118 . . . . 38.35 114.018 -174.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 22.9 ttm-85 -72.02 -30.63 65.4 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 117.238 -1.785 . . . . 82.99 112.022 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -111.93 -37.06 5.22 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 115.106 1.521 . . . . 75.21 115.106 -176.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TRP . . . . . 0.453 ' CE2' HG12 ' A' ' 116' ' ' ILE . 82.2 m95 -112.73 -23.12 10.36 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 116.321 1.971 . . . . 39.31 116.321 -155.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 32.0 p -148.85 158.52 44.22 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 107.899 -1.149 . . . . 37.08 107.899 -175.158 64.428 81.764 97.076 103.532 2.036 104.404 -66.681 -59.103 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -105.86 123.23 47.63 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 116.488 -0.324 . . . . 55.27 110.411 -175.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 54.9 p30 -119.49 6.61 11.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.617 0.599 . . . . 35.72 112.617 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.9 6.25 77.9 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-O 119.192 -0.782 . . . . 46.54 114.631 170.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.8 ptt180 -141.11 16.56 2.26 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-N 118.367 1.083 . . . . 48.5 113.903 179.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.3 m -114.26 90.82 21.5 Favored Pre-proline 0 C--O 1.244 0.785 0 N-CA-C 106.769 -1.567 . . . . 51.09 106.769 177.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' PRO . . . . . 0.417 ' O ' ' O ' ' A' ' 301' ' ' HOH . 5.4 Cg_exo -46.52 -61.28 0.63 Allowed 'Trans proline' 0 C--N 1.35 0.637 0 N-CA-C 118.67 2.527 . . . . 74.72 118.67 -168.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -86.65 36.54 3.24 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 118.136 -1.983 . . . . 78.89 116.364 -170.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 90.5 p -102.05 147.15 26.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 122.143 0.973 . . . . 66.17 113.016 -158.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.73 169.34 11.73 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 122.567 1.175 . . . . 93.26 108.447 167.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -135.77 66.27 1.51 Allowed 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 105.056 -2.202 . . . . 49.31 105.056 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 53.5 mt -71.93 -23.97 61.55 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 113.996 1.11 . . . . 52.94 113.996 -168.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 88.8 m -89.66 -5.96 56.61 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 119.113 0.869 . . . . 37.94 111.243 174.447 -66.891 172.915 80.482 103.675 2.044 106.117 54.145 -173.745 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 60.04 48.78 8.22 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.617 1.167 . . . . 60.01 111.723 174.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.5 pt -142.52 151.5 57.69 Favored Pre-proline 0 C--O 1.238 0.495 0 CA-C-N 115.51 -0.768 . . . . 59.47 109.142 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.48 143.0 50.76 Favored 'Trans proline' 0 C--N 1.32 -0.959 0 N-CA-C 110.385 -0.66 . . . . 45.03 110.385 165.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 80.1 m -61.26 -27.2 68.29 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 119.69 -0.804 . . . . 34.29 111.863 -177.092 -59.103 -66.681 97.076 104.404 2.036 103.532 81.764 64.428 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 96.9 p -61.37 -26.96 68.18 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.977 -0.689 . . . . 39.54 111.882 177.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.28 -21.33 66.71 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 119.039 -1.064 . . . . 37.34 111.956 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 81.2 mt -80.89 -3.64 52.07 Favored 'General case' 0 C--O 1.245 0.857 0 N-CA-C 114.216 1.191 . . . . 44.49 114.216 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.0 mt -100.99 -1.19 34.99 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 113.208 0.818 . . . . 45.2 113.208 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.6 t -60.8 153.59 24.04 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.921 0.867 . . . . 46.22 112.698 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 73.3 p -71.12 -14.8 62.42 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.729 -0.669 . . . . 53.8 112.573 172.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -88.89 117.5 27.93 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 106.745 -1.576 . . . . 58.02 106.745 170.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.9 pt -83.1 4.15 2.5 Favored 'Isoleucine or valine' 0 C--O 1.248 0.999 0 C-N-CA 120.066 -0.654 . . . . 40.23 112.444 -172.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 47.5 m -58.15 -44.21 87.74 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 118.444 0.566 . . . . 46.24 111.108 -169.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.52 -37.94 86.12 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.131 -1.028 . . . . 43.83 111.176 -176.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.8 m -64.73 -40.7 95.77 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 120.857 -0.337 . . . . 37.14 111.485 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 41.4 t -66.29 -45.14 90.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-O 121.118 0.485 . . . . 40.32 110.341 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.75 -39.58 92.11 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 119.439 -0.905 . . . . 54.33 110.779 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 49.6 t -72.07 -40.07 68.56 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 122.059 -0.4 . . . . 34.74 111.036 179.397 -173.745 54.145 80.482 106.117 2.044 103.675 172.915 -66.891 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.31 -38.25 71.01 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 112.56 0.578 . . . . 34.33 112.56 174.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -63.27 -33.6 75.85 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.168 -1.013 . . . . 51.17 112.07 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -71.97 -38.54 69.72 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 120.035 -0.666 . . . . 74.66 110.801 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ILE . . . . . 0.453 HG12 ' CE2' ' A' ' 81' ' ' TRP . 89.8 mt -64.49 -48.47 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 120.159 -0.616 . . . . 35.46 110.838 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.0 p -69.0 -14.51 18.62 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 O-C-N 121.277 -0.89 . . . . 39.33 111.593 -173.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 70.6 m -92.49 -1.94 56.6 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 113.095 0.776 . . . . 50.68 113.095 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -86.37 4.0 41.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 118.756 -0.64 . . . . 62.98 112.686 -167.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 121.84 -28.92 5.76 Favored Glycine 0 C--N 1.336 0.581 0 CA-C-N 118.711 0.687 . . . . 49.29 114.346 171.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -103.64 5.76 36.64 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 118.189 0.994 . . . . 63.97 113.003 -175.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 58.09 -145.7 40.58 Favored Glycine 0 CA--C 1.501 -0.824 0 N-CA-C 110.21 -1.156 . . . . 33.14 110.21 174.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 56.4 mtp -80.08 1.15 29.0 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.968 0.729 . . . . 33.02 112.968 -175.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 -65.57 -13.74 59.63 Favored 'General case' 0 C--N 1.346 0.455 0 CA-C-N 119.021 0.828 . . . . 36.47 111.953 174.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.24 -23.33 63.99 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.889 0.7 . . . . 38.9 112.889 171.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -99.91 112.17 24.45 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.383 0.992 . . . . 36.01 109.189 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 56.5 t -62.65 -39.1 83.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.161 -0.472 . . . . 51.48 110.647 -171.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.45 -33.52 75.32 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.566 -0.854 . . . . 34.45 111.753 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 91.6 t90 -63.98 -47.67 79.44 Favored 'General case' 0 CA--C 1.511 -0.54 0 C-N-CA 119.01 -1.076 . . . . 34.05 110.465 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 25.9 ttp-105 -56.9 -44.15 82.06 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 116.46 -0.336 . . . . 68.5 111.161 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -90.65 -17.67 26.45 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 114.243 1.201 . . . . 41.28 114.243 -172.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -128.79 -12.21 4.82 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 115.373 1.62 . . . . 42.53 115.373 -172.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 58.1 m -118.67 -42.8 2.72 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 113.71 1.004 . . . . 32.91 113.71 -179.507 -54.658 -79.255 -94.498 102.202 2.022 104.265 -89.933 -177.39 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -54.88 130.17 40.22 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 122.883 0.473 . . . . 38.81 110.54 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 77.55 7.25 87.14 Favored Glycine 0 CA--C 1.507 -0.447 0 N-CA-C 115.152 0.821 . . . . 46.25 115.152 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 10.4 p -106.69 174.13 6.02 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 118.512 1.156 . . . . 48.97 108.049 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -80.65 87.46 5.79 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 107.462 -1.31 . . . . 59.74 107.462 178.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 15.7 m -78.91 -17.71 13.28 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 C-N-CA 119.328 -0.949 . . . . 45.57 111.85 -173.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -61.27 -26.04 67.5 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 120.19 -0.604 . . . . 95.12 111.599 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -53.22 -26.15 16.62 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.301 -0.56 . . . . 47.66 111.931 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -74.34 -17.84 60.78 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 113.178 0.807 . . . . 44.34 113.178 -174.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 39.7 pt -112.33 3.46 8.43 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 113.271 0.841 . . . . 54.26 113.271 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 6.5 mtt85 -66.23 143.42 57.24 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 119.017 0.826 . . . . 78.01 110.245 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 82.9 -9.9 58.84 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-O 118.675 -1.07 . . . . 53.03 115.277 -178.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 39.5 m -87.99 144.05 26.75 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 118.956 1.378 . . . . 47.09 111.005 -176.853 -52.364 -62.267 -69.687 104.448 2.006 105.002 -61.601 -63.19 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -88.08 109.64 20.02 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 107.352 -1.351 . . . . 81.5 107.352 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 17.7 mt . . . . . 0 C--O 1.236 0.373 0 O-C-N 123.422 0.451 . . . . 72.88 111.73 -177.393 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.417 ' O ' ' O ' ' A' ' 88' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.6 tttt . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 109.72 -0.474 . . . . 62.95 109.72 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 79.9 t -106.54 106.6 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 107.451 -1.314 . . . . 41.94 107.451 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -71.04 151.94 44.05 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 121.658 0.742 . . . . 45.1 110.405 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -82.95 161.35 39.79 Favored Glycine 0 C--N 1.353 1.476 0 C-N-CA 120.197 -1.002 . . . . 41.99 111.761 158.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.1 ttp85 -56.36 -54.88 40.29 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.882 -0.659 . . . . 53.99 111.765 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 73.8 m -73.08 -33.46 65.64 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 119.576 -0.85 . . . . 42.99 112.181 -178.322 -63.19 -61.601 -69.687 105.002 2.006 104.448 -62.267 -52.364 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -55.69 -44.58 77.51 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.757 -0.777 . . . . 53.61 111.172 173.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 63.4 tp -70.16 -42.77 72.06 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.676 -0.64 . . . . 37.93 111.177 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -51.96 -44.06 63.81 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.654 -0.418 . . . . 35.34 110.432 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.06 -37.69 72.5 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 120.107 -0.637 . . . . 39.01 111.25 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.64 89.4 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.689 -0.804 . . . . 40.79 111.767 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 34.2 mtt -65.84 -40.38 91.7 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 119.753 -0.779 . . . . 41.03 110.947 179.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.2 tttt -63.43 -41.21 98.67 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 120.892 -0.323 . . . . 69.88 110.631 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -66.07 -28.52 68.9 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 118.943 -1.103 . . . . 71.37 111.452 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -90.96 12.69 18.83 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.912 0.708 . . . . 51.04 112.912 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.01 16.77 46.36 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 116.031 1.172 . . . . 51.04 116.031 167.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.9 mt -89.22 -15.11 34.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 114.713 1.375 . . . . 46.3 114.713 -174.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -71.8 120.94 18.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 120.405 1.457 . . . . 60.22 109.03 -177.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 64.8 19.84 11.95 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.622 1.169 . . . . 52.2 112.65 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.45 119.75 10.98 Favored 'General case' 0 C--O 1.245 0.846 0 O-C-N 121.524 -0.735 . . . . 48.98 109.677 175.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 9.4 mtp85 51.47 36.47 16.86 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.624 0.726 . . . . 76.02 112.717 -173.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.51 1.61 83.25 Favored Glycine 0 CA--C 1.508 -0.406 0 N-CA-C 115.911 1.125 . . . . 37.71 115.911 172.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -99.93 113.86 26.71 Favored 'General case' 0 C--O 1.244 0.78 0 CA-C-N 118.205 1.002 . . . . 34.86 110.084 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 96.1 p -66.74 162.29 21.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 122.129 0.966 . . . . 39.52 110.842 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.3 tp -56.76 -38.72 72.84 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-N 114.733 -1.121 . . . . 57.86 111.905 -173.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -55.24 -34.06 58.62 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 119.994 -1.098 . . . . 30.96 113.694 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -62.25 -43.31 99.12 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 121.61 -0.936 . . . . 34.71 111.081 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -69.38 -38.6 78.09 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 123.521 0.728 . . . . 37.82 111.141 -177.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 54.7 t -68.2 -43.99 84.44 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 O-C-N 121.409 -0.807 . . . . 34.88 111.206 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 47.9 t -58.47 -46.31 86.86 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 120.941 0.401 . . . . 29.63 110.322 177.37 -177.39 -89.933 -94.498 104.265 2.022 102.202 -79.255 -54.658 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.57 -42.43 92.45 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 120.542 -0.463 . . . . 31.88 111.618 179.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.3 -40.5 90.03 Favored 'General case' 0 C--O 1.245 0.855 0 C-N-CA 120.361 -0.535 . . . . 33.92 111.381 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -53.14 -51.48 61.82 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.512 0.673 . . . . 52.79 111.49 177.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -87.24 -16.73 34.37 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 118.769 -1.172 . . . . 39.98 112.899 -171.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -81.02 -38.59 27.21 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 118.919 -1.112 . . . . 37.94 112.201 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.1 p -135.56 -1.64 2.51 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 114.417 1.266 . . . . 35.49 114.417 -168.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.5 t30 50.21 38.31 17.01 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.27 1.028 . . . . 65.98 111.184 -169.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 69.08 20.56 7.65 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.7 1.2 . . . . 39.72 112.824 174.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 56.4 t-20 -104.14 116.69 32.65 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.719 -1.238 . . . . 35.47 109.494 -174.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.1 p -67.47 -17.02 64.53 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 118.421 -1.311 . . . . 35.25 111.761 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -95.05 5.63 51.34 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.193 1.183 . . . . 43.13 114.193 -175.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.31 138.26 57.5 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.556 -0.858 . . . . 34.49 112.28 -176.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 74.0 p -136.29 148.58 48.04 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 114.775 -1.102 . . . . 36.92 108.688 173.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -150.46 132.62 15.37 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.225 -0.657 . . . . 59.7 109.225 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -89.44 142.54 27.57 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.559 1.162 . . . . 69.61 110.006 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -107.75 163.5 13.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.516 0.674 . . . . 50.74 111.964 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 p -59.17 -36.34 75.13 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.124 -0.943 . . . . 65.44 111.31 -175.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 53.5 p30 -76.43 4.78 8.35 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.927 0.714 . . . . 58.6 112.927 -176.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.72 -8.03 80.64 Favored Glycine 0 C--O 1.243 0.669 0 N-CA-C 116.028 1.171 . . . . 42.17 116.028 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 91.4 p -80.03 167.94 19.8 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.519 1.152 . . . . 34.91 111.03 171.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 90.7 m -134.96 142.12 46.41 Favored 'General case' 0 C--O 1.245 0.852 0 N-CA-C 108.159 -1.052 . . . . 33.48 108.159 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -98.01 139.84 33.24 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.215 1.006 . . . . 44.13 110.765 174.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -129.89 129.36 43.81 Favored 'General case' 0 C--N 1.348 0.543 0 N-CA-C 112.392 0.516 . . . . 33.81 112.392 -167.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.41 -166.91 30.89 Favored Glycine 0 C--N 1.318 -0.424 0 CA-C-O 122.711 1.173 . . . . 30.71 115.849 161.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.4 tp -60.13 -32.01 49.42 Favored 'Isoleucine or valine' 0 C--O 1.246 0.91 0 CA-C-N 114.116 -1.042 . . . . 47.07 113.215 -175.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 71.5 mt -113.73 16.31 18.57 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.006 0.743 . . . . 37.02 113.006 177.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 49.86 58.61 5.26 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 122.634 1.206 . . . . 34.51 112.442 169.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 68.2 mt -84.08 134.52 26.78 Favored 'Isoleucine or valine' 0 C--O 1.243 0.714 0 CA-C-N 114.075 -1.42 . . . . 40.56 110.515 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -91.83 139.46 30.64 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 113.359 0.874 . . . . 43.56 113.359 -164.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.2 p -77.81 -13.28 59.94 Favored 'General case' 0 C--N 1.347 0.494 0 N-CA-C 114.018 1.118 . . . . 38.35 114.018 -174.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 22.9 ttm-85 -72.02 -30.63 65.4 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 117.238 -1.785 . . . . 82.99 112.022 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -111.93 -37.06 5.22 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 115.106 1.521 . . . . 75.21 115.106 -176.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.453 ' CE2' HG12 ' A' ' 116' ' ' ILE . 82.2 m95 -112.73 -23.12 10.36 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 116.321 1.971 . . . . 39.31 116.321 -155.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 32.0 p -148.85 158.52 44.22 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 107.899 -1.149 . . . . 37.08 107.899 -175.158 64.428 81.764 97.076 103.532 2.036 104.404 -66.681 -59.103 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -105.86 123.23 47.63 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 116.488 -0.324 . . . . 55.27 110.411 -175.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 54.9 p30 -119.49 6.61 11.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.617 0.599 . . . . 35.72 112.617 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.9 6.25 77.9 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-O 119.192 -0.782 . . . . 46.54 114.631 170.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.8 ptt180 -141.11 16.56 2.26 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-N 118.367 1.083 . . . . 48.5 113.903 179.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.3 m -114.26 90.82 21.5 Favored Pre-proline 0 C--O 1.244 0.785 0 N-CA-C 106.769 -1.567 . . . . 51.09 106.769 177.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.417 ' O ' ' O ' ' A' ' 301' ' ' HOH . 5.4 Cg_exo -46.52 -61.28 0.63 Allowed 'Trans proline' 0 C--N 1.35 0.637 0 N-CA-C 118.67 2.527 . . . . 74.72 118.67 -168.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -86.65 36.54 3.24 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 118.136 -1.983 . . . . 78.89 116.364 -170.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 90.5 p -102.05 147.15 26.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 122.143 0.973 . . . . 66.17 113.016 -158.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.73 169.34 11.73 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 122.567 1.175 . . . . 93.26 108.447 167.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -135.77 66.27 1.51 Allowed 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 105.056 -2.202 . . . . 49.31 105.056 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 53.5 mt -71.93 -23.97 61.55 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 113.996 1.11 . . . . 52.94 113.996 -168.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 88.8 m -89.66 -5.96 56.61 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 119.113 0.869 . . . . 37.94 111.243 174.447 -66.891 172.915 80.482 103.675 2.044 106.117 54.145 -173.745 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 60.04 48.78 8.22 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.617 1.167 . . . . 60.01 111.723 174.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.5 pt -142.52 151.5 57.69 Favored Pre-proline 0 C--O 1.238 0.495 0 CA-C-N 115.51 -0.768 . . . . 59.47 109.142 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.48 143.0 50.76 Favored 'Trans proline' 0 C--N 1.32 -0.959 0 N-CA-C 110.385 -0.66 . . . . 45.03 110.385 165.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 80.1 m -61.26 -27.2 68.29 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 119.69 -0.804 . . . . 34.29 111.863 -177.092 -59.103 -66.681 97.076 104.404 2.036 103.532 81.764 64.428 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 96.9 p -61.37 -26.96 68.18 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.977 -0.689 . . . . 39.54 111.882 177.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.28 -21.33 66.71 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 119.039 -1.064 . . . . 37.34 111.956 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 81.2 mt -80.89 -3.64 52.07 Favored 'General case' 0 C--O 1.245 0.857 0 N-CA-C 114.216 1.191 . . . . 44.49 114.216 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.0 mt -100.99 -1.19 34.99 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 113.208 0.818 . . . . 45.2 113.208 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.6 t -60.8 153.59 24.04 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.921 0.867 . . . . 46.22 112.698 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 73.3 p -71.12 -14.8 62.42 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.729 -0.669 . . . . 53.8 112.573 172.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -88.89 117.5 27.93 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 106.745 -1.576 . . . . 58.02 106.745 170.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.9 pt -83.1 4.15 2.5 Favored 'Isoleucine or valine' 0 C--O 1.248 0.999 0 C-N-CA 120.066 -0.654 . . . . 40.23 112.444 -172.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 47.5 m -58.15 -44.21 87.74 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 118.444 0.566 . . . . 46.24 111.108 -169.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.52 -37.94 86.12 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.131 -1.028 . . . . 43.83 111.176 -176.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.8 m -64.73 -40.7 95.77 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 120.857 -0.337 . . . . 37.14 111.485 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 41.4 t -66.29 -45.14 90.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-O 121.118 0.485 . . . . 40.32 110.341 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.75 -39.58 92.11 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 119.439 -0.905 . . . . 54.33 110.779 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 49.6 t -72.07 -40.07 68.56 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 122.059 -0.4 . . . . 34.74 111.036 179.397 -173.745 54.145 80.482 106.117 2.044 103.675 172.915 -66.891 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.31 -38.25 71.01 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 112.56 0.578 . . . . 34.33 112.56 174.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -63.27 -33.6 75.85 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.168 -1.013 . . . . 51.17 112.07 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -71.97 -38.54 69.72 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 120.035 -0.666 . . . . 74.66 110.801 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.453 HG12 ' CE2' ' A' ' 81' ' ' TRP . 89.8 mt -64.49 -48.47 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 120.159 -0.616 . . . . 35.46 110.838 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.0 p -69.0 -14.51 18.62 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 O-C-N 121.277 -0.89 . . . . 39.33 111.593 -173.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 70.6 m -92.49 -1.94 56.6 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 113.095 0.776 . . . . 50.68 113.095 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -86.37 4.0 41.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 118.756 -0.64 . . . . 62.98 112.686 -167.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 121.84 -28.92 5.76 Favored Glycine 0 C--N 1.336 0.581 0 CA-C-N 118.711 0.687 . . . . 49.29 114.346 171.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -103.64 5.76 36.64 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 118.189 0.994 . . . . 63.97 113.003 -175.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 58.09 -145.7 40.58 Favored Glycine 0 CA--C 1.501 -0.824 0 N-CA-C 110.21 -1.156 . . . . 33.14 110.21 174.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 56.4 mtp -80.08 1.15 29.0 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.968 0.729 . . . . 33.02 112.968 -175.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 -65.57 -13.74 59.63 Favored 'General case' 0 C--N 1.346 0.455 0 CA-C-N 119.021 0.828 . . . . 36.47 111.953 174.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.24 -23.33 63.99 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.889 0.7 . . . . 38.9 112.889 171.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -99.91 112.17 24.45 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.383 0.992 . . . . 36.01 109.189 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 56.5 t -62.65 -39.1 83.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.161 -0.472 . . . . 51.48 110.647 -171.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.45 -33.52 75.32 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.566 -0.854 . . . . 34.45 111.753 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 91.6 t90 -63.98 -47.67 79.44 Favored 'General case' 0 CA--C 1.511 -0.54 0 C-N-CA 119.01 -1.076 . . . . 34.05 110.465 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 25.9 ttp-105 -56.9 -44.15 82.06 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 116.46 -0.336 . . . . 68.5 111.161 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -90.65 -17.67 26.45 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 114.243 1.201 . . . . 41.28 114.243 -172.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -128.79 -12.21 4.82 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 115.373 1.62 . . . . 42.53 115.373 -172.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 58.1 m -118.67 -42.8 2.72 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 113.71 1.004 . . . . 32.91 113.71 -179.507 -54.658 -79.255 -94.498 102.202 2.022 104.265 -89.933 -177.39 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -54.88 130.17 40.22 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 122.883 0.473 . . . . 38.81 110.54 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 77.55 7.25 87.14 Favored Glycine 0 CA--C 1.507 -0.447 0 N-CA-C 115.152 0.821 . . . . 46.25 115.152 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 10.4 p -106.69 174.13 6.02 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 118.512 1.156 . . . . 48.97 108.049 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -80.65 87.46 5.79 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 107.462 -1.31 . . . . 59.74 107.462 178.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 15.7 m -78.91 -17.71 13.28 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 C-N-CA 119.328 -0.949 . . . . 45.57 111.85 -173.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -61.27 -26.04 67.5 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 120.19 -0.604 . . . . 95.12 111.599 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -53.22 -26.15 16.62 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.301 -0.56 . . . . 47.66 111.931 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -74.34 -17.84 60.78 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 113.178 0.807 . . . . 44.34 113.178 -174.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 39.7 pt -112.33 3.46 8.43 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 113.271 0.841 . . . . 54.26 113.271 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 6.5 mtt85 -66.23 143.42 57.24 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 119.017 0.826 . . . . 78.01 110.245 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 82.9 -9.9 58.84 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-O 118.675 -1.07 . . . . 53.03 115.277 -178.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 39.5 m -87.99 144.05 26.75 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 118.956 1.378 . . . . 47.09 111.005 -176.853 -52.364 -62.267 -69.687 104.448 2.006 105.002 -61.601 -63.19 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -88.08 109.64 20.02 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 107.352 -1.351 . . . . 81.5 107.352 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 17.7 mt . . . . . 0 C--O 1.236 0.373 0 O-C-N 123.422 0.451 . . . . 72.88 111.73 -177.393 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.417 ' O ' ' O ' ' A' ' 88' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_