Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p8x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NE ARG 200.A O no hydrogen 2.589 N/A SER 8.A N GLN 11.A OE1 no hydrogen 2.918 N/A GLN 11.A N SER 8.A OG no hydrogen 3.000 N/A GLN 12.A N SER 8.A O no hydrogen 2.861 N/A ARG 13.A N GLU 9.A O no hydrogen 2.933 N/A ILE 14.A N GLU 10.A O no hydrogen 2.830 N/A ILE 15.A N GLN 11.A O no hydrogen 3.024 N/A ALA 16.A N GLN 12.A O no hydrogen 2.959 N/A ILE 17.A N ARG 13.A O no hydrogen 2.816 N/A LEU 18.A N ILE 14.A O no hydrogen 2.949 N/A LEU 19.A N ILE 15.A O no hydrogen 2.866 N/A ASP 20.A N ALA 16.A O no hydrogen 2.989 N/A ALA 21.A N ILE 17.A O no hydrogen 2.809 N/A HIS 22.A N LEU 18.A O no hydrogen 2.892 N/A HIS 22.A NE2 GLU 109.A OE2 no hydrogen 3.047 N/A HIS 23.A N LEU 19.A O no hydrogen 2.864 N/A HIS 23.A NE2 GLU 159.A OE1 no hydrogen 2.741 N/A LYS 24.A N ASP 20.A O no hydrogen 2.957 N/A LYS 24.A NZ ASP 20.A OD1 no hydrogen 2.867 N/A THR 25.A N HIS 22.A O no hydrogen 3.076 N/A THR 25.A OG1 ALA 21.A O no hydrogen 2.706 N/A THR 25.A OG1 HIS 22.A O no hydrogen 3.515 N/A TYR 26.A N HIS 22.A O no hydrogen 2.827 N/A TYR 26.A OH TYR 30.A OH no hydrogen 2.738 N/A THR 29.A N ASP 27.A OD1 no hydrogen 2.909 N/A THR 29.A OG1 ASP 27.A OD1 no hydrogen 2.617 N/A THR 29.A OG1 ASP 27.A OD2 no hydrogen 3.227 N/A TYR 30.A N ASP 27.A O no hydrogen 3.109 N/A TYR 30.A OH TYR 26.A OH no hydrogen 2.738 N/A SER 31.A N ASP 27.A OD2 no hydrogen 3.033 N/A SER 31.A OG ASP 27.A OD2 no hydrogen 2.630 N/A PHE 33.A N TYR 30.A O no hydrogen 3.209 N/A CYS 34.A SG SER 31.A O no hydrogen 3.688 N/A GLN 35.A N ASP 32.A O no hydrogen 2.825 N/A PHE 36.A N PHE 33.A O no hydrogen 3.194 N/A ARG 37.A N ASP 64.A OD1 no hydrogen 2.834 N/A ARG 37.A NE ASP 64.A OD1 no hydrogen 2.986 N/A ARG 37.A NE ASP 64.A OD2 no hydrogen 3.400 N/A ARG 37.A NH1 MET 244.A O no hydrogen 2.918 N/A ARG 37.A NH2 ASP 64.A OD2 no hydrogen 2.829 N/A ARG 37.A NH2 LEU 246.A O no hydrogen 2.921 N/A ARG 41.A NE ASP 131.A OD1 no hydrogen 2.511 N/A ARG 41.A NH1 ASP 124.A O no hydrogen 3.097 N/A ARG 41.A NH2 ASP 124.A O no hydrogen 3.067 N/A GLY 47.A N ASP 44.A O no hydrogen 2.813 N/A SER 48.A N ASP 44.A OD1 no hydrogen 2.746 N/A LEU 51.A N SER 48.A OG no hydrogen 3.139 N/A GLU 52.A N SER 48.A O no hydrogen 2.850 N/A LEU 53.A N VAL 49.A O no hydrogen 2.917 N/A SER 54.A N THR 50.A O no hydrogen 3.008 N/A SER 54.A OG.A THR 50.A O no hydrogen 3.333 N/A SER 54.A OG.A LEU 51.A O no hydrogen 2.664 N/A GLN 55.A N LEU 51.A O no hydrogen 2.998 N/A LEU 56.A N GLU 52.A O no hydrogen 2.669 N/A SER 57.A OG VAL 40.A O no hydrogen 2.785 N/A MET 58.A N LYS 134.A O no hydrogen 3.245 N/A LEU 59.A N LEU 56.A O no hydrogen 3.069 N/A HIS 61.A ND1 ARG 37.A O no hydrogen 2.830 N/A HIS 61.A NE2 TYR 127.A OH no hydrogen 2.693 N/A LEU 62.A N MET 58.A O no hydrogen 2.986 N/A ALA 63.A N LEU 59.A O no hydrogen 2.669 N/A ASP 64.A N PRO 60.A O no hydrogen 3.003 N/A LEU 65.A N HIS 61.A O no hydrogen 2.901 N/A VAL 66.A N LEU 62.A O no hydrogen 2.867 N/A SER 67.A N ALA 63.A O no hydrogen 2.783 N/A SER 67.A OG THR 247.A OG1 no hydrogen 2.853 N/A TYR 68.A N ASP 64.A O no hydrogen 2.814 N/A TYR 68.A OH ASP 32.A OD2 no hydrogen 2.696 N/A SER 69.A N LEU 65.A O no hydrogen 2.881 N/A SER 69.A OG LEU 65.A O no hydrogen 2.757 N/A ILE 70.A N VAL 66.A O no hydrogen 2.757 N/A GLN 71.A N SER 67.A O no hydrogen 3.058 N/A LYS 72.A N TYR 68.A O no hydrogen 3.043 N/A VAL 73.A N SER 69.A O no hydrogen 2.831 N/A ILE 74.A N ILE 70.A O no hydrogen 2.872 N/A GLY 75.A N GLN 71.A O no hydrogen 3.087 N/A PHE 76.A N LYS 72.A O no hydrogen 2.837 N/A ALA 77.A N VAL 73.A O no hydrogen 2.807 N/A LYS 78.A N ILE 74.A O no hydrogen 2.986 N/A MET 79.A N PHE 76.A O no hydrogen 2.948 N/A ILE 80.A N ALA 77.A O no hydrogen 2.940 N/A PHE 83.A N ILE 80.A O no hydrogen 2.909 N/A ASP 85.A N GLY 82.A O no hydrogen 2.811 N/A LEU 86.A N PHE 83.A O no hydrogen 3.131 N/A ASP 90.A N THR 87.A OG1 no hydrogen 3.175 N/A GLN 91.A N THR 87.A O no hydrogen 2.863 N/A GLN 91.A NE2 LEU 86.A O no hydrogen 2.839 N/A ILE 92.A N SER 88.A O no hydrogen 2.859 N/A VAL 93.A N GLU 89.A O no hydrogen 3.020 N/A LEU 94.A N ASP 90.A O no hydrogen 2.912 N/A LEU 95.A N GLN 91.A O no hydrogen 2.947 N/A LYS 96.A N ILE 92.A O no hydrogen 2.897 N/A LYS 96.A NZ GLU 252.A OE1 no hydrogen 2.675 N/A SER 97.A N VAL 93.A O no hydrogen 3.059 N/A SER 97.A OG VAL 93.A O no hydrogen 2.833 N/A SER 97.A OG LEU 94.A O no hydrogen 3.116 N/A SER 98.A N LEU 94.A O no hydrogen 2.979 N/A SER 98.A OG LEU 94.A O no hydrogen 2.790 N/A ALA 99.A N LEU 95.A O no hydrogen 2.843 N/A VAL 102.A N SER 98.A O no hydrogen 2.840 N/A ILE 103.A N ALA 99.A O no hydrogen 2.974 N/A MET 104.A N ILE 100.A O no hydrogen 2.939 N/A LEU 105.A N GLU 101.A O no hydrogen 2.913 N/A ARG 106.A N VAL 102.A O no hydrogen 2.771 N/A ARG 106.A NH2 THR 25.A O no hydrogen 2.901 N/A SER 107.A N ILE 103.A O no hydrogen 2.922 N/A SER 107.A OG MET 104.A O no hydrogen 2.794 N/A ASN 108.A N LEU 105.A O no hydrogen 3.046 N/A ASN 108.A ND2 GLN 149.A O no hydrogen 3.013 N/A ASN 108.A ND2 GLN 149.A OE1 no hydrogen 2.790 N/A GLU 109.A N ARG 106.A O no hydrogen 3.159 N/A SER 110.A N SER 107.A O no hydrogen 2.968 N/A SER 110.A OG SER 107.A O no hydrogen 3.071 N/A PHE 111.A N SER 107.A O no hydrogen 3.007 N/A THR 112.A N SER 117.A O no hydrogen 2.779 N/A THR 112.A OG1 ASP 114.A OD2 no hydrogen 2.600 N/A ASP 114.A N THR 112.A OG1 no hydrogen 3.053 N/A SER 117.A N THR 112.A O no hydrogen 3.315 N/A SER 117.A OG ASP 115.A OD1 no hydrogen 2.629 N/A SER 117.A OG ASP 115.A OD2 no hydrogen 3.377 N/A SER 117.A OG THR 119.A OG1 no hydrogen 2.970 N/A TRP 118.A N TYR 127.A O no hydrogen 2.929 N/A TRP 118.A NE1 SER 107.A OG no hydrogen 2.961 N/A THR 119.A N SER 110.A O no hydrogen 2.922 N/A THR 119.A OG1 SER 117.A OG no hydrogen 2.970 N/A CYS 120.A N TYR 125.A O no hydrogen 2.877 N/A TYR 125.A N ASN 122.A O no hydrogen 2.868 N/A LYS 126.A N GLN 123.A O no hydrogen 3.197 N/A LYS 126.A NZ ASP 115.A OD2 no hydrogen 2.919 N/A LYS 126.A NZ SER 117.A OG no hydrogen 3.302 N/A LYS 126.A NZ THR 119.A OG1 no hydrogen 2.704 N/A TYR 127.A N TRP 118.A O no hydrogen 2.788 N/A TYR 127.A OH HIS 61.A NE2 no hydrogen 2.693 N/A ARG 128.A N ASP 131.A OD2 no hydrogen 2.771 N/A ARG 128.A NH1 ASP 115.A O no hydrogen 2.700 N/A ASP 131.A N ARG 128.A O no hydrogen 2.839 N/A VAL 132.A N ARG 128.A O no hydrogen 3.260 N/A VAL 132.A N VAL 129.A O no hydrogen 3.090 N/A THR 133.A N VAL 129.A O no hydrogen 3.119 N/A THR 133.A OG1 SER 130.A O no hydrogen 2.756 N/A LYS 134.A N SER 130.A O no hydrogen 3.168 N/A LYS 134.A NZ SER 130.A O no hydrogen 3.300 N/A ALA 135.A N VAL 132.A O no hydrogen 3.036 N/A GLY 136.A N THR 133.A O no hydrogen 2.995 N/A HIS 137.A N VAL 132.A O no hydrogen 3.359 N/A HIS 137.A ND1 GLN 232.A OE1 no hydrogen 2.845 N/A SER 138.A N GLN 232.A OE1 no hydrogen 2.808 N/A LEU 141.A N SER 138.A O no hydrogen 3.037 N/A ILE 142.A N SER 138.A O no hydrogen 3.166 N/A GLU 143.A N LEU 139.A O no hydrogen 2.962 N/A LEU 145.A N LEU 141.A O no hydrogen 2.973 N/A ILE 146.A N ILE 142.A O no hydrogen 2.864 N/A LYS 147.A N GLU 143.A O no hydrogen 3.016 N/A PHE 148.A N PRO 144.A O no hydrogen 2.838 N/A GLN 149.A N LEU 145.A O no hydrogen 2.843 N/A GLN 149.A NE2 MET 104.A O no hydrogen 2.885 N/A VAL 150.A N ILE 146.A O no hydrogen 2.943 N/A GLY 151.A N LYS 147.A O no hydrogen 2.982 N/A LEU 152.A N PHE 148.A O no hydrogen 2.886 N/A LYS 153.A N GLN 149.A O no hydrogen 2.822 N/A LYS 153.A NZ ASN 108.A O no hydrogen 2.760 N/A LYS 153.A NZ PHE 111.A O no hydrogen 2.861 N/A LYS 154.A N VAL 150.A O no hydrogen 2.887 N/A LEU 155.A N LEU 152.A O no hydrogen 3.077 N/A ASN 156.A N LYS 153.A O no hydrogen 3.053 N/A HIS 158.A N GLU 161.A OE2 no hydrogen 2.810 N/A HIS 158.A ND1 TYR 198.A OH no hydrogen 2.723 N/A GLU 160.A N GLU 160.A OE2 no hydrogen 2.652 N/A HIS 162.A N HIS 158.A O no hydrogen 2.936 N/A VAL 163.A N GLU 159.A O no hydrogen 2.909 N/A LEU 164.A N GLU 160.A O no hydrogen 3.135 N/A LEU 165.A N GLU 161.A O no hydrogen 2.916 N/A MET 166.A N HIS 162.A O no hydrogen 3.166 N/A ALA 167.A N VAL 163.A O no hydrogen 3.052 N/A ILE 168.A N LEU 164.A O no hydrogen 2.841 N/A CYS 169.A N LEU 165.A O no hydrogen 2.906 N/A CYS 169.A SG GLU 101.A OE1 no hydrogen 3.353 N/A ILE 170.A N MET 166.A O no hydrogen 3.044 N/A VAL 171.A N ALA 167.A O no hydrogen 2.947 N/A SER 172.A N ILE 170.A O no hydrogen 2.972 N/A SER 172.A OG.A ILE 168.A O no hydrogen 3.135 N/A SER 172.A OG.A CYS 169.A O no hydrogen 2.708 N/A SER 172.A OG.B ASP 174.A OD2 no hydrogen 2.358 N/A ARG 175.A NH1 GLU 101.A OE2 no hydrogen 2.856 N/A ARG 175.A NH2 GLU 101.A OE1 no hydrogen 2.911 N/A ARG 175.A NH2 CYS 169.A O no hydrogen 3.125 N/A VAL 178.A N ARG 175.A O no hydrogen 3.350 N/A GLN 179.A N ASP 90.A OD2 no hydrogen 2.764 N/A ASP 180.A N ASP 90.A OD1 no hydrogen 2.914 N/A LEU 183.A N ASP 180.A OD2 no hydrogen 3.001 N/A ILE 184.A N ASP 180.A O no hydrogen 3.142 N/A GLU 185.A N ALA 181.A O no hydrogen 2.775 N/A ALA 186.A N ALA 182.A O no hydrogen 2.972 N/A ILE 187.A N LEU 183.A O no hydrogen 3.051 N/A GLN 188.A N ILE 184.A O no hydrogen 2.826 N/A GLN 188.A NE2 ILE 168.A O no hydrogen 3.086 N/A ASP 189.A N GLU 185.A O no hydrogen 2.736 N/A ARG 190.A N ALA 186.A O no hydrogen 3.066 N/A LEU 191.A N ILE 187.A O no hydrogen 3.108 N/A SER 192.A N GLN 188.A O no hydrogen 2.680 N/A SER 192.A OG.A TYR 212.A OH no hydrogen 2.486 N/A SER 192.A OG.B GLN 188.A O no hydrogen 2.964 N/A ASN 193.A N ASP 189.A O no hydrogen 2.738 N/A THR 194.A N ARG 190.A O no hydrogen 3.112 N/A THR 194.A OG1 ARG 190.A O no hydrogen 2.751 N/A LEU 195.A N LEU 191.A O no hydrogen 2.893 N/A GLN 196.A N SER 192.A O no hydrogen 2.822 N/A GLN 196.A NE2 SER 192.A OG.A no hydrogen 3.289 N/A THR 197.A N ASN 193.A O no hydrogen 2.869 N/A THR 197.A OG1 ASN 193.A O no hydrogen 2.734 N/A TYR 198.A N THR 194.A O no hydrogen 2.807 N/A TYR 198.A OH HIS 158.A ND1 no hydrogen 2.723 N/A ILE 199.A N LEU 195.A O no hydrogen 2.946 N/A ARG 200.A N GLN 196.A O no hydrogen 3.141 N/A ARG 200.A NE GLN 196.A O no hydrogen 3.178 N/A ARG 200.A NH2 THR 197.A OG1 no hydrogen 3.407 N/A CYS 201.A N THR 197.A O no hydrogen 3.161 N/A CYS 201.A SG PRO 5.A O no hydrogen 3.871 N/A CYS 201.A SG THR 197.A O no hydrogen 3.255 N/A ARG 202.A N TYR 198.A O no hydrogen 2.739 N/A HIS 203.A N ILE 199.A O no hydrogen 3.196 N/A HIS 203.A ND1 GLU 161.A OE1 no hydrogen 2.730 N/A HIS 209.A N PRO 206.A O no hydrogen 3.077 N/A LEU 211.A N SER 208.A O no hydrogen 2.958 N/A TYR 212.A OH SER 192.A OG.A no hydrogen 2.486 N/A LYS 214.A N LEU 210.A O no hydrogen 3.034 N/A MET 215.A N LEU 211.A O no hydrogen 2.899 N/A ILE 216.A N TYR 212.A O no hydrogen 2.936 N/A GLN 217.A N ALA 213.A O no hydrogen 2.972 N/A GLN 217.A NE2 ASP 221.A OD2 no hydrogen 2.910 N/A LYS 218.A N LYS 214.A O no hydrogen 3.144 N/A LEU 219.A N MET 215.A O no hydrogen 3.312 N/A ALA 220.A N ILE 216.A O no hydrogen 3.255 N/A ASP 221.A N GLN 217.A O no hydrogen 2.932 N/A LEU 222.A N LYS 218.A O no hydrogen 2.910 N/A ARG 223.A N LEU 219.A O no hydrogen 3.386 N/A ARG 223.A N ALA 220.A O no hydrogen 3.050 N/A ARG 223.A NH1 ASP 174.A O no hydrogen 3.504 N/A ARG 223.A NH2 ASP 174.A OD1 no hydrogen 3.539 N/A ARG 223.A NH2 ASP 174.A OD2 no hydrogen 2.638 N/A LEU 225.A N ASP 221.A O no hydrogen 3.103 N/A ASN 226.A N LEU 222.A O no hydrogen 2.760 N/A ASN 226.A ND2 SER 97.A O no hydrogen 2.851 N/A ASN 226.A ND2 GLU 101.A OE2 no hydrogen 2.668 N/A GLU 227.A N ARG 223.A O no hydrogen 2.957 N/A GLU 228.A N SER 224.A O no hydrogen 2.966 N/A HIS 229.A N LEU 225.A O no hydrogen 2.812 N/A SER 230.A N ASN 226.A O no hydrogen 2.908 N/A SER 230.A OG.A GLU 227.A O no hydrogen 2.553 N/A LYS 231.A N GLU 227.A O no hydrogen 3.130 N/A GLN 232.A N GLU 228.A O no hydrogen 3.019 N/A GLN 232.A NE2 SER 138.A O no hydrogen 3.545 N/A GLN 232.A NE2 GLU 228.A OE1 no hydrogen 3.007 N/A TYR 233.A N HIS 229.A O no hydrogen 2.787 N/A ARG 234.A N SER 230.A O no hydrogen 3.026 N/A CYS 235.A N LYS 231.A O no hydrogen 3.228 N/A CYS 235.A SG.B LYS 231.A O no hydrogen 3.388 N/A LEU 236.A N GLN 232.A O no hydrogen 2.890 N/A SER 237.A N TYR 233.A O no hydrogen 2.779 N/A SER 237.A OG ARG 234.A O no hydrogen 2.539 N/A PHE 238.A N CYS 235.A O no hydrogen 3.005 N/A GLN 239.A N LEU 236.A O no hydrogen 2.958 N/A CYS 242.A N GLN 239.A O no hydrogen 2.975 N/A CYS 242.A SG LEU 236.A O no hydrogen 3.438 N/A MET 244.A N GLU 241.A O no hydrogen 3.341 N/A LYS 245.A N CYS 242.A O no hydrogen 2.735 N/A LEU 246.A N SER 243.A O no hydrogen 3.153 N/A THR 247.A OG1 SER 67.A OG no hydrogen 2.853 N/A VAL 250.A N THR 247.A OG1 no hydrogen 3.063 N/A LEU 251.A N THR 247.A O no hydrogen 2.856 N/A GLU 252.A N PRO 248.A O no hydrogen 3.019 N/A VAL 253.A N LEU 249.A O no hydrogen 2.929 N/A PHE 254.A N VAL 250.A O no hydrogen 3.020 N/A