data_2ycc_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 2ycc _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 125.509 2.575 . . . . 55.240000000000002 108.168 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -137.19 44.09 2.31 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 110.16 -3.2 . . . . 58.270000000000003 112.191 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -164.58 113.1 1.1 Allowed 'General case' 0 C--O 1.256 1.421 0 C-N-CA 124.682 1.193 . . . . 48.82 109.007 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 11.3 mtmm -114.99 141.72 47.6 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 125.782 1.926 . . . . 49.340000000000003 108.283 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -62.66 127.78 32.9 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 124.527 1.131 . . . . 36.340000000000003 111.024 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -99.98 -146.28 19.4 Favored Glycine 0 CA--C 1.545 1.961 0 N-CA-C 106.785 -2.526 . . . . 30.859999999999999 106.785 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 t -95.17 131.98 40.61 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 125.584 1.554 . . . . 27.140000000000001 111.961 179.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.46 -58.61 5.95 Favored 'General case' 0 C--O 1.255 1.342 0 O-C-N 126.91 2.631 . . . . 21.77 106.15 174.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -49.13 -41.67 36.89 Favored 'General case' 0 C--O 1.256 1.427 0 CA-C-O 125.424 2.535 . . . . 19.59 112.637 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.4 tppt? -59.46 -55.92 28.49 Favored 'General case' 0 C--O 1.251 1.172 0 CA-C-N 112.39 -2.187 . . . . 11.43 108.205 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -50.68 -41.4 42.79 Favored Glycine 0 C--O 1.267 2.187 0 CA-C-O 115.997 -2.557 . . . . 10.24 117.508 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.55 -28.65 56.11 Favored 'General case' 0 N--CA 1.414 -2.232 1 CA-C-O 110.909 -4.377 . . . . 10.44 113.545 -179.575 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.385 71.7 p -97.57 -25.05 15.28 Favored 'General case' 0 C--O 1.275 2.434 1 O-C-N 129.139 4.025 . . . . 8.1799999999999997 115.782 -177.404 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . 0.746 ' O ' ' N ' ' A' ' 13' ' ' ARG . 0.5 OUTLIER -73.18 -46.7 49.13 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 101.721 -3.437 . . . . 13.68 101.721 174.019 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . 0.41 ' CE2' ' CB ' ' A' ' 14' ' ' CYS 0.26 43.3 t80 -51.69 -51.62 54.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.837 2.055 . . . . 6.8600000000000003 107.794 -178.256 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.7 mttt -58.9 -59.48 5.38 Favored 'General case' 0 C--O 1.195 -1.815 0 N-CA-C 107.474 -1.306 . . . . 7.25 107.474 173.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.321 72.9 p -64.08 -31.01 72.04 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 114.923 -2.465 . . . . 9.2200000000000006 112.656 -178.98 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ARG . . . . . 0.746 ' N ' ' O ' ' A' ' 9' ' ' LEU . 34.2 mtp180 -118.37 -8.55 10.53 Favored 'General case' 0 C--O 1.277 2.505 1 N-CA-C 124.068 4.84 . . . . 22.73 124.068 -175.551 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . 0.41 ' CB ' ' CE2' ' A' ' 10' ' ' PHE . 11.1 m -138.34 -19.16 1.1 Allowed 'General case' 0 C--N 1.276 -2.61 0 CA-C-N 122.283 2.311 . . . . 9.4600000000000009 109.7 -175.899 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . 0.434 ' O ' ' NZ ' ' A' ' 27' ' ' LYS . 27.7 tp -61.06 -37.85 84.11 Favored 'General case' 0 C--O 1.295 3.46 0 CA-C-N 121.283 1.856 . . . . 11.34 114.453 -179.2 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -42.94 -42.01 3.57 Favored 'General case' 0 C--O 1.264 1.819 0 O-C-N 124.751 1.282 . . . . 8.1999999999999993 107.857 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.7 m -125.68 13.36 8.04 Favored 'General case' 1 C--O 1.309 4.232 1 C-N-CA 107.35 -5.74 . . . . 6.4299999999999997 116.776 -178.214 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -150.12 154.78 38.65 Favored 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 123.915 1.817 . . . . 6.7599999999999998 113.653 -172.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . 0.462 ' CA ' ' O ' ' A' ' 195' ' ' HOH . 80.4 p -123.89 148.46 46.81 Favored 'General case' 0 CA--C 1.574 1.898 0 N-CA-C 104.227 -2.508 . . . . 3.8799999999999999 104.227 177.673 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . 0.407 ' N ' ' O ' ' A' ' 195' ' ' HOH . 2.9 m -111.2 -25.32 3.57 Favored 'Isoleucine or valine' 0 C--O 1.275 2.427 0 CA-C-O 127.926 3.727 . . . . 13.44 114.678 -174.155 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.49 132.02 40.5 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 111.226 -2.715 . . . . 23.34 116.828 -175.018 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.93 126.91 29.66 Favored 'General case' 0 C--O 1.256 1.407 0 CA-C-N 118.884 0.766 . . . . 22.100000000000001 110.607 179.625 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.66 12.14 78.35 Favored Glycine 0 N--CA 1.501 3.017 1 C-N-CA 113.386 -4.245 . . . . 12.09 108.469 177.809 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -92.56 154.38 22.14 Favored Glycine 1 CA--C 1.579 4.053 1 N-CA-C 101.717 -4.553 . . . . 10.039999999999999 101.717 174.68 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -82.08 156.93 17.63 Favored 'Trans proline' 0 C--O 1.273 2.234 1 CA-C-O 129.848 4.02 . . . . 9.7799999999999994 121.516 -178.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -84.59 140.65 31.24 Favored 'General case' 0 CA--C 1.577 2.01 0 CA-C-N 108.735 -3.848 . . . . 13.94 101.573 175.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . 0.434 ' NZ ' ' O ' ' A' ' 15' ' ' LEU . 15.6 mtmt -128.58 -122.74 0.23 Allowed 'General case' 0 C--O 1.275 2.434 1 O-C-N 131.309 5.381 . . . . 11.43 108.228 -179.261 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . 0.498 ' O ' ' OH ' ' A' ' 46' ' ' TYR . 74.2 t -67.37 -56.5 13.22 Favored 'Isoleucine or valine' 0 C--O 1.264 1.843 0 O-C-N 128.202 3.439 . . . . 6.1299999999999999 107.814 176.838 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -96.7 168.5 25.08 Favored Glycine 1 CA--C 1.597 5.173 1 N-CA-C 96.716 -6.554 . . . . 2.9700000000000002 96.716 176.173 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . 0.412 ' C ' ' O ' ' A' ' 110' ' ' HOH . 22.0 Cg_endo -78.72 165.43 24.73 Favored 'Trans proline' 0 C--N 1.321 -0.879 1 O-C-N 130.002 4.685 . . . . 2.25 116.815 -175.284 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . 0.444 ' CB ' ' OG1' ' A' ' 19' ' ' THR . 0.3 OUTLIER -77.81 144.53 36.99 Favored 'General case' 0 C--O 1.3 3.735 2 O-C-N 131.575 5.547 . . . . 5.9699999999999998 102.66 178.925 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.0 mt -95.42 1.27 54.1 Favored 'General case' 0 C--O 1.298 3.619 0 N-CA-C 115.286 1.588 . . . . 7.6900000000000004 115.286 -176.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . 0.283 17.3 t60 -55.9 127.66 31.38 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 115.041 -2.664 . . . . 12.470000000000001 109.17 -176.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.1 24.39 61.67 Favored Glycine 0 N--CA 1.411 -3.012 0 CA-C-N 111.28 -2.691 . . . . 9.1099999999999994 110.853 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.2 tp -59.28 -35.76 59.83 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 115.57 1.692 . . . . 17.289999999999999 115.57 178.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.347 70.5 m-85 -68.71 123.56 21.24 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-O 123.041 1.4 . . . . 14.77 113.186 -176.731 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 59' ' ' TRP . . . 98.44 -19.84 52.81 Favored Glycine 0 C--O 1.248 0.971 0 CA-C-N 113.749 -1.569 . . . . 14.52 113.382 -178.617 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . 0.336 0.0 OUTLIER -90.39 152.59 20.92 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 105.83 -1.915 . . . . 15.68 105.83 -179.402 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -84.82 147.89 26.59 Favored 'General case' 0 C--N 1.311 -1.097 1 O-C-N 131.413 5.446 . . . . 20.02 105.551 179.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.5 p -63.11 140.1 58.84 Favored 'General case' 0 C--O 1.264 1.854 0 O-C-N 126.075 2.11 . . . . 14.33 109.627 -178.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . 0.407 ' N ' ' OD1' ' A' ' 52' ' ' ASN . . . 84.31 31.48 25.13 Favored Glycine 0 CA--C 1.503 -0.697 0 CA-C-N 111.969 -2.378 . . . . 14.02 117.607 177.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . 0.25 9.0 mm100 -112.04 -3.18 14.83 Favored 'General case' 0 C--O 1.267 2.002 0 N-CA-C 117.881 2.549 . . . . 18.649999999999999 117.881 -176.609 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.29 120.05 10.82 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 106.015 -1.846 . . . . 15.609999999999999 106.015 175.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.6 132.3 34.91 Favored 'General case' 0 C--O 1.265 1.893 1 O-C-N 131.464 5.477 . . . . 19.879999999999999 107.128 179.158 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 100.64 13.24 35.53 Favored Glycine 0 C--O 1.26 1.726 0 C-N-CA 129.864 3.602 . . . . 13.220000000000001 109.375 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TYR . . . . . 0.498 ' OH ' ' O ' ' A' ' 28' ' ' VAL . 49.3 t80 -123.42 136.28 54.54 Favored 'General case' 0 C--O 1.258 1.532 0 C-N-CA 117.329 -1.748 . . . . 12.869999999999999 110.492 -179.828 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . 0.254 22.9 t -99.52 83.82 2.86 Favored 'General case' 0 C--N 1.358 0.978 0 CA-C-O 122.837 1.303 . . . . 18.550000000000001 108.194 -177.521 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -70.58 140.66 51.75 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 129.554 3.142 . . . . 19.190000000000001 106.235 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 28.0 p -63.61 162.49 12.91 Favored 'General case' 0 CA--C 1.558 1.257 0 O-C-N 124.501 1.126 . . . . 22.890000000000001 108.025 176.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -45.95 72.15 Favored 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 125.789 1.931 . . . . 30.210000000000001 108.049 179.193 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -49.36 -48.02 47.05 Favored 'General case' 0 C--O 1.282 2.813 0 O-C-N 128.475 3.609 . . . . 29.469999999999999 113.043 -179.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASN . . . . . 0.407 ' OD1' ' N ' ' A' ' 41' ' ' GLY . 21.5 t-20 -51.44 -69.23 0.12 Allowed 'General case' 0 C--O 1.249 1.057 0 O-C-N 127.726 3.141 . . . . 30.469999999999999 110.942 -178.794 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.284 0.2 OUTLIER -36.39 -55.09 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 C-N-CA 129.807 3.243 . . . . 31.149999999999999 114.407 -178.801 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.95 -27.01 64.39 Favored 'General case' 0 C--O 1.249 1.069 0 C-N-CA 127.733 2.413 . . . . 31.870000000000001 114.017 -178.416 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -57.8 -56.2 25.05 Favored 'General case' 0 C--N 1.312 -1.042 0 O-C-N 127.448 2.968 . . . . 35.579999999999998 105.699 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 58.47 54.46 5.52 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 109.082 -3.69 . . . . 38.259999999999998 114.3 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.3 t -79.29 140.91 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 116.85 -1.548 . . . . 38.030000000000001 113.17 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.85 131.76 36.3 Favored 'General case' 0 N--CA 1.507 2.42 0 N-CA-C 103.033 -2.951 . . . . 35.200000000000003 103.033 176.593 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TRP . . . . . 0.555 ' O ' ' N ' ' A' ' 37' ' ' GLY 0.263 25.5 m95 -94.47 100.43 12.42 Favored 'General case' 0 C--O 1.249 1.051 1 CA-C-O 128.569 4.033 . . . . 27.59 116.505 -176.415 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -133.8 164.02 28.17 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 110.382 -3.099 . . . . 23.48 104.546 174.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -48.29 -28.47 3.13 Favored 'General case' 0 C--N 1.291 -1.969 0 C-N-CA 129.576 3.151 . . . . 28.050000000000001 117.208 -177.339 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . 0.503 ' O ' ' OE1' ' A' ' 66' ' ' GLU . 6.3 m120 -84.85 -54.39 4.71 Favored 'General case' 0 C--O 1.266 1.921 0 N-CA-C 115.631 1.715 . . . . 27.489999999999998 115.631 -176.931 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -50.93 -50.41 57.72 Favored 'General case' 0 N--CA 1.519 2.983 0 CA-C-O 127.732 3.634 . . . . 27.420000000000002 105.379 178.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 10.2 tpp -55.53 -20.09 11.98 Favored 'General case' 0 C--O 1.279 2.633 0 CA-C-N 109.466 -3.516 . . . . 28.879999999999999 114.342 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . 0.471 ' OG ' ' NH1' ' A' ' 91' ' ' ARG 0.253 9.9 t -92.84 -41.71 9.93 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 127.617 3.073 . . . . 16.09 107.974 -179.85 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . 0.577 ' O ' ' N ' ' A' ' 69' ' ' THR . 3.5 mp0 -62.88 -58.67 6.57 Favored 'General case' 0 C--O 1.255 1.351 0 C-N-CA 117.252 -1.779 . . . . 30.989999999999998 106.362 175.65 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -38.9 -45.11 1.13 Allowed 'General case' 0 C--N 1.31 -1.145 0 O-C-N 119.773 -1.829 . . . . 29.170000000000002 111.233 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . 0.33 31.4 mt -68.06 -27.02 66.15 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 112.361 -2.2 . . . . 19.600000000000001 111.124 -179.141 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . 0.577 ' N ' ' O ' ' A' ' 66' ' ' GLU . 87.1 m -65.68 -42.4 91.3 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 126.438 2.337 . . . . 21.48 111.069 176.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -170.09 88.24 0.54 Allowed Pre-proline 0 C--O 1.249 1.031 0 C-N-CA 124.475 1.11 . . . . 23.690000000000001 109.825 -177.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -50.86 -61.25 0.58 Allowed 'Trans proline' 0 C--O 1.237 0.454 0 O-C-N 126.343 2.76 . . . . 20.82 116.485 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 O-C-N 127.267 2.854 . . . . 23.460000000000001 108.204 -178.779 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.59 -46.21 22.87 Favored 'General case' 0 C--O 1.249 1.045 0 CA-C-N 113.26 -1.791 . . . . 20.59 109.198 177.297 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -65.33 -43.05 92.18 Favored 'General case' 0 C--O 1.257 1.456 0 CA-C-N 122.015 2.189 . . . . 24.66 111.052 178.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . 0.27 0.1 OUTLIER -129.14 78.8 75.55 Favored Pre-proline 0 C--O 1.259 1.574 0 O-C-N 127.939 3.274 . . . . 20.010000000000002 115.803 176.439 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -62.55 115.15 2.71 Favored 'Trans proline' 0 C--O 1.255 1.346 0 N-CA-C 107.265 -1.86 . . . . 18.350000000000001 107.265 177.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 138.06 -34.13 2.17 Favored Glycine 0 C--O 1.275 2.663 0 N-CA-C 106.757 -2.537 . . . . 15.470000000000001 106.757 -177.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 3.4 t -53.07 134.95 38.14 Favored 'General case' 0 C--O 1.26 1.633 0 O-C-N 128.083 2.873 . . . . 11.09 115.702 -176.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.0 pttt -83.46 12.73 5.17 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 113.494 -3.283 . . . . 8.8200000000000003 107.842 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.1 ttt -73.13 113.29 10.01 Favored 'General case' 0 C--N 1.381 1.95 0 C-N-CA 115.258 -2.577 . . . . 11.94 109.853 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -91.34 88.93 7.05 Favored 'General case' 0 N--CA 1.484 1.232 1 O-C-N 129.451 4.219 . . . . 15.69 106.627 177.685 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PHE . . . . . 0.485 ' CE1' ' CA ' ' A' ' 84' ' ' GLY . 73.5 t80 -164.31 124.28 2.03 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 112.348 -2.206 . . . . 26.030000000000001 105.725 -178.756 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -66.8 -32.04 80.04 Favored Glycine 0 C--O 1.245 0.816 1 O-C-N 130.445 4.841 . . . . 22.670000000000002 109.754 -178.289 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . 0.485 ' CA ' ' CE1' ' A' ' 82' ' ' PHE . . . 123.56 -161.38 17.9 Favored Glycine 0 N--CA 1.506 3.35 0 N-CA-C 105.604 -2.998 . . . . 22.699999999999999 105.604 -179.708 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.64 110.36 10.87 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 129.202 3.001 . . . . 17.620000000000001 106.322 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . 0.419 ' NZ ' ' O ' ' A' ' 183' ' ' HOH . 0.0 OUTLIER -65.52 -34.97 79.5 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 118.004 2.594 . . . . 33.57 118.004 -174.329 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -93.13 134.41 35.32 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 124.902 2.287 . . . . 23.399999999999999 115.706 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -56.99 -50.19 73.45 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-N 109.761 -3.381 . . . . 17.170000000000002 111.7 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.77 -48.71 50.2 Favored 'General case' 0 C--O 1.249 1.071 0 C-N-CA 126.109 1.764 . . . . 13.890000000000001 114.963 177.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -66.15 -36.05 82.1 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 129.545 3.138 . . . . 16.760000000000002 109.947 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . 0.471 ' NH1' ' OG ' ' A' ' 65' ' ' SER . 0.5 OUTLIER -64.46 -54.93 24.74 Favored 'General case' 0 C--O 1.252 1.189 0 CA-C-N 111.75 -2.477 . . . . 14.69 107.258 177.701 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -47.74 -56.95 6.21 Favored 'General case' 0 C--O 1.267 1.979 0 CA-C-O 123.895 1.807 . . . . 10.91 111.088 -178.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -50.4 -63.89 0.98 Allowed 'General case' 1 C--O 1.319 4.726 0 C-N-CA 128.472 2.709 . . . . 6.0999999999999996 110.92 178.736 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 98' ' ' LEU 0.343 40.8 tp -57.06 -49.54 75.52 Favored 'General case' 0 N--CA 1.511 2.593 0 C-N-CA 115.512 -2.475 . . . . 2.7599999999999998 113.994 178.585 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . 0.666 ' O ' ' N ' ' A' ' 99' ' ' LYS . 56.3 mt -52.1 -39.53 26.92 Favored 'Isoleucine or valine' 0 C--O 1.286 2.978 0 O-C-N 117.733 -3.105 . . . . 8.5700000000000003 111.584 177.171 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.2 m -62.75 -43.86 97.72 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 101.07 -3.678 . . . . 7.79 101.07 -179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -58.5 -48.38 81.0 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 112.52 -2.127 . . . . 10.83 107.899 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . 0.624 ' N ' ' O ' ' A' ' 94' ' ' LEU 0.504 18.2 mt -66.68 -42.85 85.86 Favored 'General case' 0 C--O 1.274 2.383 0 C-N-CA 112.022 -3.871 . . . . 12.24 108.036 -175.127 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . 0.666 ' N ' ' O ' ' A' ' 95' ' ' ILE . 0.0 OUTLIER -36.77 -56.04 0.86 Allowed 'General case' 0 C--N 1.311 -1.086 0 O-C-N 128.614 3.696 . . . . 12.08 108.221 178.075 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -66.01 -75.24 0.09 Allowed 'General case' 0 C--O 1.248 1.02 1 CA-C-N 108.255 -4.066 . . . . 19.949999999999999 115.848 -177.408 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . 0.399 . . -59.48 -43.55 93.23 Favored 'General case' 0 C--O 1.287 3.069 0 CA-C-O 112.726 -3.512 . . . . 17.050000000000001 119.24 -176.263 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.5 p -61.58 -1.07 0.5 Allowed 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 124.785 3.448 . . . . 18.140000000000001 112.884 -176.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.276 2.488 0 N-CA-C 120.534 3.531 . . . . 26.670000000000002 120.534 -174.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . 0.412 ' O ' ' C ' ' A' ' 30' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . 0.419 ' O ' ' NZ ' ' A' ' 86' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' HOH . . . . . 0.462 ' O ' ' CA ' ' A' ' 19' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . 0.419 ' O ' ' CA ' ' A' ' 84' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 125.509 2.575 . . . . 55.240000000000002 108.168 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -137.19 44.09 2.31 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 110.16 -3.2 . . . . 58.270000000000003 112.191 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -3' ' ' PHE . . . . . 0.674 ' CE1' ' HA ' ' A' ' 92' ' ' ASN . 64.5 t80 -164.58 113.1 1.1 Allowed 'General case' 0 C--O 1.256 1.421 0 C-N-CA 124.682 1.193 . . . . 48.82 109.007 177.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 11.3 mtmm -114.99 141.72 47.6 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 125.782 1.926 . . . . 49.340000000000003 108.283 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -62.66 127.78 32.9 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 124.527 1.131 . . . . 36.340000000000003 111.024 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . 0.575 ' HA3' ' OD1' ' A' ' 93' ' ' ASP . . . -99.98 -146.28 19.4 Favored Glycine 0 CA--C 1.545 1.961 0 N-CA-C 106.785 -2.526 . . . . 30.859999999999999 106.785 177.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . 0.522 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 6.6 t -95.17 131.98 40.61 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 125.584 1.554 . . . . 27.140000000000001 111.961 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.46 -58.61 5.95 Favored 'General case' 0 C--O 1.255 1.342 0 O-C-N 126.91 2.631 . . . . 21.77 106.15 174.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -49.13 -41.67 36.89 Favored 'General case' 0 C--O 1.256 1.427 0 CA-C-O 125.424 2.535 . . . . 19.59 112.637 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 2' ' ' SER . 3.4 tppt? -59.46 -55.92 28.49 Favored 'General case' 0 C--O 1.251 1.172 0 CA-C-N 112.39 -2.187 . . . . 11.43 108.205 179.116 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . 0.681 ' HA3' ' HB2' ' A' ' 97' ' ' TYR . . . -50.68 -41.4 42.79 Favored Glycine 0 C--O 1.267 2.187 0 CA-C-O 115.997 -2.557 . . . . 10.24 117.508 -179.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . 0.739 ' O ' ' HG3' ' A' ' 11' ' ' LYS . . . -55.55 -28.65 56.11 Favored 'General case' 0 N--CA 1.414 -2.232 1 CA-C-O 110.909 -4.377 . . . . 10.44 113.545 -179.575 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.385 71.7 p -97.57 -25.05 15.28 Favored 'General case' 0 C--O 1.275 2.434 1 O-C-N 129.139 4.025 . . . . 8.1799999999999997 115.782 -177.404 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . 0.746 ' O ' ' N ' ' A' ' 13' ' ' ARG . 0.5 OUTLIER -73.18 -46.7 49.13 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 101.721 -3.437 . . . . 13.68 101.721 174.019 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . 0.806 ' HB2' HD13 ' A' ' 94' ' ' LEU 0.26 43.3 t80 -51.69 -51.62 54.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.837 2.055 . . . . 6.8600000000000003 107.794 -178.256 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . 0.739 ' HG3' ' O ' ' A' ' 7' ' ' ALA . 40.7 mttt -58.9 -59.48 5.38 Favored 'General case' 0 C--O 1.195 -1.815 0 N-CA-C 107.474 -1.306 . . . . 7.25 107.474 173.05 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.321 72.9 p -64.08 -31.01 72.04 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 114.923 -2.465 . . . . 9.2200000000000006 112.656 -178.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ARG . . . . . 0.746 ' N ' ' O ' ' A' ' 9' ' ' LEU . 34.2 mtp180 -118.37 -8.55 10.53 Favored 'General case' 0 C--O 1.277 2.505 1 N-CA-C 124.068 4.84 . . . . 22.73 124.068 -175.551 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . 0.489 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 11.1 m -138.34 -19.16 1.1 Allowed 'General case' 0 C--N 1.276 -2.61 0 CA-C-N 122.283 2.311 . . . . 9.4600000000000009 109.7 -175.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . 0.469 HD11 ' O ' ' A' ' 218' ' ' HOH . 27.7 tp -61.06 -37.85 84.11 Favored 'General case' 0 C--O 1.295 3.46 0 CA-C-N 121.283 1.856 . . . . 11.34 114.453 -179.2 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . 0.77 ' HG2' ' SG ' ' A' ' 17' ' ' CYS . 26.7 tt0 -42.94 -42.01 3.57 Favored 'General case' 0 C--O 1.264 1.819 0 O-C-N 124.751 1.282 . . . . 8.1999999999999993 107.857 177.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' CYS . . . . . 0.77 ' SG ' ' HG2' ' A' ' 16' ' ' GLN . 10.7 m -125.68 13.36 8.04 Favored 'General case' 1 C--O 1.309 4.232 1 C-N-CA 107.35 -5.74 . . . . 6.4299999999999997 116.776 -178.214 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -150.12 154.78 38.65 Favored 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 123.915 1.817 . . . . 6.7599999999999998 113.653 -172.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . 0.824 ' OG1' ' HB2' ' A' ' 31' ' ' ASN . 80.4 p -123.89 148.46 46.81 Favored 'General case' 0 CA--C 1.574 1.898 0 N-CA-C 104.227 -2.508 . . . . 3.8799999999999999 104.227 177.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . 0.574 ' O ' ' HB2' ' A' ' 33' ' ' HIS . 2.9 m -111.2 -25.32 3.57 Favored 'Isoleucine or valine' 0 C--O 1.275 2.427 0 CA-C-O 127.926 3.727 . . . . 13.44 114.678 -174.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . 0.578 ' OE1' ' HB ' ' A' ' 19' ' ' THR . 0.0 OUTLIER -75.49 132.02 40.5 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 111.226 -2.715 . . . . 23.34 116.828 -175.018 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . 0.465 ' HD2' ' O ' ' A' ' 133' ' ' HOH . 0.0 OUTLIER -58.93 126.91 29.66 Favored 'General case' 0 C--O 1.256 1.407 0 CA-C-N 118.884 0.766 . . . . 22.100000000000001 110.607 179.625 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.66 12.14 78.35 Favored Glycine 0 N--CA 1.501 3.017 1 C-N-CA 113.386 -4.245 . . . . 12.09 108.469 177.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -92.56 154.38 22.14 Favored Glycine 1 CA--C 1.579 4.053 1 N-CA-C 101.717 -4.553 . . . . 10.039999999999999 101.717 174.68 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . 0.543 ' HD2' HG21 ' A' ' 19' ' ' THR . 60.0 Cg_endo -82.08 156.93 17.63 Favored 'Trans proline' 0 C--O 1.273 2.234 1 CA-C-O 129.848 4.02 . . . . 9.7799999999999994 121.516 -178.812 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HIS . . . . . 0.535 ' CE1' ' HB1' ' A' ' 43' ' ' ALA . 16.4 m-70 -84.59 140.65 31.24 Favored 'General case' 0 CA--C 1.577 2.01 0 CA-C-N 108.735 -3.848 . . . . 13.94 101.573 175.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . 0.509 ' HE3' ' O ' ' A' ' 125' ' ' HOH . 15.6 mtmt -128.58 -122.74 0.23 Allowed 'General case' 0 C--O 1.275 2.434 1 O-C-N 131.309 5.381 . . . . 11.43 108.228 -179.261 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . 0.621 ' HB ' ' HB3' ' A' ' 17' ' ' CYS . 74.2 t -67.37 -56.5 13.22 Favored 'Isoleucine or valine' 0 C--O 1.264 1.843 0 O-C-N 128.202 3.439 . . . . 6.1299999999999999 107.814 176.838 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -96.7 168.5 25.08 Favored Glycine 1 CA--C 1.597 5.173 1 N-CA-C 96.716 -6.554 . . . . 2.9700000000000002 96.716 176.173 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . 0.412 ' C ' ' O ' ' A' ' 110' ' ' HOH . 22.0 Cg_endo -78.72 165.43 24.73 Favored 'Trans proline' 0 C--N 1.321 -0.879 1 O-C-N 130.002 4.685 . . . . 2.25 116.815 -175.284 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . 0.824 ' HB2' ' OG1' ' A' ' 19' ' ' THR . 0.3 OUTLIER -77.81 144.53 36.99 Favored 'General case' 0 C--O 1.3 3.735 2 O-C-N 131.575 5.547 . . . . 5.9699999999999998 102.66 178.925 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.0 mt -95.42 1.27 54.1 Favored 'General case' 0 C--O 1.298 3.619 0 N-CA-C 115.286 1.588 . . . . 7.6900000000000004 115.286 -176.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . 0.574 ' HB2' ' O ' ' A' ' 20' ' ' VAL 0.283 47.3 t-80 -55.9 127.66 31.38 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 115.041 -2.664 . . . . 12.470000000000001 109.17 -176.964 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.1 24.39 61.67 Favored Glycine 0 N--CA 1.411 -3.012 0 CA-C-N 111.28 -2.691 . . . . 9.1099999999999994 110.853 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . 0.949 HG22 HG21 ' A' ' 102' ' ' THR . 11.2 tp -59.28 -35.76 59.83 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 115.57 1.692 . . . . 17.289999999999999 115.57 178.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 59' ' ' TRP 0.347 70.5 m-85 -68.71 123.56 21.24 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-O 123.041 1.4 . . . . 14.77 113.186 -176.731 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . 0.428 ' N ' ' O ' ' A' ' 59' ' ' TRP . . . 98.44 -19.84 52.81 Favored Glycine 0 C--O 1.248 0.971 0 CA-C-N 113.749 -1.569 . . . . 14.52 113.382 -178.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . 0.336 0.0 OUTLIER -90.39 152.59 20.92 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 105.83 -1.915 . . . . 15.68 105.83 -179.402 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . 0.561 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 65.6 m80 -84.82 147.89 26.59 Favored 'General case' 0 C--N 1.311 -1.097 1 O-C-N 131.413 5.446 . . . . 20.02 105.551 179.612 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . 0.453 ' HA ' ' O2A' ' A' ' 104' ' ' HEM . 48.5 p -63.11 140.1 58.84 Favored 'General case' 0 C--O 1.264 1.854 0 O-C-N 126.075 2.11 . . . . 14.33 109.627 -178.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . 0.411 ' HA2' ' CZ ' ' A' ' 48' ' ' TYR . . . 84.31 31.48 25.13 Favored Glycine 0 CA--C 1.503 -0.697 0 CA-C-N 111.969 -2.378 . . . . 14.02 117.607 177.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . 0.25 9.0 mm100 -112.04 -3.18 14.83 Favored 'General case' 0 C--O 1.267 2.002 0 N-CA-C 117.881 2.549 . . . . 18.649999999999999 117.881 -176.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . 0.535 ' HB1' ' CE1' ' A' ' 26' ' ' HIS . . . -63.29 120.05 10.82 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 106.015 -1.846 . . . . 15.609999999999999 106.015 175.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.6 132.3 34.91 Favored 'General case' 0 C--O 1.265 1.893 1 O-C-N 131.464 5.477 . . . . 19.879999999999999 107.128 179.158 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 100.64 13.24 35.53 Favored Glycine 0 C--O 1.26 1.726 0 C-N-CA 129.864 3.602 . . . . 13.220000000000001 109.375 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TYR . . . . . 0.475 ' OH ' HMD2 ' A' ' 104' ' ' HEM . 49.3 t80 -123.42 136.28 54.54 Favored 'General case' 0 C--O 1.258 1.532 0 C-N-CA 117.329 -1.748 . . . . 12.869999999999999 110.492 -179.828 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . 0.254 22.9 t -99.52 83.82 2.86 Favored 'General case' 0 C--N 1.358 0.978 0 CA-C-O 122.837 1.303 . . . . 18.550000000000001 108.194 -177.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . 0.411 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 81.7 m-85 -70.58 140.66 51.75 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 129.554 3.142 . . . . 19.190000000000001 106.235 177.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . 0.56 HG23 ' HG2' ' A' ' 79' ' ' LYS . 28.0 p -63.61 162.49 12.91 Favored 'General case' 0 CA--C 1.558 1.257 0 O-C-N 124.501 1.126 . . . . 22.890000000000001 108.025 176.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . 0.717 ' OD2' ' HE2' ' A' ' 54' ' ' LYS . 0.8 OUTLIER -54.15 -45.95 72.15 Favored 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 125.789 1.931 . . . . 30.210000000000001 108.049 179.193 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . 0.547 ' HB2' ' HA3' ' A' ' 77' ' ' GLY . . . -49.36 -48.02 47.05 Favored 'General case' 0 C--O 1.282 2.813 0 O-C-N 128.475 3.609 . . . . 29.469999999999999 113.043 -179.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 55' ' ' LYS . 21.5 t-20 -51.44 -69.23 0.12 Allowed 'General case' 0 C--O 1.249 1.057 0 O-C-N 127.726 3.141 . . . . 30.469999999999999 110.942 -178.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . 0.758 HG22 ' HD2' ' A' ' 54' ' ' LYS 0.284 0.2 OUTLIER -36.39 -55.09 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 C-N-CA 129.807 3.243 . . . . 31.149999999999999 114.407 -178.801 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . 0.758 ' HD2' HG22 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -69.95 -27.01 64.39 Favored 'General case' 0 C--O 1.249 1.069 0 C-N-CA 127.733 2.413 . . . . 31.870000000000001 114.017 -178.416 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . 0.889 ' HG3' HG23 ' A' ' 57' ' ' VAL . 42.4 tptt -57.8 -56.2 25.05 Favored 'General case' 0 C--N 1.312 -1.042 0 O-C-N 127.448 2.968 . . . . 35.579999999999998 105.699 178.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 58.47 54.46 5.52 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 109.082 -3.69 . . . . 38.259999999999998 114.3 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . 0.889 HG23 ' HG3' ' A' ' 55' ' ' LYS . 3.3 t -79.29 140.91 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 116.85 -1.548 . . . . 38.030000000000001 113.17 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . 0.514 HD23 ' CD2' ' A' ' 39' ' ' HIS . 0.2 OUTLIER -90.85 131.76 36.3 Favored 'General case' 0 N--CA 1.507 2.42 0 N-CA-C 103.033 -2.951 . . . . 35.200000000000003 103.033 176.593 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TRP . . . . . 0.562 ' O ' ' HA ' ' A' ' 36' ' ' PHE 0.263 25.5 m95 -94.47 100.43 12.42 Favored 'General case' 0 C--O 1.249 1.051 1 CA-C-O 128.569 4.033 . . . . 27.59 116.505 -176.415 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . 0.692 ' HB3' ' O ' ' A' ' 124' ' ' HOH . 7.6 p30 -133.8 164.02 28.17 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 110.382 -3.099 . . . . 23.48 104.546 174.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . 0.528 ' HG3' ' OD1' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -48.29 -28.47 3.13 Favored 'General case' 0 C--N 1.291 -1.969 0 C-N-CA 129.576 3.151 . . . . 28.050000000000001 117.208 -177.339 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . 0.528 ' OD1' ' HG3' ' A' ' 61' ' ' GLU . 6.3 m120 -84.85 -54.39 4.71 Favored 'General case' 0 C--O 1.266 1.921 0 N-CA-C 115.631 1.715 . . . . 27.489999999999998 115.631 -176.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASN . . . . . 0.52 ' OD1' HG13 ' A' ' 57' ' ' VAL . 1.2 t-20 -50.93 -50.41 57.72 Favored 'General case' 0 N--CA 1.519 2.983 0 CA-C-O 127.732 3.634 . . . . 27.420000000000002 105.379 178.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . 0.496 ' O ' HD12 ' A' ' 68' ' ' LEU . 10.2 tpp -55.53 -20.09 11.98 Favored 'General case' 0 C--O 1.279 2.633 0 CA-C-N 109.466 -3.516 . . . . 28.879999999999999 114.342 179.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . 0.471 ' OG ' ' NH1' ' A' ' 91' ' ' ARG 0.253 9.9 t -92.84 -41.71 9.93 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 127.617 3.073 . . . . 16.09 107.974 -179.85 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . 0.548 ' O ' ' N ' ' A' ' 69' ' ' THR . 3.5 mp0 -62.88 -58.67 6.57 Favored 'General case' 0 C--O 1.255 1.351 0 C-N-CA 117.252 -1.779 . . . . 30.989999999999998 106.362 175.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . 0.542 ' CE2' HD12 ' A' ' 75' ' ' ILE . 43.7 t80 -38.9 -45.11 1.13 Allowed 'General case' 0 C--N 1.31 -1.145 0 O-C-N 119.773 -1.829 . . . . 29.170000000000002 111.233 178.392 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . 0.496 HD12 ' O ' ' A' ' 64' ' ' MET 0.33 31.4 mt -68.06 -27.02 66.15 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 112.361 -2.2 . . . . 19.600000000000001 111.124 -179.141 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . 0.548 ' N ' ' O ' ' A' ' 66' ' ' GLU . 87.1 m -65.68 -42.4 91.3 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 126.438 2.337 . . . . 21.48 111.069 176.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -170.09 88.24 0.54 Allowed Pre-proline 0 C--O 1.249 1.031 0 C-N-CA 124.475 1.11 . . . . 23.690000000000001 109.825 -177.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . 0.523 ' HB3' ' CE2' ' A' ' 67' ' ' TYR . 50.5 Cg_exo -50.86 -61.25 0.58 Allowed 'Trans proline' 0 C--O 1.237 0.454 0 O-C-N 126.343 2.76 . . . . 20.82 116.485 -177.225 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' M3L . . . . . 0.529 HM12 ' O ' ' A' ' 78' ' ' THR . . . . . . . . 0 N--CA 1.479 0.988 0 O-C-N 127.267 2.854 . . . . 23.460000000000001 108.204 -178.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.59 -46.21 22.87 Favored 'General case' 0 C--O 1.249 1.045 0 CA-C-N 113.26 -1.791 . . . . 20.59 109.198 177.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . 0.57 ' HE2' HG21 ' A' ' 57' ' ' VAL . 22.3 t80 -65.33 -43.05 92.18 Favored 'General case' 0 C--O 1.257 1.456 0 CA-C-N 122.015 2.189 . . . . 24.66 111.052 178.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.722 ' O ' HG22 ' A' ' 78' ' ' THR 0.27 0.1 OUTLIER -129.14 78.8 75.55 Favored Pre-proline 0 C--O 1.259 1.574 0 O-C-N 127.939 3.274 . . . . 20.010000000000002 115.803 176.439 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -62.55 115.15 2.71 Favored 'Trans proline' 0 C--O 1.255 1.346 0 N-CA-C 107.265 -1.86 . . . . 18.350000000000001 107.265 177.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . 0.547 ' HA3' ' HB2' ' A' ' 51' ' ' ALA . . . 138.06 -34.13 2.17 Favored Glycine 0 C--O 1.275 2.663 0 N-CA-C 106.757 -2.537 . . . . 15.470000000000001 106.757 -177.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 75' ' ' ILE . 3.4 t -53.07 134.95 38.14 Favored 'General case' 0 C--O 1.26 1.633 0 O-C-N 128.083 2.873 . . . . 11.09 115.702 -176.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . 0.592 ' HG2' ' CGD' ' A' ' 104' ' ' HEM . 22.0 pttt -83.46 12.73 5.17 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 113.494 -3.283 . . . . 8.8200000000000003 107.842 179.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' MET . . . . . 0.447 ' HE3' ' CHC' ' A' ' 104' ' ' HEM . 6.1 ttt -73.13 113.29 10.01 Favored 'General case' 0 C--N 1.381 1.95 0 C-N-CA 115.258 -2.577 . . . . 11.94 109.853 179.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -91.34 88.93 7.05 Favored 'General case' 0 N--CA 1.484 1.232 1 O-C-N 129.451 4.219 . . . . 15.69 106.627 177.685 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PHE . . . . . 0.485 ' CE1' ' CA ' ' A' ' 84' ' ' GLY . 73.5 t80 -164.31 124.28 2.03 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 112.348 -2.206 . . . . 26.030000000000001 105.725 -178.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -66.8 -32.04 80.04 Favored Glycine 0 C--O 1.245 0.816 1 O-C-N 130.445 4.841 . . . . 22.670000000000002 109.754 -178.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . 0.485 ' CA ' ' CE1' ' A' ' 82' ' ' PHE . . . 123.56 -161.38 17.9 Favored Glycine 0 N--CA 1.506 3.35 0 N-CA-C 105.604 -2.998 . . . . 22.699999999999999 105.604 -179.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . 0.47 ' HG ' HH11 ' A' ' 13' ' ' ARG . 1.2 mt -131.64 110.36 10.87 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 129.202 3.001 . . . . 17.620000000000001 106.322 177.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . 0.649 ' HE2' ' O ' ' A' ' 158' ' ' HOH . 0.0 OUTLIER -65.52 -34.97 79.5 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 118.004 2.594 . . . . 33.57 118.004 -174.329 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . 0.742 ' O ' ' HG3' ' A' ' 91' ' ' ARG . 7.4 mttt -93.13 134.41 35.32 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 124.902 2.287 . . . . 23.399999999999999 115.706 -179.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -56.99 -50.19 73.45 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-N 109.761 -3.381 . . . . 17.170000000000002 111.7 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.77 -48.71 50.2 Favored 'General case' 0 C--O 1.249 1.071 0 C-N-CA 126.109 1.764 . . . . 13.890000000000001 114.963 177.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . 0.468 ' HB3' HD22 ' A' ' 85' ' ' LEU . 24.9 m-20 -66.15 -36.05 82.1 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 129.545 3.138 . . . . 16.760000000000002 109.947 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . 0.742 ' HG3' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -64.46 -54.93 24.74 Favored 'General case' 0 C--O 1.252 1.189 0 CA-C-N 111.75 -2.477 . . . . 14.69 107.258 177.701 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . 0.674 ' HA ' ' CE1' ' A' ' -3' ' ' PHE . 99.0 m-20 -47.74 -56.95 6.21 Favored 'General case' 0 C--O 1.267 1.979 0 CA-C-O 123.895 1.807 . . . . 10.91 111.088 -178.766 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . 0.575 ' OD1' ' HA3' ' A' ' 1' ' ' GLY . 66.1 m-20 -50.4 -63.89 0.98 Allowed 'General case' 1 C--O 1.319 4.726 0 C-N-CA 128.472 2.709 . . . . 6.0999999999999996 110.92 178.736 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . 0.806 HD13 ' HB2' ' A' ' 10' ' ' PHE 0.343 40.8 tp -57.06 -49.54 75.52 Favored 'General case' 0 N--CA 1.511 2.593 0 C-N-CA 115.512 -2.475 . . . . 2.7599999999999998 113.994 178.585 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . 0.559 ' O ' ' N ' ' A' ' 99' ' ' LYS . 56.3 mt -52.1 -39.53 26.92 Favored 'Isoleucine or valine' 0 C--O 1.286 2.978 0 O-C-N 117.733 -3.105 . . . . 8.5700000000000003 111.584 177.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . 0.508 ' O ' ' HB3' ' A' ' 99' ' ' LYS . 4.2 m -62.75 -43.86 97.72 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 101.07 -3.678 . . . . 7.79 101.07 -179.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . 0.681 ' HB2' ' HA3' ' A' ' 6' ' ' GLY . 68.4 t80 -58.5 -48.38 81.0 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 112.52 -2.127 . . . . 10.83 107.899 177.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 94' ' ' LEU 0.504 18.2 mt -66.68 -42.85 85.86 Favored 'General case' 0 C--O 1.274 2.383 0 C-N-CA 112.022 -3.871 . . . . 12.24 108.036 -175.127 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . 0.565 ' NZ ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -36.77 -56.04 0.86 Allowed 'General case' 0 C--N 1.311 -1.086 0 O-C-N 128.614 3.696 . . . . 12.08 108.221 178.075 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 103' ' ' GLU . 2.6 mtpt -66.01 -75.24 0.09 Allowed 'General case' 0 C--O 1.248 1.02 1 CA-C-N 108.255 -4.066 . . . . 19.949999999999999 115.848 -177.408 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . 0.399 . . -59.48 -43.55 93.23 Favored 'General case' 0 C--O 1.287 3.069 0 CA-C-O 112.726 -3.512 . . . . 17.050000000000001 119.24 -176.263 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . 0.949 HG21 HG22 ' A' ' 35' ' ' ILE . 82.5 p -61.58 -1.07 0.5 Allowed 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 124.785 3.448 . . . . 18.140000000000001 112.884 -176.751 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 100' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.276 2.488 0 N-CA-C 120.534 3.531 . . . . 26.670000000000002 120.534 -174.175 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HEM . . . . . 0.684 HBD1 ' O ' ' A' ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . 0.412 ' O ' ' C ' ' A' ' 30' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . 0.418 ' O ' ' HA ' ' A' ' 46' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . 0.692 ' O ' ' HB3' ' A' ' 60' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . 0.509 ' O ' ' HE3' ' A' ' 27' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . 0.658 ' O ' ' HB3' ' A' ' 16' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . 0.465 ' O ' ' HD2' ' A' ' 22' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . 0.417 ' O ' ' HB3' ' A' ' 103' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . 0.649 ' O ' ' HE2' ' A' ' 86' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . 0.684 ' O ' HBD1 ' A' ' 104' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' HOH . . . . . 0.69 ' O ' ' HA ' ' A' ' 19' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . 0.469 ' O ' HD11 ' A' ' 15' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . 0.419 ' O ' ' CA ' ' A' ' 84' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 125.509 2.575 . . . . 55.240000000000002 108.168 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -137.19 44.09 2.31 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 110.16 -3.2 . . . . 58.270000000000003 112.191 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' PHE . . . . . 0.674 ' CE1' ' HA ' ' A' ' 92' ' ' ASN . 64.5 t80 -164.58 113.1 1.1 Allowed 'General case' 0 C--O 1.256 1.421 0 C-N-CA 124.682 1.193 . . . . 48.82 109.007 177.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 11.3 mtmm -114.99 141.72 47.6 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 125.782 1.926 . . . . 49.340000000000003 108.283 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -62.66 127.78 32.9 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 124.527 1.131 . . . . 36.340000000000003 111.024 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.575 ' HA3' ' OD1' ' A' ' 93' ' ' ASP . . . -99.98 -146.28 19.4 Favored Glycine 0 CA--C 1.545 1.961 0 N-CA-C 106.785 -2.526 . . . . 30.859999999999999 106.785 177.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . 0.522 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 6.6 t -95.17 131.98 40.61 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 125.584 1.554 . . . . 27.140000000000001 111.961 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.46 -58.61 5.95 Favored 'General case' 0 C--O 1.255 1.342 0 O-C-N 126.91 2.631 . . . . 21.77 106.15 174.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -49.13 -41.67 36.89 Favored 'General case' 0 C--O 1.256 1.427 0 CA-C-O 125.424 2.535 . . . . 19.59 112.637 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 2' ' ' SER . 3.4 tppt? -59.46 -55.92 28.49 Favored 'General case' 0 C--O 1.251 1.172 0 CA-C-N 112.39 -2.187 . . . . 11.43 108.205 179.116 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.681 ' HA3' ' HB2' ' A' ' 97' ' ' TYR . . . -50.68 -41.4 42.79 Favored Glycine 0 C--O 1.267 2.187 0 CA-C-O 115.997 -2.557 . . . . 10.24 117.508 -179.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.739 ' O ' ' HG3' ' A' ' 11' ' ' LYS . . . -55.55 -28.65 56.11 Favored 'General case' 0 N--CA 1.414 -2.232 1 CA-C-O 110.909 -4.377 . . . . 10.44 113.545 -179.575 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.385 71.7 p -97.57 -25.05 15.28 Favored 'General case' 0 C--O 1.275 2.434 1 O-C-N 129.139 4.025 . . . . 8.1799999999999997 115.782 -177.404 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.746 ' O ' ' N ' ' A' ' 13' ' ' ARG . 0.5 OUTLIER -73.18 -46.7 49.13 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 101.721 -3.437 . . . . 13.68 101.721 174.019 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.806 ' HB2' HD13 ' A' ' 94' ' ' LEU 0.26 43.3 t80 -51.69 -51.62 54.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.837 2.055 . . . . 6.8600000000000003 107.794 -178.256 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.739 ' HG3' ' O ' ' A' ' 7' ' ' ALA . 40.7 mttt -58.9 -59.48 5.38 Favored 'General case' 0 C--O 1.195 -1.815 0 N-CA-C 107.474 -1.306 . . . . 7.25 107.474 173.05 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.321 72.9 p -64.08 -31.01 72.04 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 114.923 -2.465 . . . . 9.2200000000000006 112.656 -178.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.746 ' N ' ' O ' ' A' ' 9' ' ' LEU . 34.2 mtp180 -118.37 -8.55 10.53 Favored 'General case' 0 C--O 1.277 2.505 1 N-CA-C 124.068 4.84 . . . . 22.73 124.068 -175.551 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.489 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 11.1 m -138.34 -19.16 1.1 Allowed 'General case' 0 C--N 1.276 -2.61 0 CA-C-N 122.283 2.311 . . . . 9.4600000000000009 109.7 -175.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.469 HD11 ' O ' ' A' ' 218' ' ' HOH . 27.7 tp -61.06 -37.85 84.11 Favored 'General case' 0 C--O 1.295 3.46 0 CA-C-N 121.283 1.856 . . . . 11.34 114.453 -179.2 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.77 ' HG2' ' SG ' ' A' ' 17' ' ' CYS . 26.7 tt0 -42.94 -42.01 3.57 Favored 'General case' 0 C--O 1.264 1.819 0 O-C-N 124.751 1.282 . . . . 8.1999999999999993 107.857 177.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.77 ' SG ' ' HG2' ' A' ' 16' ' ' GLN . 10.7 m -125.68 13.36 8.04 Favored 'General case' 1 C--O 1.309 4.232 1 C-N-CA 107.35 -5.74 . . . . 6.4299999999999997 116.776 -178.214 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -150.12 154.78 38.65 Favored 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 123.915 1.817 . . . . 6.7599999999999998 113.653 -172.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . 0.824 ' OG1' ' HB2' ' A' ' 31' ' ' ASN . 80.4 p -123.89 148.46 46.81 Favored 'General case' 0 CA--C 1.574 1.898 0 N-CA-C 104.227 -2.508 . . . . 3.8799999999999999 104.227 177.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.574 ' O ' ' HB2' ' A' ' 33' ' ' HIS . 2.9 m -111.2 -25.32 3.57 Favored 'Isoleucine or valine' 0 C--O 1.275 2.427 0 CA-C-O 127.926 3.727 . . . . 13.44 114.678 -174.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.578 ' OE1' ' HB ' ' A' ' 19' ' ' THR . 0.0 OUTLIER -75.49 132.02 40.5 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 111.226 -2.715 . . . . 23.34 116.828 -175.018 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.465 ' HD2' ' O ' ' A' ' 133' ' ' HOH . 0.0 OUTLIER -58.93 126.91 29.66 Favored 'General case' 0 C--O 1.256 1.407 0 CA-C-N 118.884 0.766 . . . . 22.100000000000001 110.607 179.625 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.66 12.14 78.35 Favored Glycine 0 N--CA 1.501 3.017 1 C-N-CA 113.386 -4.245 . . . . 12.09 108.469 177.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -92.56 154.38 22.14 Favored Glycine 1 CA--C 1.579 4.053 1 N-CA-C 101.717 -4.553 . . . . 10.039999999999999 101.717 174.68 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.543 ' HD2' HG21 ' A' ' 19' ' ' THR . 60.0 Cg_endo -82.08 156.93 17.63 Favored 'Trans proline' 0 C--O 1.273 2.234 1 CA-C-O 129.848 4.02 . . . . 9.7799999999999994 121.516 -178.812 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.535 ' CE1' ' HB1' ' A' ' 43' ' ' ALA . 16.4 m-70 -84.59 140.65 31.24 Favored 'General case' 0 CA--C 1.577 2.01 0 CA-C-N 108.735 -3.848 . . . . 13.94 101.573 175.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.509 ' HE3' ' O ' ' A' ' 125' ' ' HOH . 15.6 mtmt -128.58 -122.74 0.23 Allowed 'General case' 0 C--O 1.275 2.434 1 O-C-N 131.309 5.381 . . . . 11.43 108.228 -179.261 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.621 ' HB ' ' HB3' ' A' ' 17' ' ' CYS . 74.2 t -67.37 -56.5 13.22 Favored 'Isoleucine or valine' 0 C--O 1.264 1.843 0 O-C-N 128.202 3.439 . . . . 6.1299999999999999 107.814 176.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -96.7 168.5 25.08 Favored Glycine 1 CA--C 1.597 5.173 1 N-CA-C 96.716 -6.554 . . . . 2.9700000000000002 96.716 176.173 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.412 ' C ' ' O ' ' A' ' 110' ' ' HOH . 22.0 Cg_endo -78.72 165.43 24.73 Favored 'Trans proline' 0 C--N 1.321 -0.879 1 O-C-N 130.002 4.685 . . . . 2.25 116.815 -175.284 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.824 ' HB2' ' OG1' ' A' ' 19' ' ' THR . 0.3 OUTLIER -77.81 144.53 36.99 Favored 'General case' 0 C--O 1.3 3.735 2 O-C-N 131.575 5.547 . . . . 5.9699999999999998 102.66 178.925 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.0 mt -95.42 1.27 54.1 Favored 'General case' 0 C--O 1.298 3.619 0 N-CA-C 115.286 1.588 . . . . 7.6900000000000004 115.286 -176.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.574 ' HB2' ' O ' ' A' ' 20' ' ' VAL 0.283 17.3 t60 -55.9 127.66 31.38 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 115.041 -2.664 . . . . 12.470000000000001 109.17 -176.964 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.1 24.39 61.67 Favored Glycine 0 N--CA 1.411 -3.012 0 CA-C-N 111.28 -2.691 . . . . 9.1099999999999994 110.853 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.949 HG22 HG21 ' A' ' 102' ' ' THR . 11.2 tp -59.28 -35.76 59.83 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 115.57 1.692 . . . . 17.289999999999999 115.57 178.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 59' ' ' TRP 0.347 70.5 m-85 -68.71 123.56 21.24 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-O 123.041 1.4 . . . . 14.77 113.186 -176.731 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.428 ' N ' ' O ' ' A' ' 59' ' ' TRP . . . 98.44 -19.84 52.81 Favored Glycine 0 C--O 1.248 0.971 0 CA-C-N 113.749 -1.569 . . . . 14.52 113.382 -178.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . 0.336 0.0 OUTLIER -90.39 152.59 20.92 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 105.83 -1.915 . . . . 15.68 105.83 -179.402 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.561 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 65.6 m80 -84.82 147.89 26.59 Favored 'General case' 0 C--N 1.311 -1.097 1 O-C-N 131.413 5.446 . . . . 20.02 105.551 179.612 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . 0.453 ' HA ' ' O2A' ' A' ' 104' ' ' HEM . 48.5 p -63.11 140.1 58.84 Favored 'General case' 0 C--O 1.264 1.854 0 O-C-N 126.075 2.11 . . . . 14.33 109.627 -178.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.411 ' HA2' ' CZ ' ' A' ' 48' ' ' TYR . . . 84.31 31.48 25.13 Favored Glycine 0 CA--C 1.503 -0.697 0 CA-C-N 111.969 -2.378 . . . . 14.02 117.607 177.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . 0.25 9.0 mm100 -112.04 -3.18 14.83 Favored 'General case' 0 C--O 1.267 2.002 0 N-CA-C 117.881 2.549 . . . . 18.649999999999999 117.881 -176.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.535 ' HB1' ' CE1' ' A' ' 26' ' ' HIS . . . -63.29 120.05 10.82 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 106.015 -1.846 . . . . 15.609999999999999 106.015 175.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.6 132.3 34.91 Favored 'General case' 0 C--O 1.265 1.893 1 O-C-N 131.464 5.477 . . . . 19.879999999999999 107.128 179.158 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 100.64 13.24 35.53 Favored Glycine 0 C--O 1.26 1.726 0 C-N-CA 129.864 3.602 . . . . 13.220000000000001 109.375 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.475 ' OH ' HMD2 ' A' ' 104' ' ' HEM . 49.3 t80 -123.42 136.28 54.54 Favored 'General case' 0 C--O 1.258 1.532 0 C-N-CA 117.329 -1.748 . . . . 12.869999999999999 110.492 -179.828 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . 0.254 22.9 t -99.52 83.82 2.86 Favored 'General case' 0 C--N 1.358 0.978 0 CA-C-O 122.837 1.303 . . . . 18.550000000000001 108.194 -177.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.411 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 81.7 m-85 -70.58 140.66 51.75 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 129.554 3.142 . . . . 19.190000000000001 106.235 177.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . 0.56 HG23 ' HG2' ' A' ' 79' ' ' LYS . 28.0 p -63.61 162.49 12.91 Favored 'General case' 0 CA--C 1.558 1.257 0 O-C-N 124.501 1.126 . . . . 22.890000000000001 108.025 176.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.717 ' OD2' ' HE2' ' A' ' 54' ' ' LYS . 0.8 OUTLIER -54.15 -45.95 72.15 Favored 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 125.789 1.931 . . . . 30.210000000000001 108.049 179.193 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.547 ' HB2' ' HA3' ' A' ' 77' ' ' GLY . . . -49.36 -48.02 47.05 Favored 'General case' 0 C--O 1.282 2.813 0 O-C-N 128.475 3.609 . . . . 29.469999999999999 113.043 -179.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 55' ' ' LYS . 21.5 t-20 -51.44 -69.23 0.12 Allowed 'General case' 0 C--O 1.249 1.057 0 O-C-N 127.726 3.141 . . . . 30.469999999999999 110.942 -178.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.758 HG22 ' HD2' ' A' ' 54' ' ' LYS 0.284 0.2 OUTLIER -36.39 -55.09 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 C-N-CA 129.807 3.243 . . . . 31.149999999999999 114.407 -178.801 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.758 ' HD2' HG22 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -69.95 -27.01 64.39 Favored 'General case' 0 C--O 1.249 1.069 0 C-N-CA 127.733 2.413 . . . . 31.870000000000001 114.017 -178.416 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.889 ' HG3' HG23 ' A' ' 57' ' ' VAL . 42.4 tptt -57.8 -56.2 25.05 Favored 'General case' 0 C--N 1.312 -1.042 0 O-C-N 127.448 2.968 . . . . 35.579999999999998 105.699 178.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 58.47 54.46 5.52 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 109.082 -3.69 . . . . 38.259999999999998 114.3 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.889 HG23 ' HG3' ' A' ' 55' ' ' LYS . 3.3 t -79.29 140.91 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 116.85 -1.548 . . . . 38.030000000000001 113.17 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.514 HD23 ' CD2' ' A' ' 39' ' ' HIS . 0.2 OUTLIER -90.85 131.76 36.3 Favored 'General case' 0 N--CA 1.507 2.42 0 N-CA-C 103.033 -2.951 . . . . 35.200000000000003 103.033 176.593 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.562 ' O ' ' HA ' ' A' ' 36' ' ' PHE 0.263 25.5 m95 -94.47 100.43 12.42 Favored 'General case' 0 C--O 1.249 1.051 1 CA-C-O 128.569 4.033 . . . . 27.59 116.505 -176.415 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.692 ' HB3' ' O ' ' A' ' 124' ' ' HOH . 7.6 p30 -133.8 164.02 28.17 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 110.382 -3.099 . . . . 23.48 104.546 174.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.528 ' HG3' ' OD1' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -48.29 -28.47 3.13 Favored 'General case' 0 C--N 1.291 -1.969 0 C-N-CA 129.576 3.151 . . . . 28.050000000000001 117.208 -177.339 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.528 ' OD1' ' HG3' ' A' ' 61' ' ' GLU . 6.3 m120 -84.85 -54.39 4.71 Favored 'General case' 0 C--O 1.266 1.921 0 N-CA-C 115.631 1.715 . . . . 27.489999999999998 115.631 -176.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.52 ' OD1' HG13 ' A' ' 57' ' ' VAL . 1.2 t-20 -50.93 -50.41 57.72 Favored 'General case' 0 N--CA 1.519 2.983 0 CA-C-O 127.732 3.634 . . . . 27.420000000000002 105.379 178.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . 0.496 ' O ' HD12 ' A' ' 68' ' ' LEU . 10.2 tpp -55.53 -20.09 11.98 Favored 'General case' 0 C--O 1.279 2.633 0 CA-C-N 109.466 -3.516 . . . . 28.879999999999999 114.342 179.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . 0.471 ' OG ' ' NH1' ' A' ' 91' ' ' ARG 0.253 9.9 t -92.84 -41.71 9.93 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 127.617 3.073 . . . . 16.09 107.974 -179.85 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.548 ' O ' ' N ' ' A' ' 69' ' ' THR . 3.5 mp0 -62.88 -58.67 6.57 Favored 'General case' 0 C--O 1.255 1.351 0 C-N-CA 117.252 -1.779 . . . . 30.989999999999998 106.362 175.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.542 ' CE2' HD12 ' A' ' 75' ' ' ILE . 43.7 t80 -38.9 -45.11 1.13 Allowed 'General case' 0 C--N 1.31 -1.145 0 O-C-N 119.773 -1.829 . . . . 29.170000000000002 111.233 178.392 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.496 HD12 ' O ' ' A' ' 64' ' ' MET 0.33 31.4 mt -68.06 -27.02 66.15 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 112.361 -2.2 . . . . 19.600000000000001 111.124 -179.141 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . 0.548 ' N ' ' O ' ' A' ' 66' ' ' GLU . 87.1 m -65.68 -42.4 91.3 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 126.438 2.337 . . . . 21.48 111.069 176.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -170.09 88.24 0.54 Allowed Pre-proline 0 C--O 1.249 1.031 0 C-N-CA 124.475 1.11 . . . . 23.690000000000001 109.825 -177.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.523 ' HB3' ' CE2' ' A' ' 67' ' ' TYR . 50.5 Cg_exo -50.86 -61.25 0.58 Allowed 'Trans proline' 0 C--O 1.237 0.454 0 O-C-N 126.343 2.76 . . . . 20.82 116.485 -177.225 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' M3L . . . . . 0.529 HM12 ' O ' ' A' ' 78' ' ' THR . . . . . . . . 0 N--CA 1.479 0.988 0 O-C-N 127.267 2.854 . . . . 23.460000000000001 108.204 -178.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.59 -46.21 22.87 Favored 'General case' 0 C--O 1.249 1.045 0 CA-C-N 113.26 -1.791 . . . . 20.59 109.198 177.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.57 ' HE2' HG21 ' A' ' 57' ' ' VAL . 22.3 t80 -65.33 -43.05 92.18 Favored 'General case' 0 C--O 1.257 1.456 0 CA-C-N 122.015 2.189 . . . . 24.66 111.052 178.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.722 ' O ' HG22 ' A' ' 78' ' ' THR 0.27 0.1 OUTLIER -129.14 78.8 75.55 Favored Pre-proline 0 C--O 1.259 1.574 0 O-C-N 127.939 3.274 . . . . 20.010000000000002 115.803 176.439 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -62.55 115.15 2.71 Favored 'Trans proline' 0 C--O 1.255 1.346 0 N-CA-C 107.265 -1.86 . . . . 18.350000000000001 107.265 177.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.547 ' HA3' ' HB2' ' A' ' 51' ' ' ALA . . . 138.06 -34.13 2.17 Favored Glycine 0 C--O 1.275 2.663 0 N-CA-C 106.757 -2.537 . . . . 15.470000000000001 106.757 -177.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 75' ' ' ILE . 3.4 t -53.07 134.95 38.14 Favored 'General case' 0 C--O 1.26 1.633 0 O-C-N 128.083 2.873 . . . . 11.09 115.702 -176.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.592 ' HG2' ' CGD' ' A' ' 104' ' ' HEM . 22.0 pttt -83.46 12.73 5.17 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 113.494 -3.283 . . . . 8.8200000000000003 107.842 179.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' MET . . . . . 0.447 ' HE3' ' CHC' ' A' ' 104' ' ' HEM . 6.1 ttt -73.13 113.29 10.01 Favored 'General case' 0 C--N 1.381 1.95 0 C-N-CA 115.258 -2.577 . . . . 11.94 109.853 179.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -91.34 88.93 7.05 Favored 'General case' 0 N--CA 1.484 1.232 1 O-C-N 129.451 4.219 . . . . 15.69 106.627 177.685 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.485 ' CE1' ' CA ' ' A' ' 84' ' ' GLY . 73.5 t80 -164.31 124.28 2.03 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 112.348 -2.206 . . . . 26.030000000000001 105.725 -178.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -66.8 -32.04 80.04 Favored Glycine 0 C--O 1.245 0.816 1 O-C-N 130.445 4.841 . . . . 22.670000000000002 109.754 -178.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.485 ' CA ' ' CE1' ' A' ' 82' ' ' PHE . . . 123.56 -161.38 17.9 Favored Glycine 0 N--CA 1.506 3.35 0 N-CA-C 105.604 -2.998 . . . . 22.699999999999999 105.604 -179.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.47 ' HG ' HH11 ' A' ' 13' ' ' ARG . 1.2 mt -131.64 110.36 10.87 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 129.202 3.001 . . . . 17.620000000000001 106.322 177.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.649 ' HE2' ' O ' ' A' ' 158' ' ' HOH . 0.0 OUTLIER -65.52 -34.97 79.5 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 118.004 2.594 . . . . 33.57 118.004 -174.329 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.742 ' O ' ' HG3' ' A' ' 91' ' ' ARG . 7.4 mttt -93.13 134.41 35.32 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 124.902 2.287 . . . . 23.399999999999999 115.706 -179.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -56.99 -50.19 73.45 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-N 109.761 -3.381 . . . . 17.170000000000002 111.7 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.77 -48.71 50.2 Favored 'General case' 0 C--O 1.249 1.071 0 C-N-CA 126.109 1.764 . . . . 13.890000000000001 114.963 177.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.468 ' HB3' HD22 ' A' ' 85' ' ' LEU . 24.9 m-20 -66.15 -36.05 82.1 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 129.545 3.138 . . . . 16.760000000000002 109.947 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.742 ' HG3' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -64.46 -54.93 24.74 Favored 'General case' 0 C--O 1.252 1.189 0 CA-C-N 111.75 -2.477 . . . . 14.69 107.258 177.701 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.674 ' HA ' ' CE1' ' A' ' -3' ' ' PHE . 99.0 m-20 -47.74 -56.95 6.21 Favored 'General case' 0 C--O 1.267 1.979 0 CA-C-O 123.895 1.807 . . . . 10.91 111.088 -178.766 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.575 ' OD1' ' HA3' ' A' ' 1' ' ' GLY . 66.1 m-20 -50.4 -63.89 0.98 Allowed 'General case' 1 C--O 1.319 4.726 0 C-N-CA 128.472 2.709 . . . . 6.0999999999999996 110.92 178.736 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.806 HD13 ' HB2' ' A' ' 10' ' ' PHE 0.343 40.8 tp -57.06 -49.54 75.52 Favored 'General case' 0 N--CA 1.511 2.593 0 C-N-CA 115.512 -2.475 . . . . 2.7599999999999998 113.994 178.585 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.559 ' O ' ' N ' ' A' ' 99' ' ' LYS . 56.3 mt -52.1 -39.53 26.92 Favored 'Isoleucine or valine' 0 C--O 1.286 2.978 0 O-C-N 117.733 -3.105 . . . . 8.5700000000000003 111.584 177.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . 0.508 ' O ' ' HB3' ' A' ' 99' ' ' LYS . 4.2 m -62.75 -43.86 97.72 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 101.07 -3.678 . . . . 7.79 101.07 -179.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.681 ' HB2' ' HA3' ' A' ' 6' ' ' GLY . 68.4 t80 -58.5 -48.38 81.0 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 112.52 -2.127 . . . . 10.83 107.899 177.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 94' ' ' LEU 0.504 18.2 mt -66.68 -42.85 85.86 Favored 'General case' 0 C--O 1.274 2.383 0 C-N-CA 112.022 -3.871 . . . . 12.24 108.036 -175.127 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.565 ' NZ ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -36.77 -56.04 0.86 Allowed 'General case' 0 C--N 1.311 -1.086 0 O-C-N 128.614 3.696 . . . . 12.08 108.221 178.075 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 103' ' ' GLU . 2.6 mtpt -66.01 -75.24 0.09 Allowed 'General case' 0 C--O 1.248 1.02 1 CA-C-N 108.255 -4.066 . . . . 19.949999999999999 115.848 -177.408 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . 0.399 . . -59.48 -43.55 93.23 Favored 'General case' 0 C--O 1.287 3.069 0 CA-C-O 112.726 -3.512 . . . . 17.050000000000001 119.24 -176.263 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . 0.949 HG21 HG22 ' A' ' 35' ' ' ILE . 82.5 p -61.58 -1.07 0.5 Allowed 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 124.785 3.448 . . . . 18.140000000000001 112.884 -176.751 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 100' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.276 2.488 0 N-CA-C 120.534 3.531 . . . . 26.670000000000002 120.534 -174.175 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HEM . . . . . 0.684 HBD1 ' O ' ' A' ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . 0.412 ' O ' ' C ' ' A' ' 30' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . 0.418 ' O ' ' HA ' ' A' ' 46' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . 0.692 ' O ' ' HB3' ' A' ' 60' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . 0.509 ' O ' ' HE3' ' A' ' 27' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . 0.658 ' O ' ' HB3' ' A' ' 16' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . 0.465 ' O ' ' HD2' ' A' ' 22' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . 0.417 ' O ' ' HB3' ' A' ' 103' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . 0.649 ' O ' ' HE2' ' A' ' 86' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . 0.684 ' O ' HBD1 ' A' ' 104' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' HOH . . . . . 0.69 ' O ' ' HA ' ' A' ' 19' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . 0.469 ' O ' HD11 ' A' ' 15' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . 0.419 ' O ' ' CA ' ' A' ' 84' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_