data_1zkz_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 1zkz _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 ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.077 0 N-CA-C 113.803 1.038 . . . . 88.769999999999996 113.803 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -98.02 15.55 61.4 Favored Glycine 0 N--CA 1.473 1.112 0 N-CA-C 117.648 1.819 . . . . 86.540000000000006 117.648 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.2 t -116.01 34.35 5.02 Favored 'General case' 0 C--O 1.259 1.597 0 CA-C-O 122.758 1.266 . . . . 78.629999999999995 112.35 -178.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -92.14 172.54 8.36 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 114.05 -1.432 . . . . 69.810000000000002 113.755 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.4 t -53.07 119.76 5.08 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 125.448 1.499 . . . . 54.409999999999997 113.378 -176.011 -176.882 63.2 76.797 103.318 2.067 105.076 66.749 172.934 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -160.1 157.52 28.68 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 112.229 0.455 . . . . 56.740000000000002 112.229 -176.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.43 122.09 19.76 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 124.938 1.295 . . . . 53.810000000000002 110.69 175.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.8 p -127.32 169.75 13.22 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.74 -0.837 . . . . 47.189999999999998 108.74 170.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.4 t -72.44 139.16 47.58 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 115.963 -0.562 . . . . 50.270000000000003 110.847 -174.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.3 tp -144.98 105.29 4.08 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 115.759 -0.655 . . . . 47.840000000000003 109.319 166.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.8 ttt85 -88.22 121.74 30.97 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.381 -0.827 . . . . 70.420000000000002 111.051 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 76.1 t -109.53 117.59 54.88 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 O-C-N 124.177 0.923 . . . . 55.229999999999997 112.693 -174.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -87.51 123.06 32.01 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 114.946 -1.024 . . . . 63.770000000000003 110.195 173.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -66.82 -22.65 66.0 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.184 1.55 . . . . 69.459999999999994 115.184 -172.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -72.45 -53.58 11.75 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.258 -0.645 . . . . 85.370000000000005 109.258 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -36.14 -44.21 0.38 Allowed 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.897 1.073 . . . . 77.180000000000007 113.897 170.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.5 pt -98.21 8.88 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 N-CA-C 116.327 1.973 . . . . 74.620000000000005 116.327 -175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.55 17.93 78.21 Favored Glycine 0 C--O 1.264 2.011 0 N-CA-C 119.354 2.501 . . . . 76.510000000000005 119.354 -178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 14.9 m0 -97.18 -10.24 26.28 Favored 'General case' 0 C--O 1.253 1.287 0 N-CA-C 114.651 1.352 . . . . 81.609999999999999 114.651 -176.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -68.71 -11.28 60.03 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.874 -0.603 . . . . 92.180000000000007 112.385 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.6 p -65.32 -26.15 67.92 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 115.966 -0.561 . . . . 99.010000000000005 110.139 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 14.5 p-90 -128.63 -8.03 5.1 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.123 1.527 . . . . 100.76000000000001 115.123 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 11.1 mt -111.68 112.26 39.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 122.043 -0.411 . . . . 95.390000000000001 111.05 172.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 13.3 mt -70.64 -42.82 77.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 124.437 1.095 . . . . 90.859999999999999 110.446 173.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.05 146.88 15.5 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 113.433 0.901 . . . . 83.769999999999996 113.433 -171.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.97 176.75 42.36 Favored 'Cis proline' 0 CA--C 1.55 1.286 0 C-N-CA 124.309 -1.121 . . . . 76.159999999999997 112.722 -4.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -70.37 -37.91 74.67 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.707 0.803 . . . . 81.109999999999999 112.09 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.36 145.9 39.56 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 126.0 1.72 . . . . 71.969999999999999 107.845 -172.688 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -137.61 162.67 33.17 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 120.994 -0.283 . . . . 56.759999999999998 110.7 166.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -82.77 97.98 8.87 Favored 'General case' 0 C--O 1.214 -0.771 0 CA-C-N 115.973 -0.558 . . . . 54.240000000000002 110.889 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.7 164.23 17.77 Favored 'General case' 0 CA--C 1.491 -1.305 1 N-CA-C 97.838 -4.875 . . . . 42.329999999999998 97.838 176.375 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -106.14 -172.47 2.09 Favored 'General case' 0 C--N 1.28 -2.419 2 C-N-CA 104.1 -7.04 . . . . 45.259999999999998 107.502 168.563 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -131.85 152.69 50.85 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 106.223 -1.769 . . . . 51.5 106.223 165.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 92.1 m -104.74 108.28 19.67 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.067 0.947 . . . . 42.590000000000003 109.774 169.911 -70.101 -59.864 -89.776 105.671 2.06 105.685 -68.456 -66.364 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -113.52 147.27 38.24 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.585 0.957 . . . . 56.439999999999998 113.585 -176.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 126.18 -163.8 19.98 Favored Glycine 0 CA--C 1.502 -0.743 0 N-CA-C 108.684 -1.766 . . . . 46.109999999999999 108.684 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -132.24 165.77 23.5 Favored Glycine 0 CA--C 1.505 -0.588 0 N-CA-C 109.349 -1.5 . . . . 45.539999999999999 109.349 -174.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 78.1 m -118.65 99.17 6.62 Favored 'General case' 0 C--O 1.248 1.014 0 N-CA-C 104.956 -2.239 . . . . 46.710000000000001 104.956 -179.873 -60.782 -83.165 -93.19 102.005 2.038 102.257 -77.656 -74.173 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.7 p90 -142.53 160.7 39.77 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.268 -1.333 . . . . 56.259999999999998 108.951 175.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -79.99 146.16 62.95 Favored Pre-proline 0 C--N 1.317 -0.821 0 C-N-CA 119.813 -0.755 . . . . 55.579999999999998 112.026 175.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.3 137.84 52.37 Favored 'Cis proline' 0 C--N 1.355 0.918 0 N-CA-C 109.784 -0.891 . . . . 63.57 109.784 -3.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.7 mt -66.55 143.45 57.04 Favored 'General case' 0 C--O 1.253 1.288 0 C-N-CA 119.135 -1.026 . . . . 70.25 112.361 -173.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.55 143.97 44.24 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.186 -1.042 . . . . 76.019999999999996 108.186 167.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -69.59 -31.21 69.23 Favored 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 113.903 1.075 . . . . 79.010000000000005 113.903 -163.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -103.57 34.81 2.82 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 113.056 0.761 . . . . 79.379999999999995 113.056 -170.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . 0.486 ' O ' ' CG1' ' A' ' 49' ' ' VAL . 12.2 t -110.92 -4.3 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 CA-C-O 121.536 0.684 . . . . 70.019999999999996 112.792 -168.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . 0.587 ' CG2' ' O ' ' A' ' 131' ' ' HOH . 94.2 m 102.18 -23.8 0.0 OUTLIER Pre-proline 0 C--O 1.265 1.878 1 O-C-N 115.975 -4.203 . . . . 63.270000000000003 117.544 152.344 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 50' ' ' THR . 74.1 Cg_endo -44.21 151.27 0.54 Allowed 'Trans proline' 1 C--N 1.584 12.922 2 O-C-N 95.213 -13.625 . . . . 55.259999999999998 114.956 -129.807 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 72.6 p -77.61 161.95 27.44 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.591 -1.186 . . . . 46.960000000000001 107.917 175.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.7 mttp -62.33 -41.75 98.82 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.193 0.442 . . . . 43.759999999999998 112.193 172.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -53.43 -47.89 69.25 Favored 'General case' 0 CA--C 1.564 1.481 0 N-CA-C 115.312 1.597 . . . . 36.420000000000002 115.312 172.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.52 -44.48 80.83 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.624 -0.673 . . . . 33.93 111.509 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 56.1 mt -58.19 -49.48 81.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 113.206 0.817 . . . . 36.289999999999999 113.206 173.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.8 t -66.66 -43.48 90.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.768 0.795 . . . . 37.909999999999997 108.869 -177.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -61.31 -44.93 96.39 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 114.21 1.189 . . . . 43.289999999999999 114.21 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.3 m -57.09 -38.94 74.06 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 112.28 0.474 . . . . 35.409999999999997 112.28 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 mt -68.78 -46.53 68.5 Favored 'General case' 0 C--N 1.349 0.545 0 N-CA-C 112.691 0.626 . . . . 37.530000000000001 112.691 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 79.7 t -60.55 -39.41 81.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 113.429 0.899 . . . . 38.18 113.429 173.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HIS . . . . . 0.538 ' CD2' ' O ' ' A' ' 69' ' ' VAL . 44.9 t-80 -62.51 -35.74 80.34 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.188 1.181 . . . . 40.0 114.188 174.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 mt -63.12 -37.61 87.91 Favored 'General case' 0 C--O 1.207 -1.15 0 CA-C-N 118.758 0.708 . . . . 48.799999999999997 111.016 174.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -77.68 -37.78 48.97 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.358 -0.537 . . . . 59.170000000000002 112.17 -176.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -128.28 66.47 73.1 Favored Pre-proline 0 CA--C 1.544 0.712 0 CA-C-N 116.255 -0.429 . . . . 54.670000000000002 110.275 -177.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.32 -18.1 63.16 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 N-CA-C 115.678 1.376 . . . . 50.399999999999999 115.678 -170.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 66.7 p -93.65 -17.72 22.95 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 113.064 0.764 . . . . 53.32 113.064 -176.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -104.95 -23.48 12.97 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 114.254 1.205 . . . . 66.939999999999998 114.254 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . 0.538 ' O ' ' CD2' ' A' ' 62' ' ' HIS . 57.4 t -132.14 134.82 59.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 108.738 -0.838 . . . . 46.729999999999997 108.738 -171.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.32 169.92 53.77 Favored Glycine 0 C--O 1.259 1.661 0 N-CA-C 111.189 -0.764 . . . . 41.689999999999998 111.189 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -86.68 166.45 15.32 Favored 'General case' 0 C--O 1.249 1.057 0 CA-C-O 121.766 0.793 . . . . 52.460000000000001 111.146 172.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 152.24 32.67 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.595 -0.891 . . . . 36.549999999999997 108.595 163.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 64.2 m -111.82 140.89 46.09 Favored 'General case' 0 C--O 1.221 -0.439 0 O-C-N 124.198 0.936 . . . . 44.090000000000003 110.669 -174.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 31.0 t -85.87 118.27 25.25 Favored 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 106.207 -1.775 . . . . 42.670000000000002 106.207 174.92 172.934 66.749 76.797 105.076 2.067 103.318 63.2 -176.882 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.5 m -142.86 158.95 58.35 Favored Pre-proline 0 C--O 1.222 -0.345 0 C-N-CA 122.975 0.51 . . . . 35.039999999999999 111.35 -172.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.67 134.51 38.25 Favored 'Trans proline' 0 N--CA 1.447 -1.251 0 N-CA-C 108.191 -1.503 . . . . 35.009999999999998 108.191 170.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 72.6 p -120.19 -6.96 9.89 Favored 'General case' 0 C--O 1.243 0.745 0 O-C-N 123.765 0.666 . . . . 42.590000000000003 110.681 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -146.93 138.63 24.34 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 107.919 -1.141 . . . . 53.479999999999997 107.919 169.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -124.12 149.58 46.06 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 123.168 0.293 . . . . 43.920000000000002 111.585 -175.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.0 m -114.04 153.78 46.18 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 122.482 0.313 . . . . 47.57 111.302 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -80.41 164.37 21.48 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 121.034 1.156 . . . . 51.289999999999999 111.847 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.3 pt -133.07 174.99 12.43 Favored 'Isoleucine or valine' 0 C--O 1.244 0.777 0 N-CA-C 108.893 -0.78 . . . . 58.100000000000001 108.893 161.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.6 m -104.07 137.76 41.56 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.905 -0.588 . . . . 67.25 109.503 174.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 21.6 m -127.36 154.16 37.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 114.857 -1.065 . . . . 82.459999999999994 112.954 170.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 tp -104.31 111.27 23.83 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.823 -1.081 . . . . 100.94 109.407 171.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -119.82 176.22 5.51 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.772 0.656 . . . . 123.28 112.772 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 44.0 mttt -108.02 136.89 46.95 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.996 1.48 . . . . 145.16999999999999 114.996 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -95.49 -169.94 2.06 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 113.425 0.898 . . . . 163.75999999999999 113.425 177.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -63.19 -37.73 88.37 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 115.274 1.583 . . . . 176.96000000000001 115.274 -169.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 33.4 ttp -86.97 6.49 31.96 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.004 0.431 . . . . 182.74000000000001 110.76 174.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 80.33 20.08 67.69 Favored Glycine 0 N--CA 1.461 0.306 0 CA-C-N 116.058 -0.519 . . . . 176.33000000000001 112.46 -178.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -77.08 124.65 87.3 Favored Pre-proline 0 C--O 1.236 0.386 0 N-CA-C 111.394 0.146 . . . . 163.41 111.394 178.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -62.54 123.21 11.98 Favored 'Trans proline' 0 C--N 1.35 0.632 0 N-CA-C 108.507 -1.382 . . . . 147.5 108.507 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -128.81 141.54 51.27 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 123.881 0.738 . . . . 129.44999999999999 112.645 -177.323 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -94.73 124.81 38.99 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.323 -0.853 . . . . 110.14 109.606 -174.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.71 110.6 22.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.054 -1.832 . . . . 93.810000000000002 106.054 168.322 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -71.51 -53.83 12.55 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 119.663 -0.815 . . . . 80.340000000000003 112.13 -168.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -112.85 92.92 4.19 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.228 0.825 . . . . 69.769999999999996 113.228 170.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -87.38 102.33 14.42 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.574 -0.739 . . . . 61.32 109.317 172.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -73.47 145.19 45.89 Favored 'General case' 0 C--O 1.221 -0.403 0 N-CA-C 115.227 1.565 . . . . 61.490000000000002 115.227 -164.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 87.5 25.84 31.91 Favored Glycine 0 N--CA 1.464 0.56 0 CA-C-N 115.421 -0.809 . . . . 47.219999999999999 114.77 168.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 95.6 mmm -93.5 -32.78 14.04 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 116.269 1.951 . . . . 42.57 116.269 -169.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 56.0 m -126.91 147.81 50.06 Favored 'General case' 0 CA--C 1.482 -1.653 0 C-N-CA 124.342 1.057 . . . . 44.689999999999998 111.15 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 31.0 t -71.35 126.99 32.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 O-C-N 123.949 0.781 . . . . 39.420000000000002 110.901 174.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -95.88 -41.75 8.65 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 118.975 -0.536 . . . . 41.289999999999999 111.274 167.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -137.95 147.88 44.72 Favored 'General case' 0 C--O 1.208 -1.104 0 C-N-CA 124.276 1.031 . . . . 54.740000000000002 113.053 175.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' CYS . . . . . . . . . . . . . 93.1 m -108.21 155.58 20.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.518 1.527 . . . . 47.270000000000003 110.263 172.587 -66.364 -68.456 -89.776 105.685 2.06 105.671 -59.864 -70.101 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -165.93 172.24 41.28 Favored Glycine 0 CA--C 1.508 -0.38 0 O-C-N 121.382 -0.824 . . . . 37.670000000000002 111.311 173.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' CYS . . . . . 0.402 ' SG ' ' CG1' ' A' ' 49' ' ' VAL . 59.7 m -96.96 133.6 41.4 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.325 -1.731 . . . . 43.240000000000002 106.325 -178.535 -74.173 -77.656 -93.19 102.257 2.038 102.005 -83.165 -60.782 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 79.8 mmt-85 . . . . . 0 CA--C 1.49 -1.344 0 N-CA-C 111.753 0.279 . . . . 35.539999999999999 111.753 -171.17 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' 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 ' 131' ' ' HOH . . . . . 0.587 ' O ' ' CG2' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' 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 ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' 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 build full ' A' A ' 4' ' ' ALA . . . . . 0.446 ' HB3' ' CE1' ' A' ' 7' ' ' HIS . . . . . . . . 0 N--CA 1.501 2.077 0 N-CA-C 113.803 1.038 . . . . 88.77 113.803 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -98.02 15.55 61.4 Favored Glycine 0 N--CA 1.473 1.112 0 N-CA-C 117.648 1.819 . . . . 86.54 117.648 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.2 t -116.01 34.35 5.02 Favored 'General case' 0 C--O 1.259 1.597 0 CA-C-O 122.758 1.266 . . . . 78.63 112.35 -178.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HIS . . . . . 0.514 ' CB ' ' HB2' ' A' ' 46' ' ' ALA . 54.2 m80 -92.14 172.54 8.36 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 114.05 -1.432 . . . . 69.81 113.755 -178.703 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.4 t -53.07 119.76 5.08 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 125.448 1.499 . . . . 54.41 113.378 -176.011 -176.882 63.2 76.797 103.318 2.067 105.076 66.749 172.934 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -160.1 157.52 28.68 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 112.229 0.455 . . . . 56.74 112.229 -176.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.43 122.09 19.76 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 124.938 1.295 . . . . 53.81 110.69 175.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.8 p -127.32 169.75 13.22 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.74 -0.837 . . . . 47.19 108.74 170.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.4 t -72.44 139.16 47.58 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 115.963 -0.562 . . . . 50.27 110.847 -174.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.3 tp -144.98 105.29 4.08 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 115.759 -0.655 . . . . 47.84 109.319 166.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.8 ttt85 -88.22 121.74 30.97 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.381 -0.827 . . . . 70.42 111.051 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 76.1 t -109.53 117.59 54.88 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 O-C-N 124.177 0.923 . . . . 55.23 112.693 -174.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . 0.417 ' HA ' ' HG3' ' A' ' 31' ' ' GLU . 22.4 t-20 -87.51 123.06 32.01 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 114.946 -1.024 . . . . 63.77 110.195 173.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -66.82 -22.65 66.0 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.184 1.55 . . . . 69.46 115.184 -172.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -72.45 -53.58 11.75 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.258 -0.645 . . . . 85.37 109.258 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -36.14 -44.21 0.38 Allowed 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.897 1.073 . . . . 77.18 113.897 170.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.5 pt -98.21 8.88 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 N-CA-C 116.327 1.973 . . . . 74.62 116.327 -175.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.55 17.93 78.21 Favored Glycine 0 C--O 1.264 2.011 0 N-CA-C 119.354 2.501 . . . . 76.51 119.354 -178.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 14.9 m0 -97.18 -10.24 26.28 Favored 'General case' 0 C--O 1.253 1.287 0 N-CA-C 114.651 1.352 . . . . 81.61 114.651 -176.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -68.71 -11.28 60.03 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.874 -0.603 . . . . 92.18 112.385 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.6 p -65.32 -26.15 67.92 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 115.966 -0.561 . . . . 99.01 110.139 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 14.5 p-90 -128.63 -8.03 5.1 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.123 1.527 . . . . 100.76 115.123 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 11.1 mt -111.68 112.26 39.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 122.043 -0.411 . . . . 95.39 111.05 172.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . 0.513 HD11 ' HG3' ' A' ' 87' ' ' LYS . 13.3 mt -70.64 -42.82 77.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 124.437 1.095 . . . . 90.86 110.446 173.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.05 146.88 15.5 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 113.433 0.901 . . . . 83.77 113.433 -171.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.97 176.75 42.36 Favored 'Cis proline' 0 CA--C 1.55 1.286 0 C-N-CA 124.309 -1.121 . . . . 76.16 112.722 -4.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -70.37 -37.91 74.67 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.707 0.803 . . . . 81.11 112.09 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . 0.417 ' HG3' ' HA ' ' A' ' 16' ' ' ASN . 0.7 OUTLIER -139.36 145.9 39.56 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 126.0 1.72 . . . . 71.97 107.845 -172.688 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -137.61 162.67 33.17 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 120.994 -0.283 . . . . 56.76 110.7 166.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -82.77 97.98 8.87 Favored 'General case' 0 C--O 1.214 -0.771 0 CA-C-N 115.973 -0.558 . . . . 54.24 110.889 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.7 164.23 17.77 Favored 'General case' 0 CA--C 1.491 -1.305 1 N-CA-C 97.838 -4.875 . . . . 42.33 97.838 176.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' TYR . . . . . 0.649 ' HB2' ' HB ' ' A' ' 104' ' ' VAL . 44.9 m-85 -106.14 -172.47 2.09 Favored 'General case' 0 C--N 1.28 -2.419 2 C-N-CA 104.1 -7.04 . . . . 45.26 107.502 168.563 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' OE1' ' HE3' ' A' ' 38' ' ' LYS . 33.9 tt0 -131.85 152.69 50.85 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 106.223 -1.769 . . . . 51.5 106.223 165.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 92.1 m -104.74 108.28 19.67 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.067 0.947 . . . . 42.59 109.774 169.911 -70.101 -59.864 -89.776 105.671 2.06 105.685 -68.456 -66.364 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . 0.415 ' HE3' ' OE1' ' A' ' 36' ' ' GLU . 72.6 mttt -113.52 147.27 38.24 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.585 0.957 . . . . 56.44 113.585 -176.59 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 126.18 -163.8 19.98 Favored Glycine 0 CA--C 1.502 -0.743 0 N-CA-C 108.684 -1.766 . . . . 46.11 108.684 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -132.24 165.77 23.5 Favored Glycine 0 CA--C 1.505 -0.588 0 N-CA-C 109.349 -1.5 . . . . 45.54 109.349 -174.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 78.1 m -118.65 99.17 6.62 Favored 'General case' 0 C--O 1.248 1.014 0 N-CA-C 104.956 -2.239 . . . . 46.71 104.956 -179.873 -60.782 -83.165 -93.19 102.005 2.038 102.257 -77.656 -74.173 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.7 p90 -142.53 160.7 39.77 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.268 -1.333 . . . . 56.26 108.951 175.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -79.99 146.16 62.95 Favored Pre-proline 0 C--N 1.317 -0.821 0 C-N-CA 119.813 -0.755 . . . . 55.58 112.026 175.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.3 137.84 52.37 Favored 'Cis proline' 0 C--N 1.355 0.918 0 N-CA-C 109.784 -0.891 . . . . 63.57 109.784 -3.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . 0.421 HD13 ' HG3' ' A' ' 51' ' ' PRO . 51.7 mt -66.55 143.45 57.04 Favored 'General case' 0 C--O 1.253 1.288 0 C-N-CA 119.135 -1.026 . . . . 70.25 112.361 -173.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . 0.514 ' HB2' ' CB ' ' A' ' 7' ' ' HIS . . . -58.55 143.97 44.24 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.186 -1.042 . . . . 76.02 108.186 167.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -69.59 -31.21 69.23 Favored 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 113.903 1.075 . . . . 79.01 113.903 -163.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -103.57 34.81 2.82 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 113.056 0.761 . . . . 79.38 113.056 -170.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . 0.649 HG11 ' SG ' ' A' ' 109' ' ' CYS . 12.2 t -110.92 -4.3 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 CA-C-O 121.536 0.684 . . . . 70.02 112.792 -168.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . 0.893 HG22 ' O ' ' A' ' 131' ' ' HOH . 94.2 m 102.18 -23.8 0.0 OUTLIER Pre-proline 0 C--O 1.265 1.878 1 O-C-N 115.975 -4.203 . . . . 63.27 117.544 152.344 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 50' ' ' THR . 74.1 Cg_endo -44.21 151.27 0.54 Allowed 'Trans proline' 1 C--N 1.584 12.922 2 O-C-N 95.213 -13.625 . . . . 55.26 114.956 -129.807 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 72.6 p -77.61 161.95 27.44 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.591 -1.186 . . . . 46.96 107.917 175.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.7 mttp -62.33 -41.75 98.82 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.193 0.442 . . . . 43.76 112.193 172.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -53.43 -47.89 69.25 Favored 'General case' 0 CA--C 1.564 1.481 0 N-CA-C 115.312 1.597 . . . . 36.42 115.312 172.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.52 -44.48 80.83 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.624 -0.673 . . . . 33.93 111.509 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 56.1 mt -58.19 -49.48 81.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 113.206 0.817 . . . . 36.29 113.206 173.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.8 t -66.66 -43.48 90.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.768 0.795 . . . . 37.91 108.869 -177.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -61.31 -44.93 96.39 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 114.21 1.189 . . . . 43.29 114.21 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.3 m -57.09 -38.94 74.06 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 112.28 0.474 . . . . 35.41 112.28 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 mt -68.78 -46.53 68.5 Favored 'General case' 0 C--N 1.349 0.545 0 N-CA-C 112.691 0.626 . . . . 37.53 112.691 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 79.7 t -60.55 -39.41 81.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 113.429 0.899 . . . . 38.18 113.429 173.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -62.51 -35.74 80.34 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.188 1.181 . . . . 40.0 114.188 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 mt -63.12 -37.61 87.91 Favored 'General case' 0 C--O 1.207 -1.15 0 CA-C-N 118.758 0.708 . . . . 48.8 111.016 174.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -77.68 -37.78 48.97 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.358 -0.537 . . . . 59.17 112.17 -176.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -128.28 66.47 73.1 Favored Pre-proline 0 CA--C 1.544 0.712 0 CA-C-N 116.255 -0.429 . . . . 54.67 110.275 -177.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.32 -18.1 63.16 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 N-CA-C 115.678 1.376 . . . . 50.4 115.678 -170.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 66.7 p -93.65 -17.72 22.95 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 113.064 0.764 . . . . 53.32 113.064 -176.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -104.95 -23.48 12.97 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 114.254 1.205 . . . . 66.94 114.254 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.4 t -132.14 134.82 59.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 108.738 -0.838 . . . . 46.73 108.738 -171.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.32 169.92 53.77 Favored Glycine 0 C--O 1.259 1.661 0 N-CA-C 111.189 -0.764 . . . . 41.69 111.189 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -86.68 166.45 15.32 Favored 'General case' 0 C--O 1.249 1.057 0 CA-C-O 121.766 0.793 . . . . 52.46 111.146 172.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 152.24 32.67 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.595 -0.891 . . . . 36.55 108.595 163.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 64.2 m -111.82 140.89 46.09 Favored 'General case' 0 C--O 1.221 -0.439 0 O-C-N 124.198 0.936 . . . . 44.09 110.669 -174.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 31.0 t -85.87 118.27 25.25 Favored 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 106.207 -1.775 . . . . 42.67 106.207 174.92 172.934 66.749 76.797 105.076 2.067 103.318 63.2 -176.882 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.5 m -142.86 158.95 58.35 Favored Pre-proline 0 C--O 1.222 -0.345 0 C-N-CA 122.975 0.51 . . . . 35.04 111.35 -172.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.67 134.51 38.25 Favored 'Trans proline' 0 N--CA 1.447 -1.251 0 N-CA-C 108.191 -1.503 . . . . 35.01 108.191 170.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 72.6 p -120.19 -6.96 9.89 Favored 'General case' 0 C--O 1.243 0.745 0 O-C-N 123.765 0.666 . . . . 42.59 110.681 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . 0.555 ' HE2' ' O ' ' A' ' 142' ' ' HOH . 88.1 tttt -146.93 138.63 24.34 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 107.919 -1.141 . . . . 53.48 107.919 169.276 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -124.12 149.58 46.06 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 123.168 0.293 . . . . 43.92 111.585 -175.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.0 m -114.04 153.78 46.18 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 122.482 0.313 . . . . 47.57 111.302 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -80.41 164.37 21.48 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 121.034 1.156 . . . . 51.29 111.847 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.3 pt -133.07 174.99 12.43 Favored 'Isoleucine or valine' 0 C--O 1.244 0.777 0 N-CA-C 108.893 -0.78 . . . . 58.1 108.893 161.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.6 m -104.07 137.76 41.56 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.905 -0.588 . . . . 67.25 109.503 174.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 21.6 m -127.36 154.16 37.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 114.857 -1.065 . . . . 82.46 112.954 170.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 tp -104.31 111.27 23.83 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.823 -1.081 . . . . 100.94 109.407 171.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -119.82 176.22 5.51 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.772 0.656 . . . . 123.28 112.772 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . 0.513 ' HG3' HD11 ' A' ' 27' ' ' ILE . 44.0 mttt -108.02 136.89 46.95 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.996 1.48 . . . . 145.17 114.996 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . 0.488 ' HB2' HG23 ' A' ' 92' ' ' VAL . 2.1 m-20 -95.49 -169.94 2.06 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 113.425 0.898 . . . . 163.76 113.425 177.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -63.19 -37.73 88.37 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 115.274 1.583 . . . . 176.96 115.274 -169.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 33.4 ttp -86.97 6.49 31.96 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.004 0.431 . . . . 182.74 110.76 174.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 80.33 20.08 67.69 Favored Glycine 0 N--CA 1.461 0.306 0 CA-C-N 116.058 -0.519 . . . . 176.33 112.46 -178.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 0.488 HG23 ' HB2' ' A' ' 88' ' ' ASP . 0.3 OUTLIER -77.08 124.65 87.3 Favored Pre-proline 0 C--O 1.236 0.386 0 N-CA-C 111.394 0.146 . . . . 163.41 111.394 178.768 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -62.54 123.21 11.98 Favored 'Trans proline' 0 C--N 1.35 0.632 0 N-CA-C 108.507 -1.382 . . . . 147.5 108.507 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -128.81 141.54 51.27 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 123.881 0.738 . . . . 129.45 112.645 -177.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -94.73 124.81 38.99 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.323 -0.853 . . . . 110.14 109.606 -174.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.71 110.6 22.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.054 -1.832 . . . . 93.81 106.054 168.322 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -71.51 -53.83 12.55 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 119.663 -0.815 . . . . 80.34 112.13 -168.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -112.85 92.92 4.19 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.228 0.825 . . . . 69.77 113.228 170.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -87.38 102.33 14.42 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.574 -0.739 . . . . 61.32 109.317 172.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -73.47 145.19 45.89 Favored 'General case' 0 C--O 1.221 -0.403 0 N-CA-C 115.227 1.565 . . . . 61.49 115.227 -164.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 87.5 25.84 31.91 Favored Glycine 0 N--CA 1.464 0.56 0 CA-C-N 115.421 -0.809 . . . . 47.22 114.77 168.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 95.6 mmm -93.5 -32.78 14.04 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 116.269 1.951 . . . . 42.57 116.269 -169.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 56.0 m -126.91 147.81 50.06 Favored 'General case' 0 CA--C 1.482 -1.653 0 C-N-CA 124.342 1.057 . . . . 44.69 111.15 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . 0.649 ' HB ' ' HB2' ' A' ' 35' ' ' TYR . 31.0 t -71.35 126.99 32.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 O-C-N 123.949 0.781 . . . . 39.42 110.901 174.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -95.88 -41.75 8.65 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 118.975 -0.536 . . . . 41.29 111.274 167.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -137.95 147.88 44.72 Favored 'General case' 0 C--O 1.208 -1.104 0 C-N-CA 124.276 1.031 . . . . 54.74 113.053 175.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' CYS . . . . . . . . . . . . . 93.1 m -108.21 155.58 20.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.518 1.527 . . . . 47.27 110.263 172.587 -66.364 -68.456 -89.776 105.685 2.06 105.671 -59.864 -70.101 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -165.93 172.24 41.28 Favored Glycine 0 CA--C 1.508 -0.38 0 O-C-N 121.382 -0.824 . . . . 37.67 111.311 173.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' CYS . . . . . 0.649 ' SG ' HG11 ' A' ' 49' ' ' VAL . 59.7 m -96.96 133.6 41.4 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.325 -1.731 . . . . 43.24 106.325 -178.535 -74.173 -77.656 -93.19 102.257 2.038 102.005 -83.165 -60.782 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ARG . . . . . 0.778 HH22 HG21 ' A' ' 50' ' ' THR . 79.8 mmt-85 . . . . . 0 CA--C 1.49 -1.344 0 N-CA-C 111.753 0.279 . . . . 35.54 111.753 -171.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 131' ' ' HOH . . . . . 0.893 ' O ' HG22 ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . 0.555 ' O ' ' HE2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' 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 nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.444 ' O ' ' HD2' ' A' ' 7' ' ' HIS . . . . . . . . 0 N--CA 1.501 2.077 0 N-CA-C 113.803 1.038 . . . . 88.769999999999996 113.803 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -98.02 15.55 61.4 Favored Glycine 0 N--CA 1.473 1.112 0 N-CA-C 117.648 1.819 . . . . 86.540000000000006 117.648 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.2 t -116.01 34.35 5.02 Favored 'General case' 0 C--O 1.259 1.597 0 CA-C-O 122.758 1.266 . . . . 78.629999999999995 112.35 -178.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.514 ' CB ' ' HB2' ' A' ' 46' ' ' ALA . 89.1 m-70 -92.14 172.54 8.36 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 114.05 -1.432 . . . . 69.810000000000002 113.755 -178.703 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.4 t -53.07 119.76 5.08 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 125.448 1.499 . . . . 54.409999999999997 113.378 -176.011 -176.882 63.2 76.797 103.318 2.067 105.076 66.749 172.934 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -160.1 157.52 28.68 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 112.229 0.455 . . . . 56.740000000000002 112.229 -176.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.43 122.09 19.76 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 124.938 1.295 . . . . 53.810000000000002 110.69 175.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.8 p -127.32 169.75 13.22 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.74 -0.837 . . . . 47.189999999999998 108.74 170.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.4 t -72.44 139.16 47.58 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 115.963 -0.562 . . . . 50.270000000000003 110.847 -174.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.3 tp -144.98 105.29 4.08 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 115.759 -0.655 . . . . 47.840000000000003 109.319 166.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.8 ttt85 -88.22 121.74 30.97 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.381 -0.827 . . . . 70.420000000000002 111.051 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 76.1 t -109.53 117.59 54.88 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 O-C-N 124.177 0.923 . . . . 55.229999999999997 112.693 -174.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.417 ' HA ' ' HG3' ' A' ' 31' ' ' GLU . 22.4 t-20 -87.51 123.06 32.01 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 114.946 -1.024 . . . . 63.770000000000003 110.195 173.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -66.82 -22.65 66.0 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.184 1.55 . . . . 69.459999999999994 115.184 -172.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -72.45 -53.58 11.75 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.258 -0.645 . . . . 85.370000000000005 109.258 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -36.14 -44.21 0.38 Allowed 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.897 1.073 . . . . 77.180000000000007 113.897 170.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.5 pt -98.21 8.88 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 N-CA-C 116.327 1.973 . . . . 74.620000000000005 116.327 -175.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.55 17.93 78.21 Favored Glycine 0 C--O 1.264 2.011 0 N-CA-C 119.354 2.501 . . . . 76.510000000000005 119.354 -178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 14.9 m0 -97.18 -10.24 26.28 Favored 'General case' 0 C--O 1.253 1.287 0 N-CA-C 114.651 1.352 . . . . 81.609999999999999 114.651 -176.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -68.71 -11.28 60.03 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.874 -0.603 . . . . 92.180000000000007 112.385 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.6 p -65.32 -26.15 67.92 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 115.966 -0.561 . . . . 99.010000000000005 110.139 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 14.5 p-90 -128.63 -8.03 5.1 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.123 1.527 . . . . 100.76000000000001 115.123 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 11.1 mt -111.68 112.26 39.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 122.043 -0.411 . . . . 95.390000000000001 111.05 172.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.513 HD11 ' HG3' ' A' ' 87' ' ' LYS . 13.3 mt -70.64 -42.82 77.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 124.437 1.095 . . . . 90.859999999999999 110.446 173.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.05 146.88 15.5 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 113.433 0.901 . . . . 83.769999999999996 113.433 -171.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.97 176.75 42.36 Favored 'Cis proline' 0 CA--C 1.55 1.286 0 C-N-CA 124.309 -1.121 . . . . 76.159999999999997 112.722 -4.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -70.37 -37.91 74.67 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.707 0.803 . . . . 81.109999999999999 112.09 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.417 ' HG3' ' HA ' ' A' ' 16' ' ' ASN . 0.7 OUTLIER -139.36 145.9 39.56 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 126.0 1.72 . . . . 71.969999999999999 107.845 -172.688 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -137.61 162.67 33.17 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 120.994 -0.283 . . . . 56.759999999999998 110.7 166.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -82.77 97.98 8.87 Favored 'General case' 0 C--O 1.214 -0.771 0 CA-C-N 115.973 -0.558 . . . . 54.240000000000002 110.889 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.7 164.23 17.77 Favored 'General case' 0 CA--C 1.491 -1.305 1 N-CA-C 97.838 -4.875 . . . . 42.329999999999998 97.838 176.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.649 ' HB2' ' HB ' ' A' ' 104' ' ' VAL . 44.9 m-85 -106.14 -172.47 2.09 Favored 'General case' 0 C--N 1.28 -2.419 2 C-N-CA 104.1 -7.04 . . . . 45.259999999999998 107.502 168.563 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' OE1' ' HE3' ' A' ' 38' ' ' LYS . 33.9 tt0 -131.85 152.69 50.85 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 106.223 -1.769 . . . . 51.5 106.223 165.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 92.1 m -104.74 108.28 19.67 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.067 0.947 . . . . 42.590000000000003 109.774 169.911 -70.101 -59.864 -89.776 105.671 2.06 105.685 -68.456 -66.364 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.415 ' HE3' ' OE1' ' A' ' 36' ' ' GLU . 72.6 mttt -113.52 147.27 38.24 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.585 0.957 . . . . 56.439999999999998 113.585 -176.59 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 126.18 -163.8 19.98 Favored Glycine 0 CA--C 1.502 -0.743 0 N-CA-C 108.684 -1.766 . . . . 46.109999999999999 108.684 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -132.24 165.77 23.5 Favored Glycine 0 CA--C 1.505 -0.588 0 N-CA-C 109.349 -1.5 . . . . 45.539999999999999 109.349 -174.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 78.1 m -118.65 99.17 6.62 Favored 'General case' 0 C--O 1.248 1.014 0 N-CA-C 104.956 -2.239 . . . . 46.710000000000001 104.956 -179.873 -60.782 -83.165 -93.19 102.005 2.038 102.257 -77.656 -74.173 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.7 p90 -142.53 160.7 39.77 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.268 -1.333 . . . . 56.259999999999998 108.951 175.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -79.99 146.16 62.95 Favored Pre-proline 0 C--N 1.317 -0.821 0 C-N-CA 119.813 -0.755 . . . . 55.579999999999998 112.026 175.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.3 137.84 52.37 Favored 'Cis proline' 0 C--N 1.355 0.918 0 N-CA-C 109.784 -0.891 . . . . 63.57 109.784 -3.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.421 HD13 ' HG3' ' A' ' 51' ' ' PRO . 51.7 mt -66.55 143.45 57.04 Favored 'General case' 0 C--O 1.253 1.288 0 C-N-CA 119.135 -1.026 . . . . 70.25 112.361 -173.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.514 ' HB2' ' CB ' ' A' ' 7' ' ' HIS . . . -58.55 143.97 44.24 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.186 -1.042 . . . . 76.019999999999996 108.186 167.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -69.59 -31.21 69.23 Favored 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 113.903 1.075 . . . . 79.010000000000005 113.903 -163.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -103.57 34.81 2.82 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 113.056 0.761 . . . . 79.379999999999995 113.056 -170.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.649 HG11 ' SG ' ' A' ' 109' ' ' CYS . 12.2 t -110.92 -4.3 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 CA-C-O 121.536 0.684 . . . . 70.019999999999996 112.792 -168.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . 0.893 HG22 ' O ' ' A' ' 131' ' ' HOH . 94.2 m 102.18 -23.8 0.0 OUTLIER Pre-proline 0 C--O 1.265 1.878 1 O-C-N 115.975 -4.203 . . . . 63.270000000000003 117.544 152.344 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 50' ' ' THR . 74.1 Cg_endo -44.21 151.27 0.54 Allowed 'Trans proline' 1 C--N 1.584 12.922 2 O-C-N 95.213 -13.625 . . . . 55.259999999999998 114.956 -129.807 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 72.6 p -77.61 161.95 27.44 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.591 -1.186 . . . . 46.960000000000001 107.917 175.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.7 mttp -62.33 -41.75 98.82 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.193 0.442 . . . . 43.759999999999998 112.193 172.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -53.43 -47.89 69.25 Favored 'General case' 0 CA--C 1.564 1.481 0 N-CA-C 115.312 1.597 . . . . 36.420000000000002 115.312 172.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.52 -44.48 80.83 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.624 -0.673 . . . . 33.93 111.509 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 56.1 mt -58.19 -49.48 81.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 113.206 0.817 . . . . 36.289999999999999 113.206 173.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.8 t -66.66 -43.48 90.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.768 0.795 . . . . 37.909999999999997 108.869 -177.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -61.31 -44.93 96.39 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 114.21 1.189 . . . . 43.289999999999999 114.21 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.3 m -57.09 -38.94 74.06 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 112.28 0.474 . . . . 35.409999999999997 112.28 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 mt -68.78 -46.53 68.5 Favored 'General case' 0 C--N 1.349 0.545 0 N-CA-C 112.691 0.626 . . . . 37.530000000000001 112.691 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 79.7 t -60.55 -39.41 81.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 113.429 0.899 . . . . 38.18 113.429 173.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.746 ' HD2' ' O ' ' A' ' 69' ' ' VAL . 44.9 t-80 -62.51 -35.74 80.34 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.188 1.181 . . . . 40.0 114.188 174.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 mt -63.12 -37.61 87.91 Favored 'General case' 0 C--O 1.207 -1.15 0 CA-C-N 118.758 0.708 . . . . 48.799999999999997 111.016 174.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -77.68 -37.78 48.97 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.358 -0.537 . . . . 59.170000000000002 112.17 -176.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -128.28 66.47 73.1 Favored Pre-proline 0 CA--C 1.544 0.712 0 CA-C-N 116.255 -0.429 . . . . 54.670000000000002 110.275 -177.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.32 -18.1 63.16 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 N-CA-C 115.678 1.376 . . . . 50.399999999999999 115.678 -170.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 66.7 p -93.65 -17.72 22.95 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 113.064 0.764 . . . . 53.32 113.064 -176.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -104.95 -23.48 12.97 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 114.254 1.205 . . . . 66.939999999999998 114.254 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.746 ' O ' ' HD2' ' A' ' 62' ' ' HIS . 57.4 t -132.14 134.82 59.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 108.738 -0.838 . . . . 46.729999999999997 108.738 -171.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.32 169.92 53.77 Favored Glycine 0 C--O 1.259 1.661 0 N-CA-C 111.189 -0.764 . . . . 41.689999999999998 111.189 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.414 ' HG2' ' CE1' ' A' ' 62' ' ' HIS . 26.1 mttt -86.68 166.45 15.32 Favored 'General case' 0 C--O 1.249 1.057 0 CA-C-O 121.766 0.793 . . . . 52.460000000000001 111.146 172.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 152.24 32.67 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.595 -0.891 . . . . 36.549999999999997 108.595 163.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 64.2 m -111.82 140.89 46.09 Favored 'General case' 0 C--O 1.221 -0.439 0 O-C-N 124.198 0.936 . . . . 44.090000000000003 110.669 -174.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 31.0 t -85.87 118.27 25.25 Favored 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 106.207 -1.775 . . . . 42.670000000000002 106.207 174.92 172.934 66.749 76.797 105.076 2.067 103.318 63.2 -176.882 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.5 m -142.86 158.95 58.35 Favored Pre-proline 0 C--O 1.222 -0.345 0 C-N-CA 122.975 0.51 . . . . 35.039999999999999 111.35 -172.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.67 134.51 38.25 Favored 'Trans proline' 0 N--CA 1.447 -1.251 0 N-CA-C 108.191 -1.503 . . . . 35.009999999999998 108.191 170.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 72.6 p -120.19 -6.96 9.89 Favored 'General case' 0 C--O 1.243 0.745 0 O-C-N 123.765 0.666 . . . . 42.590000000000003 110.681 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.555 ' HE2' ' O ' ' A' ' 142' ' ' HOH . 88.1 tttt -146.93 138.63 24.34 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 107.919 -1.141 . . . . 53.479999999999997 107.919 169.276 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -124.12 149.58 46.06 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 123.168 0.293 . . . . 43.920000000000002 111.585 -175.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.0 m -114.04 153.78 46.18 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 122.482 0.313 . . . . 47.57 111.302 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -80.41 164.37 21.48 Favored 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 121.034 1.156 . . . . 51.289999999999999 111.847 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.3 pt -133.07 174.99 12.43 Favored 'Isoleucine or valine' 0 C--O 1.244 0.777 0 N-CA-C 108.893 -0.78 . . . . 58.100000000000001 108.893 161.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.6 m -104.07 137.76 41.56 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.905 -0.588 . . . . 67.25 109.503 174.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 21.6 m -127.36 154.16 37.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 114.857 -1.065 . . . . 82.459999999999994 112.954 170.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 tp -104.31 111.27 23.83 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.823 -1.081 . . . . 100.94 109.407 171.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -119.82 176.22 5.51 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.772 0.656 . . . . 123.28 112.772 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.513 ' HG3' HD11 ' A' ' 27' ' ' ILE . 44.0 mttt -108.02 136.89 46.95 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.996 1.48 . . . . 145.16999999999999 114.996 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.488 ' HB2' HG23 ' A' ' 92' ' ' VAL . 2.1 m-20 -95.49 -169.94 2.06 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 113.425 0.898 . . . . 163.75999999999999 113.425 177.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -63.19 -37.73 88.37 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 115.274 1.583 . . . . 176.96000000000001 115.274 -169.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 33.4 ttp -86.97 6.49 31.96 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.004 0.431 . . . . 182.74000000000001 110.76 174.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 80.33 20.08 67.69 Favored Glycine 0 N--CA 1.461 0.306 0 CA-C-N 116.058 -0.519 . . . . 176.33000000000001 112.46 -178.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.488 HG23 ' HB2' ' A' ' 88' ' ' ASP . 0.3 OUTLIER -77.08 124.65 87.3 Favored Pre-proline 0 C--O 1.236 0.386 0 N-CA-C 111.394 0.146 . . . . 163.41 111.394 178.768 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -62.54 123.21 11.98 Favored 'Trans proline' 0 C--N 1.35 0.632 0 N-CA-C 108.507 -1.382 . . . . 147.5 108.507 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -128.81 141.54 51.27 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 123.881 0.738 . . . . 129.44999999999999 112.645 -177.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -94.73 124.81 38.99 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.323 -0.853 . . . . 110.14 109.606 -174.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.71 110.6 22.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.054 -1.832 . . . . 93.810000000000002 106.054 168.322 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -71.51 -53.83 12.55 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 119.663 -0.815 . . . . 80.340000000000003 112.13 -168.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -112.85 92.92 4.19 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.228 0.825 . . . . 69.769999999999996 113.228 170.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -87.38 102.33 14.42 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.574 -0.739 . . . . 61.32 109.317 172.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -73.47 145.19 45.89 Favored 'General case' 0 C--O 1.221 -0.403 0 N-CA-C 115.227 1.565 . . . . 61.490000000000002 115.227 -164.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 87.5 25.84 31.91 Favored Glycine 0 N--CA 1.464 0.56 0 CA-C-N 115.421 -0.809 . . . . 47.219999999999999 114.77 168.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 95.6 mmm -93.5 -32.78 14.04 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 116.269 1.951 . . . . 42.57 116.269 -169.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 56.0 m -126.91 147.81 50.06 Favored 'General case' 0 CA--C 1.482 -1.653 0 C-N-CA 124.342 1.057 . . . . 44.689999999999998 111.15 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.649 ' HB ' ' HB2' ' A' ' 35' ' ' TYR . 31.0 t -71.35 126.99 32.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 O-C-N 123.949 0.781 . . . . 39.420000000000002 110.901 174.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -95.88 -41.75 8.65 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 118.975 -0.536 . . . . 41.289999999999999 111.274 167.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -137.95 147.88 44.72 Favored 'General case' 0 C--O 1.208 -1.104 0 C-N-CA 124.276 1.031 . . . . 54.740000000000002 113.053 175.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' CYS . . . . . . . . . . . . . 93.1 m -108.21 155.58 20.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.518 1.527 . . . . 47.270000000000003 110.263 172.587 -66.364 -68.456 -89.776 105.685 2.06 105.671 -59.864 -70.101 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -165.93 172.24 41.28 Favored Glycine 0 CA--C 1.508 -0.38 0 O-C-N 121.382 -0.824 . . . . 37.670000000000002 111.311 173.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.649 ' SG ' HG11 ' A' ' 49' ' ' VAL . 59.7 m -96.96 133.6 41.4 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.325 -1.731 . . . . 43.240000000000002 106.325 -178.535 -74.173 -77.656 -93.19 102.257 2.038 102.005 -83.165 -60.782 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.778 HH22 HG21 ' A' ' 50' ' ' THR . 79.8 mmt-85 . . . . . 0 CA--C 1.49 -1.344 0 N-CA-C 111.753 0.279 . . . . 35.539999999999999 111.753 -171.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 131' ' ' HOH . . . . . 0.893 ' O ' HG22 ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . 0.555 ' O ' ' HE2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' 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 stop_ save_