Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u9a_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 142.A O no hydrogen 3.468 N/A ILE 1.A N ASN 143.A O no hydrogen 2.929 N/A ILE 1.A N ASP 197.A OD1 no hydrogen 3.560 N/A ILE 1.A N ASP 197.A OD2 no hydrogen 2.636 N/A VAL 2.A N ASP 192.A O no hydrogen 2.884 N/A SER 5.A N VAL 155.A O no hydrogen 2.957 N/A ALA 7.A N LEU 153.A O no hydrogen 2.814 N/A MET 11.A N GLU 8.A O no hydrogen 3.107 N/A GLN 15.A N SER 12.A O no hydrogen 2.868 N/A GLN 15.A NE2.A VAL 16.A O no hydrogen 3.190 N/A GLN 15.A NE2.B SER 12.A OG.B no hydrogen 2.925 N/A GLN 15.A NE2.B THR 139.A OG1 no hydrogen 2.490 N/A VAL 16.A N ALA 30.A O no hydrogen 2.947 N/A MET 17.A N ARG 62.A O no hydrogen 2.923 N/A LEU 18.A N CYS 28.A O no hydrogen 2.893 N/A PHE 19.A N LEU 60.A O no hydrogen 2.896 N/A ARG 20.A N GLU 25.A O no hydrogen 2.814 N/A ARG 20.A NH1 GLU 25.A OE2 no hydrogen 3.177 N/A LYS 21.A N ASP 58.A O no hydrogen 3.098 N/A LYS 21.A NZ ASN 57.A O no hydrogen 2.914 N/A GLU 25.A N ARG 20.A O no hydrogen 3.387 N/A LEU 27.A N LEU 18.A O no hydrogen 2.791 N/A CYS 28.A N LEU 18.A O no hydrogen 3.433 N/A CYS 28.A SG LEU 27.A O no hydrogen 2.914 N/A CYS 28.A SG SER 198.A O no hydrogen 3.481 N/A GLY 29.A N SER 198.A O no hydrogen 2.743 N/A SER 31.A N LEU 39.A O no hydrogen 2.850 N/A SER 31.A OG GLN 214.A OE1 no hydrogen 2.652 N/A LEU 32.A N TRP 14.A O no hydrogen 2.828 N/A ILE 33.A N TRP 37.A O no hydrogen 3.065 N/A ARG 36.A N SER 34.A OG no hydrogen 3.137 N/A ARG 36.A NE.B LEU 105.A O no hydrogen 2.597 N/A TRP 37.A N SER 34.A OG no hydrogen 3.150 N/A VAL 38.A N MET 103.A O no hydrogen 2.875 N/A LEU 39.A N SER 31.A O no hydrogen 2.838 N/A THR 40.A N ALA 101.A O no hydrogen 2.921 N/A THR 40.A OG1 GLY 29.A O no hydrogen 2.897 N/A ALA 41.A N THR 40.A OG1 no hydrogen 2.840 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.919 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.732 N/A HIS 43.A NE2 SER 198.A OG no hydrogen 2.697 N/A CYS 44.A N ALA 41.A O no hydrogen 3.083 N/A CYS 44.A SG THR 40.A OG1 no hydrogen 3.739 N/A LEU 45.A N ALA 42.A O no hydrogen 2.907 N/A LEU 46.A N ALA 42.A O no hydrogen 2.849 N/A GLU 56.A N GLU 56.A OE2 no hydrogen 2.634 N/A ASP 58.A N THR 55I.A O no hydrogen 2.975 N/A LEU 59.A N GLU 56.A O no hydrogen 3.280 N/A LEU 60.A N PHE 19.A O no hydrogen 2.838 N/A VAL 61.A N SER 79.A O no hydrogen 2.972 N/A ARG 62.A N MET 17.A O no hydrogen 2.841 N/A ARG 62.A NE GLU 76.A OE1 no hydrogen 2.780 N/A ARG 62.A NH2 GLU 76.A OE1 no hydrogen 3.325 N/A ARG 62.A NH2 GLU 76.A OE2 no hydrogen 2.868 N/A ILE 63.A N LYS 77.A O no hydrogen 2.836 N/A LYS 65.A NZ SER 67.A O no hydrogen 3.165 N/A LYS 65.A NZ ARG 70.A O.A no hydrogen 2.814 N/A LYS 65.A NZ ARG 70.A O.B no hydrogen 2.841 N/A LYS 65.A NZ GLU 72.A OE1 no hydrogen 2.847 N/A LYS 65.A NZ GLU 76.A OE2 no hydrogen 2.804 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 2.842 N/A HIS 66.A N GLU 72.A OE2 no hydrogen 3.334 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.877 N/A SER 67.A OG SER 151.A O no hydrogen 3.544 N/A ARG 68.A N SER 151.A O no hydrogen 2.834 N/A ARG 68.A NE PRO 150.A O no hydrogen 2.787 N/A ARG 70.A N.A SER 67.A OG no hydrogen 3.131 N/A ARG 70.A N.B SER 67.A OG no hydrogen 3.122 N/A GLU 72.A N GLU 76.A OE2 no hydrogen 2.966 N/A ILE 75.A N GLU 72.A O no hydrogen 3.009 N/A GLU 76.A N GLU 72.A O no hydrogen 2.985 N/A LYS 77.A N ILE 63.A O no hydrogen 2.820 N/A SER 79.A N VAL 61.A O no hydrogen 2.859 N/A GLU 82.A N LYS 104.A O no hydrogen 2.672 N/A LYS 83.A N LYS 104.A O no hydrogen 3.412 N/A ILE 84.A N GLU 56.A OE1 no hydrogen 2.853 N/A TYR 85.A N LEU 102.A O no hydrogen 2.813 N/A HIS 87.A N ILE 100.A O no hydrogen 3.266 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 2.988 N/A TYR 90.A N HIS 87.A O no hydrogen 3.108 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.719 N/A ASN 91.A N ASP 97.A O no hydrogen 2.846 N/A ASN 95.A ND2 ARG 173.A O no hydrogen 2.875 N/A ASP 97.A N ASN 95.A OD1 no hydrogen 3.137 N/A ARG 98.A NH1 ARG 89.A O no hydrogen 2.894 N/A ALA 101.A N THR 40.A O no hydrogen 2.935 N/A LEU 102.A N TYR 85.A O no hydrogen 2.795 N/A MET 103.A N VAL 38.A O no hydrogen 2.810 N/A LYS 104.A N LYS 83.A O no hydrogen 2.916 N/A LYS 104.A NZ PHE 250.A O no hydrogen 3.429 N/A LEU 105.A N ARG 36.A O no hydrogen 2.858 N/A LYS 106.A N MET 80.A O no hydrogen 2.962 N/A VAL 109.A N ASP 35.A O no hydrogen 2.951 N/A SER 112.A N ILE 115.A O no hydrogen 2.961 N/A TYR 114.A N SER 112.A OG no hydrogen 3.055 N/A ILE 115.A N SER 112.A O no hydrogen 3.369 N/A HIS 116.A N PRO 13.A O no hydrogen 3.088 N/A VAL 118.A N LEU 32.A O no hydrogen 3.063 N/A CYS 119.A N TRP 212.A O no hydrogen 3.151 N/A THR 125.A N ASP 122.A OD1 no hydrogen 2.912 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 3.465 N/A ALA 126.A N ASP 122.A O no hydrogen 3.036 N/A LEU 130.A N ALA 126.A O no hydrogen 2.909 N/A GLN 131.A N LEU 129C.A O no hydrogen 2.866 N/A GLN 131.A NE2 SER 128B.A O no hydrogen 2.695 N/A GLY 133.A N ILE 160.A O no hydrogen 2.836 N/A TYR 134.A N GLN 131.A O no hydrogen 3.029 N/A LYS 135.A NZ TYR 183A.A OH no hydrogen 3.313 N/A GLY 136.A N LEU 158.A O no hydrogen 2.920 N/A ARG 137.A N VAL 203.A O no hydrogen 2.762 N/A ARG 137.A NE ASN 157.A OD1 no hydrogen 3.096 N/A VAL 138.A N VAL 156.A O no hydrogen 2.847 N/A THR 139.A OG1 GLN 15.A OE1.A no hydrogen 2.785 N/A GLY 140.A N GLN 154.A O no hydrogen 3.071 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 2.928 N/A GLY 142.A N ASP 197.A OD1 no hydrogen 2.792 N/A ASN 143.A N GLU 195.A O no hydrogen 2.834 N/A LEU 144.A N GLY 148.A O no hydrogen 2.832 N/A GLN 149.A NE2 ASN 143.A OD1 no hydrogen 3.306 N/A LEU 153.A N HIS 66.A O no hydrogen 2.858 N/A GLN 154.A N GLY 140.A O no hydrogen 2.997 N/A GLN 154.A NE2 ASP 6.A OD1 no hydrogen 2.830 N/A GLN 154.A NE2 VAL 152.A O no hydrogen 2.945 N/A VAL 155.A N SER 5.A O no hydrogen 2.851 N/A VAL 156.A N VAL 138.A O no hydrogen 2.975 N/A LEU 158.A N GLY 136.A O no hydrogen 2.844 N/A ILE 160.A N TYR 134.A O no hydrogen 2.885 N/A VAL 161.A N CYS 180.A O no hydrogen 2.942 N/A GLU 162.A N GLU 162.A OE2 no hydrogen 2.677 N/A ARG 163.A NH1.A MET 178.A O no hydrogen 2.699 N/A ARG 163.A NH1.B MET 178.A O no hydrogen 3.030 N/A ARG 163.A NH2.A THR 175.A O no hydrogen 3.014 N/A ARG 163.A NH2.A MET 178.A O no hydrogen 3.126 N/A ARG 163.A NH2.B THR 175.A O no hydrogen 2.873 N/A ARG 163.A NH2.B MET 178.A O no hydrogen 3.193 N/A CYS 166.A N GLU 162.A O no hydrogen 3.052 N/A CYS 166.A SG VAL 161.A O no hydrogen 3.660 N/A CYS 166.A SG GLU 162.A O no hydrogen 3.562 N/A LYS 167.A N ARG 163.A O no hydrogen 2.912 N/A ASP 168.A N PRO 164.A O no hydrogen 2.925 N/A SER 169.A N CYS 166.A O no hydrogen 3.171 N/A SER 169.A OG CYS 166.A O no hydrogen 2.681 N/A THR 170.A N LYS 167.A O no hydrogen 3.447 N/A THR 170.A OG1 GLU 222.A OE1 no hydrogen 2.862 N/A ILE 172.A N THR 170.A OG1 no hydrogen 3.041 N/A ARG 173.A NE GLU 94A.A OE2 no hydrogen 2.908 N/A ARG 173.A NH2 GLU 94A.A OE1 no hydrogen 2.871 N/A THR 175.A OG1 ASP 97.A OD1 no hydrogen 2.659 N/A ASN 177.A N THR 175.A OG1 no hydrogen 3.084 N/A ASN 177.A ND2 ASP 97.A OD1 no hydrogen 2.963 N/A MET 178.A N THR 175.A O no hydrogen 3.111 N/A PHE 179.A N TYR 233.A O no hydrogen 2.981 N/A ALA 181.A N GLY 231.A O no hydrogen 2.941 N/A GLY 182.A N PRO 159.A O no hydrogen 2.895 N/A LYS 184.A N GLU 187B.A OE1 no hydrogen 2.557 N/A LYS 184.A NZ GLU 162.A OE2 no hydrogen 3.098 N/A ARG 190.A NE ASP 225.A OD2 no hydrogen 2.675 N/A ARG 190.A NH1 ASP 227.A OD1 no hydrogen 2.972 N/A ARG 190.A NH2 ASP 225.A O no hydrogen 2.723 N/A ARG 190.A NH2 ASP 225.A OD2 no hydrogen 3.402 N/A ARG 190.A NH2 ASP 227.A OD1 no hydrogen 3.047 N/A GLY 191.A N ASP 225.A OD1 no hydrogen 2.902 N/A ASP 192.A N VAL 2.A O no hydrogen 3.273 N/A CYS 194.A N ASP 197.A OD2 no hydrogen 2.879 N/A ASP 197.A N CYS 194.A O no hydrogen 3.002 N/A SER 198.A OG HIS 43.A NE2 no hydrogen 2.697 N/A GLY 199.A N VAL 218.A O no hydrogen 2.967 N/A GLY 200.A N ASP 197.A O no hydrogen 3.021 N/A PHE 202.A N GLY 216.A O no hydrogen 2.905 N/A VAL 203.A N ARG 137.A O no hydrogen 2.861 N/A MET 204.A N TYR 213.A O no hydrogen 2.933 N/A SER 206.A N ARG 211.A O no hydrogen 2.893 N/A SER 206.A OG ASN 209B.A OD1 no hydrogen 3.253 N/A ASN 210.A N SER 206.A O no hydrogen 2.880 N/A ARG 211.A N ASN 209B.A OD1 no hydrogen 3.192 N/A TYR 213.A N MET 204.A O no hydrogen 2.872 N/A GLN 214.A N CYS 119.A O no hydrogen 2.837 N/A GLN 214.A NE2 GLY 216.A O no hydrogen 2.994 N/A MET 215.A N PHE 202.A O no hydrogen 2.878 N/A GLY 216.A N PHE 202.A O no hydrogen 3.105 N/A ILE 217.A N THR 234.A O no hydrogen 3.175 N/A VAL 218.A N GLY 200.A O no hydrogen 2.850 N/A SER 219.A N PHE 232.A O no hydrogen 3.025 N/A SER 219.A OG ASP 99.A OD2 no hydrogen 2.688 N/A TRP 220.A N PHE 232.A O no hydrogen 3.103 N/A CYS 224.A N GLU 146.A OE1 no hydrogen 3.020 N/A ASP 225.A N ASP 192.A OD2 no hydrogen 2.845 N/A LYS 229.A N ARG 226A.A O no hydrogen 3.137 N/A LYS 229.A NZ SER 169.A O no hydrogen 3.246 N/A LYS 229.A NZ GLU 222.A OE1 no hydrogen 2.964 N/A GLY 231.A N ALA 181.A O no hydrogen 3.063 N/A PHE 232.A N TRP 220.A O no hydrogen 2.763 N/A TYR 233.A N PHE 179.A O no hydrogen 2.799 N/A THR 234.A N ILE 217.A O no hydrogen 2.864 N/A THR 234.A OG1 ASP 99.A O no hydrogen 2.787 N/A HIS 235.A N ASN 177.A O no hydrogen 2.888 N/A VAL 236.A N MET 215.A O no hydrogen 3.046 N/A ARG 238.A N HIS 235.A ND1 no hydrogen 3.350 N/A ARG 238.A NE ASN 177.A OD1 no hydrogen 3.092 N/A ARG 238.A NH2 ASN 177.A OD1 no hydrogen 2.992 N/A LEU 239.A N VAL 236.A O no hydrogen 3.056 N/A LYS 240.A N PHE 237.A O no hydrogen 3.014 N/A LYS 240.A NZ PRO 121.A O no hydrogen 2.965 N/A ILE 243.A N LEU 239.A O no hydrogen 3.187 N/A GLN 244.A N LYS 240.A O no hydrogen 2.870 N/A LYS 245.A N LYS 241.A O no hydrogen 3.006 N/A VAL 246.A N TRP 242.A O no hydrogen 3.014 N/A ILE 247.A N ILE 243.A O no hydrogen 2.993 N/A ASP 248.A N GLN 244.A O no hydrogen 2.868 N/A GLN 249.A N LYS 245.A O no hydrogen 3.034 N/A PHE 250.A N VAL 246.A O no hydrogen 2.938 N/A GLY 251.A N ILE 247.A O no hydrogen 2.848 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.828 N/A ARG 73A.A N TYR 71.A O no hydrogen 3.056 N/A GLU 94A.A N ASN 91.A OD1 no hydrogen 2.983 N/A ALA 127A.A N ARG 123.A O no hydrogen 2.946 N/A PHE 208A.A N SER 206.A OG no hydrogen 3.077 N/A ARG 226A.A NE GLU 146.A OE1 no hydrogen 2.946 N/A ARG 226A.A NH2 GLU 146.A OE2 no hydrogen 2.682 N/A SER 128B.A N GLU 124.A O no hydrogen 2.904 N/A SER 128B.A OG GLU 124.A O no hydrogen 3.075 N/A GLU 187B.A N LYS 184.A O no hydrogen 3.013 N/A ASN 209B.A N SER 206.A OG no hydrogen 3.405 N/A ASN 209B.A ND2 TYR 213.A OH no hydrogen 2.913 N/A LEU 129C.A N THR 125.A O no hydrogen 2.942 N/A TRP 50D.A N TYR 47A.A O no hydrogen 3.006 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.961 N/A LYS 52F.A N TYR 47A.A O no hydrogen 3.163 N/A PHE 54H.A N LEU 45.A O no hydrogen 2.866 N/A THR 55I.A N ASP 58.A OD2 no hydrogen 2.805 N/A THR 55I.A OG1 GLU 56.A OE2 no hydrogen 2.985 N/A