data_5oq0_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5oq0 _Structure_validation_residue.Date_analyzed 2017-12-23 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 ' 10' ' ' CYS . . . . . 0.773 ' SG ' ' O ' ' A' ' 226' ' ' HOH . 0.4 OUTLIER . . . . . 0 CA--C 1.506 -0.731 0 N-CA-C 110.334 -0.247 . . . . 61.119999999999997 110.334 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -70.31 -18.79 34.18 Favored 'Trans proline' 0 C--O 1.236 0.401 0 CA-C-O 118.385 -0.756 . . . . 43.060000000000002 113.731 176.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.2 tp -141.8 123.09 14.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 119.332 0.969 . . . . 38.280000000000001 109.235 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.3 tmm? -129.45 147.27 51.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.038 -1.097 . . . . 75.939999999999998 108.038 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 58.8 t -125.9 133.37 69.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 107.423 -1.325 . . . . 35.850000000000001 107.423 178.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -132.2 133.36 44.1 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.63 -0.878 . . . . 59.5 108.63 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.1 t -127.54 129.11 70.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 107.319 -1.363 . . . . 40.340000000000003 107.319 -170.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.59 146.2 44.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.519 0.676 . . . . 55.280000000000001 109.686 175.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -93.93 101.61 13.69 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 104.776 -2.305 . . . . 51.509999999999998 104.776 176.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.3 -16.65 59.73 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 120.213 -0.595 . . . . 61.670000000000002 112.203 -170.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.18 -44.75 36.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 O-C-N 123.669 0.606 . . . . 63.380000000000003 110.54 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.1 mtm180 -96.0 -8.45 33.63 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.634 0.605 . . . . 87.019999999999996 112.634 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 63.65 54.17 33.32 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 118.149 0.432 . . . . 42.060000000000002 112.08 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 57.8 p -156.33 160.43 30.76 Favored Pre-proline 0 C--O 1.239 0.519 0 C-N-CA 119.148 -1.021 . . . . 52.869999999999997 108.548 -176.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.57 148.37 87.67 Favored 'Trans proline' 0 C--N 1.319 -1.019 0 N-CA-C 109.983 -0.814 . . . . 41.310000000000002 109.983 176.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.19 109.23 22.03 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.542 -1.651 . . . . 36.880000000000003 106.542 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 79.1 mt -97.17 132.63 41.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 N-CA-C 108.577 -0.898 . . . . 47.020000000000003 108.577 -167.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.7 m120 66.95 35.05 4.93 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.946 1.298 . . . . 83.890000000000001 113.27 175.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.2 t -80.3 136.94 22.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.416 -0.957 . . . . 46.390000000000001 108.416 170.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.66 139.55 40.6 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 109.753 -0.462 . . . . 42.869999999999997 109.753 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 86.5 t -135.35 121.76 32.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 107.673 -1.232 . . . . 36.619999999999997 107.673 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -115.25 135.58 54.01 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 109.439 -0.578 . . . . 41.100000000000001 109.439 173.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.3 t -114.06 137.95 45.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.677 0 N-CA-C 109.165 -0.68 . . . . 41.710000000000001 109.165 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -126.42 155.45 42.16 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 107.995 -1.113 . . . . 43.140000000000001 107.995 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 65.7 ttt-85 -126.21 124.91 41.5 Favored 'General case' 0 C--O 1.189 -2.129 0 N-CA-C 108.519 -0.919 . . . . 56.609999999999999 108.519 178.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . 0.848 ' NZ ' ' O ' ' A' ' 202' ' ' HOH . 0.4 OUTLIER -61.01 119.72 8.85 Favored 'General case' 0 C--O 1.188 -2.161 0 CA-C-O 121.576 0.703 . . . . 69.579999999999998 111.449 -178.624 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.67 169.56 17.47 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 122.055 0.931 . . . . 71.5 112.699 -178.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . 0.801 ' CB ' ' O ' ' A' ' 219' ' ' HOH . . . -57.43 -40.03 77.48 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-N 114.93 -1.032 . . . . 81.030000000000001 112.471 179.525 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -89.0 40.39 0.98 Allowed 'General case' 0 C--O 1.206 -1.199 0 N-CA-C 114.657 1.354 . . . . 95.0 114.657 178.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.6 t70 58.63 10.1 1.32 Allowed 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 120.535 3.532 . . . . 104.22 120.535 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.3 p -102.61 156.44 17.62 Favored 'General case' 0 C--N 1.294 -1.836 0 O-C-N 120.184 -1.573 . . . . 71.329999999999998 111.469 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 73.8 m95 -84.88 101.99 12.74 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.706 -0.679 . . . . 66.599999999999994 109.398 179.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -83.97 123.96 75.11 Favored Pre-proline 0 C--O 1.24 0.584 0 CA-C-N 115.702 -0.681 . . . . 75.430000000000007 109.622 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -60.77 134.38 53.54 Favored 'Trans proline' 0 C--O 1.236 0.39 0 CA-C-N 119.719 0.936 . . . . 47.009999999999998 111.968 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -117.91 -53.49 2.38 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.878 -0.601 . . . . 39.380000000000003 112.165 -172.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -162.34 164.03 27.62 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 107.851 -1.166 . . . . 39.240000000000002 107.851 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.3 p -157.17 162.43 39.34 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.846 -0.615 . . . . 38.659999999999997 109.521 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.89 -169.31 36.66 Favored Glycine 0 C--N 1.335 0.518 0 N-CA-C 110.921 -0.872 . . . . 34.509999999999998 110.921 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -127.17 141.4 51.76 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.286 1.035 . . . . 75.349999999999994 109.918 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.0 p -67.62 150.41 48.8 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 118.839 -1.144 . . . . 38.700000000000003 110.136 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.4 p -90.99 -167.85 1.92 Allowed 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.723 -1.214 . . . . 54.350000000000001 107.723 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -69.86 -19.11 63.45 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 119.255 -0.978 . . . . 92.760000000000005 112.634 -176.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 96.0 p -83.52 -0.24 49.41 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 112.685 0.624 . . . . 45.439999999999998 112.685 173.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.28 4.28 90.49 Favored Glycine 0 N--CA 1.443 -0.882 0 CA-C-O 119.08 -0.845 . . . . 42.549999999999997 114.727 -174.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -105.93 151.69 24.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 118.322 1.061 . . . . 48.640000000000001 111.011 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.4 tp -127.78 111.14 13.32 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.702 -1.592 . . . . 35.380000000000003 106.702 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -110.2 161.88 15.14 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.858 0.863 . . . . 50.039999999999999 110.207 -179.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.48 18.24 76.23 Favored Glycine 0 N--CA 1.442 -0.963 0 CA-C-N 114.553 -1.203 . . . . 42.310000000000002 113.739 173.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.43 -43.73 93.04 Favored 'General case' 0 C--O 1.245 0.842 0 CA-C-N 118.212 1.006 . . . . 43.640000000000001 111.231 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.2 t -146.82 -176.73 5.31 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 119.346 -0.942 . . . . 44.390000000000001 109.87 -174.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 78.7 p -120.01 162.41 19.28 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.918 -1.037 . . . . 48.189999999999998 109.201 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -63.17 -29.32 70.69 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.868 -0.605 . . . . 92.269999999999996 111.578 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.1 mp0 -69.98 -40.7 75.19 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 118.195 0.452 . . . . 66.900000000000006 111.811 176.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -82.25 -26.78 32.91 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 112.554 0.575 . . . . 62.82 112.554 -174.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -88.14 74.32 8.83 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 122.69 1.233 . . . . 40.75 109.667 -167.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.7 m -79.08 174.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.035 -0.984 . . . . 45.649999999999999 111.785 -176.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.41 141.8 14.8 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.746 -0.661 . . . . 67.060000000000002 109.622 169.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 168.41 179.34 40.7 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 117.626 -2.226 . . . . 47.729999999999997 112.772 172.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 13.3 mt -98.38 121.22 48.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 107.371 -1.344 . . . . 45.450000000000003 107.371 170.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -120.01 137.81 53.87 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.312 0.645 . . . . 42.100000000000001 110.541 -174.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -111.08 129.22 55.99 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.384 -0.969 . . . . 57.740000000000002 108.384 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.2 t -112.11 113.65 44.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 107.03 -1.47 . . . . 46.130000000000003 107.03 175.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . 0.727 ' OE2' ' O ' ' A' ' 201' ' ' HOH . 91.5 mt-10 -103.09 121.18 42.07 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 106.933 -1.506 . . . . 78.260000000000005 106.933 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 26.8 mt -109.8 121.73 63.22 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 106.434 -1.691 . . . . 42.780000000000001 106.434 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . 0.901 ' CB ' ' O ' ' A' ' 223' ' ' HOH . 10.6 m-20 -96.14 88.15 4.75 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 123.28 1.514 . . . . 77.25 108.3 -170.908 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 30.9 p -73.53 -37.64 65.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 112.643 -2.071 . . . . 82.569999999999993 111.117 -174.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -47.94 -49.0 31.72 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 112.139 0.422 . . . . 83.269999999999996 112.139 -172.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.6 m -74.09 -25.88 60.06 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.448 0.536 . . . . 72.629999999999995 112.448 -174.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -67.88 -42.72 80.8 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.698 -0.401 . . . . 70.090000000000003 111.228 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -62.08 -35.24 78.08 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.694 -0.402 . . . . 82.170000000000002 111.617 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -62.7 -40.57 97.56 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 119.769 -0.772 . . . . 93.510000000000005 110.969 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.41 -19.65 63.67 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 119.637 -0.825 . . . . 70.569999999999993 111.79 175.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.9 mt -103.46 10.93 37.0 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.007 0.523 . . . . 59.810000000000002 112.351 176.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.46 25.97 57.9 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-O 119.457 -0.635 . . . . 67.280000000000001 114.133 174.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 84.1 mt -120.34 140.57 43.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 117.95 0.875 . . . . 64.5 109.739 -175.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . 0.649 ' OG ' ' O ' ' A' ' 204' ' ' HOH . 74.6 m -102.9 114.92 64.94 Favored Pre-proline 0 C--O 1.243 0.713 0 N-CA-C 109.176 -0.676 . . . . 87.230000000000004 109.176 165.03 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -88.47 171.7 5.16 Favored 'Trans proline' 0 C--N 1.322 -0.822 0 C-N-CA 121.323 1.349 . . . . 65.870000000000005 112.399 -172.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 43.6 tpp -85.91 -56.01 3.68 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.907 -1.042 . . . . 101.73999999999999 111.233 174.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HIS . . . . . 0.671 ' O ' ' O ' ' A' ' 203' ' ' HOH . 19.6 m-70 -68.12 133.69 49.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.114 0.483 . . . . 82.780000000000001 110.852 177.739 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -64.23 -45.99 85.8 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.378 -0.929 . . . . 83.170000000000002 110.529 171.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -153.28 -179.52 7.8 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.707 0.765 . . . . 82.239999999999995 109.413 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.76 143.55 50.23 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.191 -0.913 . . . . 55.880000000000003 109.144 170.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -133.55 146.05 50.66 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.525 0.679 . . . . 72.269999999999996 109.975 -178.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 13.9 t -130.31 120.57 49.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 N-CA-C 106.237 -1.764 . . . . 56.0 106.237 166.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.6 t -119.09 109.4 26.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.512 0 N-CA-C 106.669 -1.604 . . . . 57.030000000000001 106.669 -179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 36.9 p90 -136.12 156.67 48.36 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.485 0.66 . . . . 50.25 110.363 -171.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 39.2 m -93.63 139.07 31.21 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.887 -0.783 . . . . 60.710000000000001 108.887 175.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -123.7 147.62 47.28 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.572 0.701 . . . . 57.329999999999998 111.824 -171.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 55.08 20.61 3.36 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.972 1.309 . . . . 62.07 112.33 175.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -52.02 -27.78 14.78 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.653 0.612 . . . . 92.030000000000001 112.653 -175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.7 p -130.66 42.76 3.21 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 122.984 0.514 . . . . 85.319999999999993 110.774 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 98.71 160.21 29.8 Favored Glycine 0 N--CA 1.443 -0.838 0 N-CA-C 110.461 -1.056 . . . . 65.290000000000006 110.461 -169.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.56 145.57 58.71 Favored 'Trans proline' 0 C--O 1.236 0.378 0 CA-C-N 117.428 0.614 . . . . 72.870000000000005 112.167 -176.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.7 mmt-85 -128.42 172.52 11.04 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.425 -0.954 . . . . 66.049999999999997 108.425 172.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 26.5 mtp180 -97.59 128.54 44.39 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.626 -1.25 . . . . 83.730000000000004 107.626 163.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -115.2 134.76 54.86 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 109.737 -0.468 . . . . 44.560000000000002 109.737 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 48.5 m -117.56 117.65 30.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.06 -1.459 . . . . 42.950000000000003 107.06 166.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 40.7 mm -92.3 121.61 43.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 106.203 -1.777 . . . . 37.189999999999998 106.203 172.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -113.7 135.07 54.34 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.112 -0.699 . . . . 44.049999999999997 109.112 -175.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -132.62 123.12 25.8 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 110.229 -0.285 . . . . 43.07 110.229 -175.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 35.3 mtt -105.28 125.49 51.04 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 123.23 0.331 . . . . 92.859999999999999 110.522 165.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 49.6 mt -112.66 165.01 12.67 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 122.405 1.098 . . . . 55.200000000000003 111.177 -171.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.2 t -163.18 166.33 13.26 Favored Pre-proline 0 C--O 1.242 0.664 0 CA-C-N 112.868 -1.969 . . . . 63.200000000000003 106.871 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -66.33 -18.58 55.52 Favored 'Trans proline' 0 C--O 1.233 0.258 0 CA-C-O 118.185 -0.84 . . . . 74.879999999999995 114.178 169.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -130.27 -12.62 4.01 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 115.495 1.665 . . . . 97.170000000000002 115.495 -176.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.2 t -129.68 162.16 28.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 119.56 1.073 . . . . 68.150000000000006 109.343 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -162.08 129.84 4.0 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 119.181 -1.008 . . . . 76.409999999999997 111.754 162.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -90.18 143.03 27.14 Favored 'General case' 0 CA--C 1.506 -0.739 0 C-N-CA 123.725 0.81 . . . . 96.379999999999995 111.431 163.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.1 t -126.98 149.1 50.03 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.049 -0.978 . . . . 59.43 109.035 157.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 3.8 m -138.14 139.45 39.42 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.065 -0.516 . . . . 65.790000000000006 109.824 170.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -98.55 111.74 24.0 Favored 'General case' 0 C--N 1.343 0.324 0 N-CA-C 107.834 -1.172 . . . . 53.689999999999998 107.834 170.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 89.8 t -105.06 115.95 47.93 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 N-CA-C 107.548 -1.279 . . . . 44.340000000000003 107.548 -175.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.7 m -117.23 137.73 50.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.409 0.623 . . . . 65.689999999999998 109.434 -169.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 61.3 p -144.2 174.88 10.51 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.452 -1.314 . . . . 67.709999999999994 107.452 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -116.91 162.37 27.75 Favored Pre-proline 0 C--O 1.238 0.452 0 CA-C-N 116.48 -0.327 . . . . 94.420000000000002 110.437 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo . . . . . 0 C--N 1.348 0.513 0 C-N-CA 122.118 1.879 . . . . 104.91 112.461 170.546 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.727 ' O ' ' OE2' ' A' ' 72' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.848 ' O ' ' NZ ' ' A' ' 35' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.671 ' O ' ' O ' ' A' ' 88' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.649 ' O ' ' OG ' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . 0.801 ' O ' ' CB ' ' A' ' 37' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . 0.901 ' O ' ' CB ' ' A' ' 74' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . 0.773 ' O ' ' SG ' ' A' ' 10' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' CYS . . . . . 0.773 ' SG ' ' O ' ' A' ' 226' ' ' HOH . 0.4 OUTLIER . . . . . 0 CA--C 1.506 -0.731 0 N-CA-C 110.334 -0.247 . . . . 61.119999999999997 110.334 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . 0.449 ' HB2' ' CD2' ' A' ' 64' ' ' PHE . 27.1 Cg_endo -70.31 -18.79 34.18 Favored 'Trans proline' 0 C--O 1.236 0.401 0 CA-C-O 118.385 -0.756 . . . . 43.060000000000002 113.731 176.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.2 tp -141.8 123.09 14.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 119.332 0.969 . . . . 38.280000000000001 109.235 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.3 tmm? -129.45 147.27 51.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.038 -1.097 . . . . 75.939999999999998 108.038 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 58.8 t -125.9 133.37 69.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 107.423 -1.325 . . . . 35.850000000000001 107.423 178.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -132.2 133.36 44.1 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.63 -0.878 . . . . 59.5 108.63 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.1 t -127.54 129.11 70.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 107.319 -1.363 . . . . 40.340000000000003 107.319 -170.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.59 146.2 44.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.519 0.676 . . . . 55.280000000000001 109.686 175.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -93.93 101.61 13.69 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 104.776 -2.305 . . . . 51.509999999999998 104.776 176.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.3 -16.65 59.73 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 120.213 -0.595 . . . . 61.670000000000002 112.203 -170.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.18 -44.75 36.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 O-C-N 123.669 0.606 . . . . 63.380000000000003 110.54 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.1 mtm180 -96.0 -8.45 33.63 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.634 0.605 . . . . 87.019999999999996 112.634 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 63.65 54.17 33.32 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 118.149 0.432 . . . . 42.060000000000002 112.08 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 57.8 p -156.33 160.43 30.76 Favored Pre-proline 0 C--O 1.239 0.519 0 C-N-CA 119.148 -1.021 . . . . 52.869999999999997 108.548 -176.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.57 148.37 87.67 Favored 'Trans proline' 0 C--N 1.319 -1.019 0 N-CA-C 109.983 -0.814 . . . . 41.310000000000002 109.983 176.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.19 109.23 22.03 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.542 -1.651 . . . . 36.880000000000003 106.542 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 79.1 mt -97.17 132.63 41.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 N-CA-C 108.577 -0.898 . . . . 47.020000000000003 108.577 -167.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.7 m120 66.95 35.05 4.93 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.946 1.298 . . . . 83.890000000000001 113.27 175.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.2 t -80.3 136.94 22.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.416 -0.957 . . . . 46.390000000000001 108.416 170.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.66 139.55 40.6 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 109.753 -0.462 . . . . 42.869999999999997 109.753 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 86.5 t -135.35 121.76 32.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 107.673 -1.232 . . . . 36.619999999999997 107.673 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -115.25 135.58 54.01 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 109.439 -0.578 . . . . 41.100000000000001 109.439 173.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.3 t -114.06 137.95 45.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.677 0 N-CA-C 109.165 -0.68 . . . . 41.710000000000001 109.165 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -126.42 155.45 42.16 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 107.995 -1.113 . . . . 43.140000000000001 107.995 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 65.7 ttt-85 -126.21 124.91 41.5 Favored 'General case' 0 C--O 1.189 -2.129 0 N-CA-C 108.519 -0.919 . . . . 56.609999999999999 108.519 178.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . 0.848 ' NZ ' ' O ' ' A' ' 202' ' ' HOH . 0.4 OUTLIER -61.01 119.72 8.85 Favored 'General case' 0 C--O 1.188 -2.161 0 CA-C-O 121.576 0.703 . . . . 69.579999999999998 111.449 -178.624 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.67 169.56 17.47 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 122.055 0.931 . . . . 71.5 112.699 -178.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . 0.851 ' HB3' ' O ' ' A' ' 219' ' ' HOH . . . -57.43 -40.03 77.48 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-N 114.93 -1.032 . . . . 81.030000000000001 112.471 179.525 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . 0.406 ' O ' HG23 ' A' ' 40' ' ' THR . 2.9 p30 -89.0 40.39 0.98 Allowed 'General case' 0 C--O 1.206 -1.199 0 N-CA-C 114.657 1.354 . . . . 95.0 114.657 178.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.6 t70 58.63 10.1 1.32 Allowed 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 120.535 3.532 . . . . 104.22 120.535 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 38' ' ' ASP . 60.3 p -102.61 156.44 17.62 Favored 'General case' 0 C--N 1.294 -1.836 0 O-C-N 120.184 -1.573 . . . . 71.329999999999998 111.469 -175.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 73.8 m95 -84.88 101.99 12.74 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.706 -0.679 . . . . 66.599999999999994 109.398 179.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -83.97 123.96 75.11 Favored Pre-proline 0 C--O 1.24 0.584 0 CA-C-N 115.702 -0.681 . . . . 75.430000000000007 109.622 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -60.77 134.38 53.54 Favored 'Trans proline' 0 C--O 1.236 0.39 0 CA-C-N 119.719 0.936 . . . . 47.009999999999998 111.968 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -117.91 -53.49 2.38 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.878 -0.601 . . . . 39.380000000000003 112.165 -172.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -162.34 164.03 27.62 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 107.851 -1.166 . . . . 39.240000000000002 107.851 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.3 p -157.17 162.43 39.34 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.846 -0.615 . . . . 38.659999999999997 109.521 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.89 -169.31 36.66 Favored Glycine 0 C--N 1.335 0.518 0 N-CA-C 110.921 -0.872 . . . . 34.509999999999998 110.921 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -127.17 141.4 51.76 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.286 1.035 . . . . 75.349999999999994 109.918 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.0 p -67.62 150.41 48.8 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 118.839 -1.144 . . . . 38.700000000000003 110.136 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.4 p -90.99 -167.85 1.92 Allowed 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.723 -1.214 . . . . 54.350000000000001 107.723 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -69.86 -19.11 63.45 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 119.255 -0.978 . . . . 92.760000000000005 112.634 -176.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 96.0 p -83.52 -0.24 49.41 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 112.685 0.624 . . . . 45.439999999999998 112.685 173.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.28 4.28 90.49 Favored Glycine 0 N--CA 1.443 -0.882 0 CA-C-O 119.08 -0.845 . . . . 42.549999999999997 114.727 -174.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -105.93 151.69 24.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 118.322 1.061 . . . . 48.640000000000001 111.011 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.4 tp -127.78 111.14 13.32 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.702 -1.592 . . . . 35.380000000000003 106.702 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -110.2 161.88 15.14 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.858 0.863 . . . . 50.039999999999999 110.207 -179.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.48 18.24 76.23 Favored Glycine 0 N--CA 1.442 -0.963 0 CA-C-N 114.553 -1.203 . . . . 42.310000000000002 113.739 173.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.43 -43.73 93.04 Favored 'General case' 0 C--O 1.245 0.842 0 CA-C-N 118.212 1.006 . . . . 43.640000000000001 111.231 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . 0.414 HG23 ' HG2' ' A' ' 11' ' ' PRO . 14.2 t -146.82 -176.73 5.31 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 119.346 -0.942 . . . . 44.390000000000001 109.87 -174.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 78.7 p -120.01 162.41 19.28 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.918 -1.037 . . . . 48.189999999999998 109.201 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -63.17 -29.32 70.69 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.868 -0.605 . . . . 92.269999999999996 111.578 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.1 mp0 -69.98 -40.7 75.19 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 118.195 0.452 . . . . 66.900000000000006 111.811 176.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -82.25 -26.78 32.91 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 112.554 0.575 . . . . 62.82 112.554 -174.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CD2' ' HB2' ' A' ' 11' ' ' PRO . 21.9 t80 -88.14 74.32 8.83 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 122.69 1.233 . . . . 40.75 109.667 -167.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.7 m -79.08 174.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.035 -0.984 . . . . 45.649999999999999 111.785 -176.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.41 141.8 14.8 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.746 -0.661 . . . . 67.060000000000002 109.622 169.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 168.41 179.34 40.7 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 117.626 -2.226 . . . . 47.729999999999997 112.772 172.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 13.3 mt -98.38 121.22 48.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 107.371 -1.344 . . . . 45.450000000000003 107.371 170.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -120.01 137.81 53.87 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.312 0.645 . . . . 42.100000000000001 110.541 -174.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -111.08 129.22 55.99 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.384 -0.969 . . . . 57.740000000000002 108.384 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.2 t -112.11 113.65 44.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 107.03 -1.47 . . . . 46.130000000000003 107.03 175.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . 0.727 ' OE2' ' O ' ' A' ' 201' ' ' HOH . 91.5 mt-10 -103.09 121.18 42.07 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 106.933 -1.506 . . . . 78.260000000000005 106.933 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 26.8 mt -109.8 121.73 63.22 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 106.434 -1.691 . . . . 42.780000000000001 106.434 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . 1.249 ' HB3' ' O ' ' A' ' 223' ' ' HOH . 10.6 m-20 -96.14 88.15 4.75 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 123.28 1.514 . . . . 77.25 108.3 -170.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 30.9 p -73.53 -37.64 65.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 112.643 -2.071 . . . . 82.569999999999993 111.117 -174.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HB3' ' HE2' ' A' ' 76' ' ' LYS . 16.3 ttpt -47.94 -49.0 31.72 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 112.139 0.422 . . . . 83.269999999999996 112.139 -172.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.6 m -74.09 -25.88 60.06 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.448 0.536 . . . . 72.629999999999995 112.448 -174.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -67.88 -42.72 80.8 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.698 -0.401 . . . . 70.090000000000003 111.228 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' TRP . . . . . 0.541 ' HB3' ' HB ' ' A' ' 84' ' ' ILE . 85.0 m95 -62.08 -35.24 78.08 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.694 -0.402 . . . . 82.170000000000002 111.617 175.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -62.7 -40.57 97.56 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 119.769 -0.772 . . . . 93.510000000000005 110.969 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.41 -19.65 63.67 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 119.637 -0.825 . . . . 70.569999999999993 111.79 175.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.9 mt -103.46 10.93 37.0 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.007 0.523 . . . . 59.810000000000002 112.351 176.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.46 25.97 57.9 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-O 119.457 -0.635 . . . . 67.280000000000001 114.133 174.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . 0.541 ' HB ' ' HB3' ' A' ' 79' ' ' TRP . 84.1 mt -120.34 140.57 43.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 117.95 0.875 . . . . 64.5 109.739 -175.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . 0.649 ' OG ' ' O ' ' A' ' 204' ' ' HOH . 74.6 m -102.9 114.92 64.94 Favored Pre-proline 0 C--O 1.243 0.713 0 N-CA-C 109.176 -0.676 . . . . 87.230000000000004 109.176 165.03 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . 0.435 ' HG3' ' CD1' ' A' ' 79' ' ' TRP . 1.4 Cg_endo -88.47 171.7 5.16 Favored 'Trans proline' 0 C--N 1.322 -0.822 0 C-N-CA 121.323 1.349 . . . . 65.870000000000005 112.399 -172.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 43.6 tpp -85.91 -56.01 3.68 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.907 -1.042 . . . . 101.73999999999999 111.233 174.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HIS . . . . . 0.671 ' O ' ' O ' ' A' ' 203' ' ' HOH . 19.6 m-70 -68.12 133.69 49.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.114 0.483 . . . . 82.780000000000001 110.852 177.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -64.23 -45.99 85.8 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.378 -0.929 . . . . 83.170000000000002 110.529 171.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -153.28 -179.52 7.8 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.707 0.765 . . . . 82.239999999999995 109.413 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.76 143.55 50.23 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.191 -0.913 . . . . 55.880000000000003 109.144 170.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -133.55 146.05 50.66 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.525 0.679 . . . . 72.269999999999996 109.975 -178.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 13.9 t -130.31 120.57 49.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 N-CA-C 106.237 -1.764 . . . . 56.0 106.237 166.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.6 t -119.09 109.4 26.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.512 0 N-CA-C 106.669 -1.604 . . . . 57.030000000000001 106.669 -179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 36.9 p90 -136.12 156.67 48.36 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.485 0.66 . . . . 50.25 110.363 -171.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 39.2 m -93.63 139.07 31.21 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.887 -0.783 . . . . 60.710000000000001 108.887 175.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -123.7 147.62 47.28 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.572 0.701 . . . . 57.329999999999998 111.824 -171.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . 0.417 ' OD1' ' HA ' ' A' ' 102' ' ' PRO . 73.3 m-20 55.08 20.61 3.36 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.972 1.309 . . . . 62.07 112.33 175.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -52.02 -27.78 14.78 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.653 0.612 . . . . 92.030000000000001 112.653 -175.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.7 p -130.66 42.76 3.21 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 122.984 0.514 . . . . 85.319999999999993 110.774 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 98.71 160.21 29.8 Favored Glycine 0 N--CA 1.443 -0.838 0 N-CA-C 110.461 -1.056 . . . . 65.290000000000006 110.461 -169.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PRO . . . . . 0.417 ' HA ' ' OD1' ' A' ' 98' ' ' ASN . 55.2 Cg_endo -69.56 145.57 58.71 Favored 'Trans proline' 0 C--O 1.236 0.378 0 CA-C-N 117.428 0.614 . . . . 72.870000000000005 112.167 -176.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . 0.476 ' HB2' ' CE1' ' A' ' 105' ' ' TYR . 86.7 mmt-85 -128.42 172.52 11.04 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.425 -0.954 . . . . 66.049999999999997 108.425 172.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 26.5 mtp180 -97.59 128.54 44.39 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.626 -1.25 . . . . 83.730000000000004 107.626 163.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' TYR . . . . . 0.476 ' CE1' ' HB2' ' A' ' 103' ' ' ARG . 56.2 m-85 -115.2 134.76 54.86 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 109.737 -0.468 . . . . 44.560000000000002 109.737 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 48.5 m -117.56 117.65 30.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.06 -1.459 . . . . 42.950000000000003 107.06 166.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 40.7 mm -92.3 121.61 43.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 106.203 -1.777 . . . . 37.189999999999998 106.203 172.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -113.7 135.07 54.34 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.112 -0.699 . . . . 44.049999999999997 109.112 -175.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -132.62 123.12 25.8 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 110.229 -0.285 . . . . 43.07 110.229 -175.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 35.3 mtt -105.28 125.49 51.04 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 123.23 0.331 . . . . 92.859999999999999 110.522 165.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 49.6 mt -112.66 165.01 12.67 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 122.405 1.098 . . . . 55.200000000000003 111.177 -171.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.2 t -163.18 166.33 13.26 Favored Pre-proline 0 C--O 1.242 0.664 0 CA-C-N 112.868 -1.969 . . . . 63.200000000000003 106.871 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -66.33 -18.58 55.52 Favored 'Trans proline' 0 C--O 1.233 0.258 0 CA-C-O 118.185 -0.84 . . . . 74.879999999999995 114.178 169.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -130.27 -12.62 4.01 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 115.495 1.665 . . . . 97.170000000000002 115.495 -176.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.2 t -129.68 162.16 28.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 119.56 1.073 . . . . 68.150000000000006 109.343 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -162.08 129.84 4.0 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 119.181 -1.008 . . . . 76.409999999999997 111.754 162.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -90.18 143.03 27.14 Favored 'General case' 0 CA--C 1.506 -0.739 0 C-N-CA 123.725 0.81 . . . . 96.379999999999995 111.431 163.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.1 t -126.98 149.1 50.03 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.049 -0.978 . . . . 59.43 109.035 157.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 3.8 m -138.14 139.45 39.42 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.065 -0.516 . . . . 65.790000000000006 109.824 170.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -98.55 111.74 24.0 Favored 'General case' 0 C--N 1.343 0.324 0 N-CA-C 107.834 -1.172 . . . . 53.689999999999998 107.834 170.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 89.8 t -105.06 115.95 47.93 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 N-CA-C 107.548 -1.279 . . . . 44.340000000000003 107.548 -175.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.7 m -117.23 137.73 50.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.409 0.623 . . . . 65.689999999999998 109.434 -169.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 61.3 p -144.2 174.88 10.51 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.452 -1.314 . . . . 67.709999999999994 107.452 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -116.91 162.37 27.75 Favored Pre-proline 0 C--O 1.238 0.452 0 CA-C-N 116.48 -0.327 . . . . 94.420000000000002 110.437 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo . . . . . 0 C--N 1.348 0.513 0 C-N-CA 122.118 1.879 . . . . 104.91 112.461 170.546 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.727 ' O ' ' OE2' ' A' ' 72' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . 0.848 ' O ' ' NZ ' ' A' ' 35' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.671 ' O ' ' O ' ' A' ' 88' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . 0.649 ' O ' ' OG ' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . 0.851 ' O ' ' HB3' ' A' ' 37' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . 1.249 ' O ' ' HB3' ' A' ' 74' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . 0.773 ' O ' ' SG ' ' A' ' 10' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.773 ' SG ' ' O ' ' A' ' 226' ' ' HOH . 0.4 OUTLIER . . . . . 0 CA--C 1.506 -0.731 0 N-CA-C 110.334 -0.247 . . . . 61.119999999999997 110.334 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.449 ' HB2' ' CD2' ' A' ' 64' ' ' PHE . 27.1 Cg_endo -70.31 -18.79 34.18 Favored 'Trans proline' 0 C--O 1.236 0.401 0 CA-C-O 118.385 -0.756 . . . . 43.060000000000002 113.731 176.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.2 tp -141.8 123.09 14.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 119.332 0.969 . . . . 38.280000000000001 109.235 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.3 tmm? -129.45 147.27 51.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.038 -1.097 . . . . 75.939999999999998 108.038 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 58.8 t -125.9 133.37 69.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 107.423 -1.325 . . . . 35.850000000000001 107.423 178.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -132.2 133.36 44.1 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.63 -0.878 . . . . 59.5 108.63 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.1 t -127.54 129.11 70.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 107.319 -1.363 . . . . 40.340000000000003 107.319 -170.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.59 146.2 44.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.519 0.676 . . . . 55.280000000000001 109.686 175.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -93.93 101.61 13.69 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 104.776 -2.305 . . . . 51.509999999999998 104.776 176.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.3 -16.65 59.73 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 120.213 -0.595 . . . . 61.670000000000002 112.203 -170.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.4 t -76.18 -44.75 36.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 O-C-N 123.669 0.606 . . . . 63.380000000000003 110.54 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.1 mtm180 -96.0 -8.45 33.63 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.634 0.605 . . . . 87.019999999999996 112.634 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 63.65 54.17 33.32 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 118.149 0.432 . . . . 42.060000000000002 112.08 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 57.8 p -156.33 160.43 30.76 Favored Pre-proline 0 C--O 1.239 0.519 0 C-N-CA 119.148 -1.021 . . . . 52.869999999999997 108.548 -176.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.57 148.37 87.67 Favored 'Trans proline' 0 C--N 1.319 -1.019 0 N-CA-C 109.983 -0.814 . . . . 41.310000000000002 109.983 176.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.19 109.23 22.03 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.542 -1.651 . . . . 36.880000000000003 106.542 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 79.1 mt -97.17 132.63 41.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 N-CA-C 108.577 -0.898 . . . . 47.020000000000003 108.577 -167.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.7 m120 66.95 35.05 4.93 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.946 1.298 . . . . 83.890000000000001 113.27 175.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.2 t -80.3 136.94 22.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.416 -0.957 . . . . 46.390000000000001 108.416 170.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.66 139.55 40.6 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 109.753 -0.462 . . . . 42.869999999999997 109.753 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 86.5 t -135.35 121.76 32.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 107.673 -1.232 . . . . 36.619999999999997 107.673 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -115.25 135.58 54.01 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 109.439 -0.578 . . . . 41.100000000000001 109.439 173.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.3 t -114.06 137.95 45.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.677 0 N-CA-C 109.165 -0.68 . . . . 41.710000000000001 109.165 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -126.42 155.45 42.16 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 107.995 -1.113 . . . . 43.140000000000001 107.995 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 65.7 ttt-85 -126.21 124.91 41.5 Favored 'General case' 0 C--O 1.189 -2.129 0 N-CA-C 108.519 -0.919 . . . . 56.609999999999999 108.519 178.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.848 ' NZ ' ' O ' ' A' ' 202' ' ' HOH . 0.4 OUTLIER -61.01 119.72 8.85 Favored 'General case' 0 C--O 1.188 -2.161 0 CA-C-O 121.576 0.703 . . . . 69.579999999999998 111.449 -178.624 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.67 169.56 17.47 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 122.055 0.931 . . . . 71.5 112.699 -178.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.851 ' HB3' ' O ' ' A' ' 219' ' ' HOH . . . -57.43 -40.03 77.48 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-N 114.93 -1.032 . . . . 81.030000000000001 112.471 179.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.406 ' O ' HG23 ' A' ' 40' ' ' THR . 2.9 p30 -89.0 40.39 0.98 Allowed 'General case' 0 C--O 1.206 -1.199 0 N-CA-C 114.657 1.354 . . . . 95.0 114.657 178.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.6 t70 58.63 10.1 1.32 Allowed 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 120.535 3.532 . . . . 104.22 120.535 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 38' ' ' ASP . 60.3 p -102.61 156.44 17.62 Favored 'General case' 0 C--N 1.294 -1.836 0 O-C-N 120.184 -1.573 . . . . 71.329999999999998 111.469 -175.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 73.8 m95 -84.88 101.99 12.74 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.706 -0.679 . . . . 66.599999999999994 109.398 179.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -83.97 123.96 75.11 Favored Pre-proline 0 C--O 1.24 0.584 0 CA-C-N 115.702 -0.681 . . . . 75.430000000000007 109.622 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -60.77 134.38 53.54 Favored 'Trans proline' 0 C--O 1.236 0.39 0 CA-C-N 119.719 0.936 . . . . 47.009999999999998 111.968 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -117.91 -53.49 2.38 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.878 -0.601 . . . . 39.380000000000003 112.165 -172.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -162.34 164.03 27.62 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 107.851 -1.166 . . . . 39.240000000000002 107.851 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.3 p -157.17 162.43 39.34 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.846 -0.615 . . . . 38.659999999999997 109.521 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.89 -169.31 36.66 Favored Glycine 0 C--N 1.335 0.518 0 N-CA-C 110.921 -0.872 . . . . 34.509999999999998 110.921 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -127.17 141.4 51.76 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.286 1.035 . . . . 75.349999999999994 109.918 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 45.0 p -67.62 150.41 48.8 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 118.839 -1.144 . . . . 38.700000000000003 110.136 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.4 p -90.99 -167.85 1.92 Allowed 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.723 -1.214 . . . . 54.350000000000001 107.723 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -69.86 -19.11 63.45 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 119.255 -0.978 . . . . 92.760000000000005 112.634 -176.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 96.0 p -83.52 -0.24 49.41 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 112.685 0.624 . . . . 45.439999999999998 112.685 173.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.28 4.28 90.49 Favored Glycine 0 N--CA 1.443 -0.882 0 CA-C-O 119.08 -0.845 . . . . 42.549999999999997 114.727 -174.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -105.93 151.69 24.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 118.322 1.061 . . . . 48.640000000000001 111.011 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.4 tp -127.78 111.14 13.32 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.702 -1.592 . . . . 35.380000000000003 106.702 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -110.2 161.88 15.14 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.858 0.863 . . . . 50.039999999999999 110.207 -179.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.48 18.24 76.23 Favored Glycine 0 N--CA 1.442 -0.963 0 CA-C-N 114.553 -1.203 . . . . 42.310000000000002 113.739 173.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.43 -43.73 93.04 Favored 'General case' 0 C--O 1.245 0.842 0 CA-C-N 118.212 1.006 . . . . 43.640000000000001 111.231 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . 0.414 HG23 ' HG2' ' A' ' 11' ' ' PRO . 14.2 t -146.82 -176.73 5.31 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 119.346 -0.942 . . . . 44.390000000000001 109.87 -174.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 78.7 p -120.01 162.41 19.28 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.918 -1.037 . . . . 48.189999999999998 109.201 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -63.17 -29.32 70.69 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.868 -0.605 . . . . 92.269999999999996 111.578 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.1 mp0 -69.98 -40.7 75.19 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 118.195 0.452 . . . . 66.900000000000006 111.811 176.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -82.25 -26.78 32.91 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 112.554 0.575 . . . . 62.82 112.554 -174.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CD2' ' HB2' ' A' ' 11' ' ' PRO . 21.9 t80 -88.14 74.32 8.83 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 122.69 1.233 . . . . 40.75 109.667 -167.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.7 m -79.08 174.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.035 -0.984 . . . . 45.649999999999999 111.785 -176.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.41 141.8 14.8 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.746 -0.661 . . . . 67.060000000000002 109.622 169.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 168.41 179.34 40.7 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 117.626 -2.226 . . . . 47.729999999999997 112.772 172.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 13.3 mt -98.38 121.22 48.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 107.371 -1.344 . . . . 45.450000000000003 107.371 170.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -120.01 137.81 53.87 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.312 0.645 . . . . 42.100000000000001 110.541 -174.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -111.08 129.22 55.99 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.384 -0.969 . . . . 57.740000000000002 108.384 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.2 t -112.11 113.65 44.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 107.03 -1.47 . . . . 46.130000000000003 107.03 175.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.727 ' OE2' ' O ' ' A' ' 201' ' ' HOH . 91.5 mt-10 -103.09 121.18 42.07 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 106.933 -1.506 . . . . 78.260000000000005 106.933 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 26.8 mt -109.8 121.73 63.22 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 106.434 -1.691 . . . . 42.780000000000001 106.434 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . 1.249 ' HB3' ' O ' ' A' ' 223' ' ' HOH . 10.6 m-20 -96.14 88.15 4.75 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 123.28 1.514 . . . . 77.25 108.3 -170.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 30.9 p -73.53 -37.64 65.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 112.643 -2.071 . . . . 82.569999999999993 111.117 -174.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HB3' ' HE2' ' A' ' 76' ' ' LYS . 16.3 ttpt -47.94 -49.0 31.72 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 112.139 0.422 . . . . 83.269999999999996 112.139 -172.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.6 m -74.09 -25.88 60.06 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.448 0.536 . . . . 72.629999999999995 112.448 -174.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -67.88 -42.72 80.8 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.698 -0.401 . . . . 70.090000000000003 111.228 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.541 ' HB3' ' HB ' ' A' ' 84' ' ' ILE . 85.0 m95 -62.08 -35.24 78.08 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.694 -0.402 . . . . 82.170000000000002 111.617 175.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -62.7 -40.57 97.56 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 119.769 -0.772 . . . . 93.510000000000005 110.969 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.41 -19.65 63.67 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 119.637 -0.825 . . . . 70.569999999999993 111.79 175.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.9 mt -103.46 10.93 37.0 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.007 0.523 . . . . 59.810000000000002 112.351 176.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.46 25.97 57.9 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-O 119.457 -0.635 . . . . 67.280000000000001 114.133 174.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.541 ' HB ' ' HB3' ' A' ' 79' ' ' TRP . 84.1 mt -120.34 140.57 43.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 117.95 0.875 . . . . 64.5 109.739 -175.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . 0.649 ' OG ' ' O ' ' A' ' 204' ' ' HOH . 74.6 m -102.9 114.92 64.94 Favored Pre-proline 0 C--O 1.243 0.713 0 N-CA-C 109.176 -0.676 . . . . 87.230000000000004 109.176 165.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.435 ' HG3' ' CD1' ' A' ' 79' ' ' TRP . 1.4 Cg_endo -88.47 171.7 5.16 Favored 'Trans proline' 0 C--N 1.322 -0.822 0 C-N-CA 121.323 1.349 . . . . 65.870000000000005 112.399 -172.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 43.6 tpp -85.91 -56.01 3.68 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.907 -1.042 . . . . 101.73999999999999 111.233 174.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.671 ' O ' ' O ' ' A' ' 203' ' ' HOH . 19.6 m-70 -68.12 133.69 49.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.114 0.483 . . . . 82.780000000000001 110.852 177.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -64.23 -45.99 85.8 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.378 -0.929 . . . . 83.170000000000002 110.529 171.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -153.28 -179.52 7.8 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.707 0.765 . . . . 82.239999999999995 109.413 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.76 143.55 50.23 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.191 -0.913 . . . . 55.880000000000003 109.144 170.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -133.55 146.05 50.66 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.525 0.679 . . . . 72.269999999999996 109.975 -178.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 13.9 t -130.31 120.57 49.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 N-CA-C 106.237 -1.764 . . . . 56.0 106.237 166.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.6 t -119.09 109.4 26.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.512 0 N-CA-C 106.669 -1.604 . . . . 57.030000000000001 106.669 -179.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 36.9 p90 -136.12 156.67 48.36 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.485 0.66 . . . . 50.25 110.363 -171.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 39.2 m -93.63 139.07 31.21 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.887 -0.783 . . . . 60.710000000000001 108.887 175.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -123.7 147.62 47.28 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.572 0.701 . . . . 57.329999999999998 111.824 -171.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.417 ' OD1' ' HA ' ' A' ' 102' ' ' PRO . 73.3 m-20 55.08 20.61 3.36 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.972 1.309 . . . . 62.07 112.33 175.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -52.02 -27.78 14.78 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.653 0.612 . . . . 92.030000000000001 112.653 -175.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.7 p -130.66 42.76 3.21 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 122.984 0.514 . . . . 85.319999999999993 110.774 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 98.71 160.21 29.8 Favored Glycine 0 N--CA 1.443 -0.838 0 N-CA-C 110.461 -1.056 . . . . 65.290000000000006 110.461 -169.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.417 ' HA ' ' OD1' ' A' ' 98' ' ' ASN . 55.2 Cg_endo -69.56 145.57 58.71 Favored 'Trans proline' 0 C--O 1.236 0.378 0 CA-C-N 117.428 0.614 . . . . 72.870000000000005 112.167 -176.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.476 ' HB2' ' CE1' ' A' ' 105' ' ' TYR . 86.7 mmt-85 -128.42 172.52 11.04 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.425 -0.954 . . . . 66.049999999999997 108.425 172.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 26.5 mtp180 -97.59 128.54 44.39 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.626 -1.25 . . . . 83.730000000000004 107.626 163.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.476 ' CE1' ' HB2' ' A' ' 103' ' ' ARG . 56.2 m-85 -115.2 134.76 54.86 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 109.737 -0.468 . . . . 44.560000000000002 109.737 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 48.5 m -117.56 117.65 30.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.06 -1.459 . . . . 42.950000000000003 107.06 166.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 40.7 mm -92.3 121.61 43.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 106.203 -1.777 . . . . 37.189999999999998 106.203 172.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -113.7 135.07 54.34 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.112 -0.699 . . . . 44.049999999999997 109.112 -175.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -132.62 123.12 25.8 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 110.229 -0.285 . . . . 43.07 110.229 -175.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 35.3 mtt -105.28 125.49 51.04 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 123.23 0.331 . . . . 92.859999999999999 110.522 165.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 49.6 mt -112.66 165.01 12.67 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 122.405 1.098 . . . . 55.200000000000003 111.177 -171.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.2 t -163.18 166.33 13.26 Favored Pre-proline 0 C--O 1.242 0.664 0 CA-C-N 112.868 -1.969 . . . . 63.200000000000003 106.871 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -66.33 -18.58 55.52 Favored 'Trans proline' 0 C--O 1.233 0.258 0 CA-C-O 118.185 -0.84 . . . . 74.879999999999995 114.178 169.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -130.27 -12.62 4.01 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 115.495 1.665 . . . . 97.170000000000002 115.495 -176.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.2 t -129.68 162.16 28.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 119.56 1.073 . . . . 68.150000000000006 109.343 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -162.08 129.84 4.0 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 119.181 -1.008 . . . . 76.409999999999997 111.754 162.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -90.18 143.03 27.14 Favored 'General case' 0 CA--C 1.506 -0.739 0 C-N-CA 123.725 0.81 . . . . 96.379999999999995 111.431 163.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.1 t -126.98 149.1 50.03 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.049 -0.978 . . . . 59.43 109.035 157.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 3.8 m -138.14 139.45 39.42 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.065 -0.516 . . . . 65.790000000000006 109.824 170.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -98.55 111.74 24.0 Favored 'General case' 0 C--N 1.343 0.324 0 N-CA-C 107.834 -1.172 . . . . 53.689999999999998 107.834 170.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 89.8 t -105.06 115.95 47.93 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 N-CA-C 107.548 -1.279 . . . . 44.340000000000003 107.548 -175.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.7 m -117.23 137.73 50.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.409 0.623 . . . . 65.689999999999998 109.434 -169.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 61.3 p -144.2 174.88 10.51 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.452 -1.314 . . . . 67.709999999999994 107.452 -178.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -116.91 162.37 27.75 Favored Pre-proline 0 C--O 1.238 0.452 0 CA-C-N 116.48 -0.327 . . . . 94.420000000000002 110.437 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo . . . . . 0 C--N 1.348 0.513 0 C-N-CA 122.118 1.879 . . . . 104.91 112.461 170.546 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.727 ' O ' ' OE2' ' A' ' 72' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . 0.848 ' O ' ' NZ ' ' A' ' 35' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.671 ' O ' ' O ' ' A' ' 88' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . 0.649 ' O ' ' OG ' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . 0.851 ' O ' ' HB3' ' A' ' 37' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . 1.249 ' O ' ' HB3' ' A' ' 74' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . 0.773 ' O ' ' SG ' ' A' ' 10' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_