Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2a98_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N ARG 4.A O no hydrogen 3.488 N/A ILE 5.A N MET 46.A O no hydrogen 2.859 N/A LYS 7.A N ASN 44.A O no hydrogen 2.884 N/A LYS 7.A NZ GLU 13.A OE1 no hydrogen 3.249 N/A LYS 7.A NZ GLU 13.A OE2 no hydrogen 3.348 N/A LYS 7.A NZ ASP 214.A OD1 no hydrogen 2.519 N/A PHE 9.A N THR 42.A O no hydrogen 3.105 N/A CYS 12.A SG PHE 215.A O no hydrogen 3.880 N/A CYS 12.A SG GLY 216.A O no hydrogen 3.757 N/A CYS 12.A SG THR 218.A O no hydrogen 3.185 N/A GLN 14.A N CYS 10.A O no hydrogen 3.084 N/A ARG 15.A N GLN 11.A O no hydrogen 2.947 N/A ARG 15.A NH1 GLN 11.A OE1 no hydrogen 3.129 N/A SER 16.A N CYS 12.A O no hydrogen 2.937 N/A SER 16.A OG CYS 12.A O no hydrogen 3.140 N/A LEU 17.A N GLU 13.A O no hydrogen 2.846 N/A GLU 18.A N GLN 14.A O no hydrogen 2.904 N/A GLN 19.A N ARG 15.A O no hydrogen 3.308 N/A LEU 20.A N SER 16.A O no hydrogen 2.794 N/A MET 21.A N LEU 17.A O no hydrogen 2.950 N/A LYS 22.A N GLN 19.A O no hydrogen 3.059 N/A ASP 23.A N LEU 20.A O no hydrogen 3.152 N/A LEU 25.A N ASP 23.A OD2 no hydrogen 2.889 N/A ARG 26.A N ASP 23.A O no hydrogen 2.895 N/A ARG 26.A NH1 MET 21.A O no hydrogen 2.909 N/A PHE 28.A N LEU 25.A O no hydrogen 2.843 N/A VAL 29.A N ARG 26.A O no hydrogen 3.209 N/A ALA 31.A N GLU 47.A OE2 no hydrogen 2.967 N/A TYR 32.A OH ASN 44.A OD1 no hydrogen 3.063 N/A TYR 33.A N GLN 45.A O no hydrogen 3.107 N/A VAL 36.A N PHE 43.A O no hydrogen 2.882 N/A GLN 38.A N GLN 41.A O no hydrogen 3.009 N/A GLN 41.A N GLN 38.A O no hydrogen 2.966 N/A GLN 41.A NE2 ASP 39.A O no hydrogen 3.508 N/A PHE 43.A N VAL 36.A O no hydrogen 2.838 N/A ASN 44.A N LYS 7.A O no hydrogen 2.785 N/A ASN 44.A ND2 CYS 10.A O no hydrogen 3.661 N/A GLN 45.A N GLY 34.A O no hydrogen 2.846 N/A MET 46.A N ILE 5.A O no hydrogen 2.823 N/A GLU 47.A N ALA 31.A O no hydrogen 2.971 N/A ASP 48.A N GLY 3.A O no hydrogen 3.388 N/A LEU 50.A N ASP 48.A OD1 no hydrogen 3.230 N/A ALA 51.A N ASP 48.A O no hydrogen 3.020 N/A PHE 53.A N LEU 50.A O no hydrogen 3.033 N/A GLU 54.A N ASP 203.A OD1 no hydrogen 3.286 N/A GLU 54.A N ASP 203.A OD2 no hydrogen 3.153 N/A SER 57.A N HIS 202.A O no hydrogen 2.863 N/A ILE 58.A N LYS 134.A O no hydrogen 2.886 N/A MET 59.A N PHE 200.A O no hydrogen 2.685 N/A ASP 60.A N GLY 132.A O no hydrogen 3.081 N/A CYS 61.A N LEU 198.A O no hydrogen 2.979 N/A LYS 62.A NZ GLU 131.A OE2 no hydrogen 3.493 N/A MET 63.A N SER 196.A O no hydrogen 2.993 N/A GLY 64.A N GLY 127.A O no hydrogen 2.753 N/A SER 65.A N ASP 240.A O no hydrogen 2.877 N/A SER 65.A OG ASP 240.A O no hydrogen 2.994 N/A ARG 66.A NE GLU 239.A O no hydrogen 3.485 N/A ARG 66.A NH1 TYR 68.A O no hydrogen 2.770 N/A ARG 66.A NH1 GLU 192.A OE2 no hydrogen 2.767 N/A ARG 66.A NH2 GLU 192.A OE2 no hydrogen 2.757 N/A ARG 66.A NH2 GLU 239.A O no hydrogen 3.112 N/A THR 67.A N GLU 118.A OE2 no hydrogen 2.871 N/A THR 67.A OG1 GLU 118.A OE2 no hydrogen 2.596 N/A GLU 72.A N LEU 69.A O no hydrogen 3.204 N/A LEU 73.A N GLU 70.A O no hydrogen 3.058 N/A VAL 74.A N GLU 70.A O no hydrogen 3.092 N/A ARG 77.A NH2 GLU 235.A OE2 no hydrogen 2.819 N/A ARG 83.A N VAL 108.A O no hydrogen 2.852 N/A ARG 83.A NE ASP 85.A OD2 no hydrogen 3.058 N/A GLU 88.A N LYS 84.A O no hydrogen 3.311 N/A LYS 89.A N ASP 85.A O no hydrogen 3.261 N/A MET 90.A N MET 86.A O no hydrogen 2.869 N/A VAL 91.A N TYR 87.A O no hydrogen 2.666 N/A ALA 92.A N GLU 88.A O no hydrogen 2.876 N/A VAL 93.A N MET 90.A O no hydrogen 2.963 N/A ASP 94.A N MET 90.A O no hydrogen 2.881 N/A ALA 97.A N ASP 94.A O no hydrogen 3.241 N/A THR 99.A N GLU 102.A OE1 no hydrogen 3.276 N/A THR 99.A OG1 GLU 101.A OE1 no hydrogen 3.208 N/A GLU 102.A N THR 99.A OG1 no hydrogen 3.225 N/A HIS 103.A N THR 99.A O no hydrogen 2.812 N/A GLN 105.A N GLU 101.A O no hydrogen 3.287 N/A GLY 106.A N HIS 103.A O no hydrogen 3.123 N/A ALA 107.A N GLU 102.A O no hydrogen 3.513 N/A VAL 108.A N ARG 83.A O no hydrogen 3.297 N/A ARG 112.A NE GLU 102.A OE1 no hydrogen 3.397 N/A ARG 112.A NH1 ARG 112.A O no hydrogen 3.287 N/A TYR 113.A N THR 109.A O no hydrogen 3.042 N/A MET 114.A N LYS 110.A O no hydrogen 2.726 N/A GLN 115.A N PRO 111.A O no hydrogen 2.612 N/A GLN 115.A NE2 TYR 68.A OH no hydrogen 2.698 N/A TRP 116.A N ARG 112.A O no hydrogen 2.974 N/A ARG 117.A N TYR 113.A O no hydrogen 2.833 N/A ARG 117.A NH2 GLU 131.A OE1 no hydrogen 2.959 N/A GLU 118.A N MET 114.A O no hydrogen 3.033 N/A THR 119.A N GLN 115.A O no hydrogen 3.162 N/A THR 119.A N TRP 116.A O no hydrogen 3.195 N/A THR 119.A OG1 GLN 115.A O no hydrogen 3.542 N/A THR 119.A OG1 TRP 116.A O no hydrogen 3.191 N/A MET 120.A N TRP 116.A O no hydrogen 2.883 N/A SER 121.A N ARG 117.A O no hydrogen 3.232 N/A SER 121.A OG ARG 117.A O no hydrogen 2.907 N/A SER 122.A OG PHE 128.A O no hydrogen 2.722 N/A THR 123.A OG1 GLY 64.A O no hydrogen 3.497 N/A SER 124.A N GLU 118.A O no hydrogen 3.033 N/A SER 124.A OG GLU 118.A O no hydrogen 3.001 N/A THR 125.A OG1 SER 122.A O no hydrogen 3.536 N/A LEU 126.A N SER 122.A O no hydrogen 2.512 N/A GLY 127.A N THR 123.A O no hydrogen 2.781 N/A ARG 129.A N LYS 62.A O no hydrogen 2.899 N/A ARG 129.A NE GLU 131.A OE1 no hydrogen 3.402 N/A GLU 131.A N ASP 60.A O no hydrogen 2.798 N/A ILE 133.A N ASN 141.A O no hydrogen 2.854 N/A LYS 134.A N ILE 58.A O no hydrogen 2.998 N/A LYS 135.A N THR 139.A O no hydrogen 2.864 N/A LYS 135.A NZ ASP 159.A O no hydrogen 3.460 N/A LYS 135.A NZ ASP 159.A OD1 no hydrogen 2.837 N/A LYS 135.A NZ ASP 159.A OD2 no hydrogen 3.334 N/A GLY 138.A N LYS 135.A O no hydrogen 2.952 N/A THR 139.A N ASP 137.A OD2 no hydrogen 3.429 N/A THR 139.A OG1 ASP 137.A OD2 no hydrogen 2.984 N/A ASN 141.A N ILE 133.A O no hydrogen 2.808 N/A ASN 143.A N ASN 141.A OD1 no hydrogen 2.942 N/A LYS 146.A NZ VAL 93.A O no hydrogen 3.527 N/A THR 147.A N PHE 144.A O no hydrogen 3.046 N/A THR 147.A OG1 PHE 144.A O no hydrogen 3.451 N/A GLN 148.A N GLN 152.A OE1 no hydrogen 2.965 N/A ALA 149.A N GLN 152.A OE1 no hydrogen 2.775 N/A GLU 151.A N GLU 151.A OE2 no hydrogen 2.344 N/A GLN 152.A N ALA 149.A O no hydrogen 3.004 N/A VAL 153.A N ALA 149.A O no hydrogen 3.159 N/A THR 154.A N LEU 150.A O no hydrogen 2.888 N/A LYS 155.A N GLU 151.A O no hydrogen 3.230 N/A VAL 156.A N GLN 152.A O no hydrogen 3.240 N/A LEU 157.A N VAL 153.A O no hydrogen 3.027 N/A GLU 158.A N THR 154.A O no hydrogen 2.783 N/A ASP 159.A N LYS 155.A O no hydrogen 3.044 N/A PHE 160.A N VAL 156.A O no hydrogen 2.978 N/A VAL 161.A N LEU 157.A O no hydrogen 3.136 N/A ASP 162.A N GLU 158.A O no hydrogen 2.919 N/A ASP 164.A N VAL 161.A O no hydrogen 3.109 N/A HIS 165.A NE2 ALA 257.A O no hydrogen 3.117 N/A ILE 167.A N ASP 164.A OD1 no hydrogen 3.189 N/A LEU 168.A N ASP 164.A O no hydrogen 3.223 N/A GLN 169.A N HIS 165.A O no hydrogen 2.765 N/A LYS 170.A N VAL 166.A O no hydrogen 3.020 N/A LYS 170.A NZ GLY 206.A O no hydrogen 2.655 N/A TYR 171.A N ILE 167.A O no hydrogen 3.098 N/A TYR 171.A OH HIS 202.A ND1 no hydrogen 2.775 N/A VAL 172.A N LEU 168.A O no hydrogen 3.038 N/A ALA 173.A N GLN 169.A O no hydrogen 3.034 N/A CYS 174.A N LYS 170.A O no hydrogen 2.938 N/A CYS 174.A SG LYS 170.A O no hydrogen 3.340 N/A LEU 175.A N TYR 171.A O no hydrogen 2.980 N/A GLU 176.A N VAL 172.A O no hydrogen 2.771 N/A GLU 177.A N ALA 173.A O no hydrogen 3.066 N/A LEU 178.A N CYS 174.A O no hydrogen 2.822 N/A ARG 179.A N LEU 175.A O no hydrogen 2.977 N/A ARG 179.A NH1 ASP 247.A OD1 no hydrogen 2.732 N/A GLU 180.A N GLU 176.A O no hydrogen 3.373 N/A ALA 181.A N GLU 177.A O no hydrogen 3.224 N/A LEU 182.A N LEU 178.A O no hydrogen 2.826 N/A GLU 183.A N ARG 179.A O no hydrogen 3.137 N/A SER 185.A N LEU 182.A O no hydrogen 3.431 N/A SER 185.A OG ASP 23.A OD1 no hydrogen 3.219 N/A SER 185.A OG ASP 23.A OD2 no hydrogen 2.671 N/A PHE 187.A N ASP 23.A OD1 no hydrogen 3.078 N/A PHE 188.A N SER 185.A OG no hydrogen 3.166 N/A LYS 189.A N SER 185.A O no hydrogen 3.036 N/A THR 190.A N PRO 186.A O no hydrogen 3.146 N/A THR 190.A N PHE 187.A O no hydrogen 3.090 N/A THR 190.A OG1 PRO 186.A O no hydrogen 2.748 N/A THR 190.A OG1 PHE 187.A O no hydrogen 3.475 N/A THR 190.A OG1 HIS 191.A ND1 no hydrogen 3.297 N/A HIS 191.A N PHE 188.A O no hydrogen 3.197 N/A HIS 191.A ND1 PHE 187.A O no hydrogen 2.812 N/A GLU 192.A N VAL 219.A O no hydrogen 2.951 N/A VAL 193.A N ASP 240.A OD1 no hydrogen 3.244 N/A VAL 193.A N ASP 240.A OD2 no hydrogen 3.069 N/A SER 197.A N ILE 213.A O no hydrogen 2.779 N/A SER 197.A OG ASP 60.A OD1 no hydrogen 2.679 N/A SER 197.A OG ASP 60.A OD2 no hydrogen 3.510 N/A LEU 198.A N CYS 61.A O no hydrogen 2.891 N/A LEU 199.A N TRP 211.A O no hydrogen 2.774 N/A PHE 200.A N MET 59.A O no hydrogen 2.728 N/A VAL 201.A N LYS 209.A O no hydrogen 3.098 N/A HIS 202.A N SER 57.A O no hydrogen 3.087 N/A HIS 202.A ND1 TYR 171.A OH no hydrogen 2.775 N/A ASP 203.A N LEU 207.A O no hydrogen 2.967 N/A THR 205.A OG1 ASP 203.A OD2 no hydrogen 3.280 N/A GLY 206.A N ASP 203.A O no hydrogen 3.018 N/A LYS 209.A N VAL 201.A O no hydrogen 3.061 N/A TRP 211.A N LEU 199.A O no hydrogen 2.991 N/A MET 212.A N PHE 28.A O no hydrogen 2.740 N/A ILE 213.A N SER 197.A O no hydrogen 2.951 N/A PHE 215.A N GLU 13.A OE2 no hydrogen 2.884 N/A THR 218.A N PHE 215.A O no hydrogen 3.492 N/A VAL 219.A N GLU 192.A O no hydrogen 3.003 N/A LEU 221.A N THR 190.A O no hydrogen 3.138 N/A GLN 225.A N PRO 222.A O no hydrogen 3.263 N/A LEU 227.A N LYS 189.A O no hydrogen 3.273 N/A SER 228.A N GLU 239.A OE2 no hydrogen 3.075 N/A SER 228.A OG GLU 239.A OE1 no hydrogen 3.376 N/A SER 228.A OG GLU 239.A OE2 no hydrogen 3.052 N/A HIS 229.A N GLU 239.A OE1 no hydrogen 2.893 N/A HIS 229.A NE2 PHE 188.A O no hydrogen 2.920 N/A ARG 230.A N SER 228.A OG no hydrogen 3.190 N/A ARG 230.A NE ASP 247.A OD2 no hydrogen 2.642 N/A ARG 230.A NH1 GLU 183.A OE2 no hydrogen 3.036 N/A ARG 230.A NH2 GLU 183.A OE2 no hydrogen 3.238 N/A ARG 230.A NH2 ASP 247.A OD1 no hydrogen 3.046 N/A ARG 230.A NH2 ASP 247.A OD2 no hydrogen 2.935 N/A LEU 231.A N SER 228.A OG no hydrogen 3.114 N/A TRP 233.A NE1 GLU 70.A OE2 no hydrogen 2.905 N/A GLY 236.A N GLU 70.A OE1 no hydrogen 3.245 N/A ASN 237.A N ALA 234.A O no hydrogen 2.713 N/A ARG 238.A N GLU 70.A OE2 no hydrogen 3.105 N/A ARG 238.A NE GLU 192.A OE1 no hydrogen 2.941 N/A ARG 238.A NH2 GLU 192.A OE1 no hydrogen 3.383 N/A LEU 243.A N HIS 229.A O no hydrogen 2.844 N/A GLY 245.A N GLY 241.A O no hydrogen 2.916 N/A LEU 246.A N TYR 242.A O no hydrogen 2.933 N/A ASP 247.A N LEU 243.A O no hydrogen 2.891 N/A ASN 248.A N TRP 244.A O no hydrogen 3.038 N/A ASN 248.A ND2 LEU 126.A O no hydrogen 2.524 N/A MET 249.A N GLY 245.A O no hydrogen 2.781 N/A ILE 250.A N LEU 246.A O no hydrogen 2.871 N/A CYS 251.A N ASP 247.A O no hydrogen 2.959 N/A LEU 252.A N ASN 248.A O no hydrogen 2.956 N/A LEU 253.A N MET 249.A O no hydrogen 2.956 N/A GLN 254.A N ILE 250.A O no hydrogen 2.867 N/A GLN 254.A NE2 ILE 250.A O no hydrogen 3.207 N/A GLY 255.A N CYS 251.A O no hydrogen 3.020 N/A LEU 256.A N LEU 252.A O no hydrogen 2.925 N/A ALA 257.A N LEU 253.A O no hydrogen 2.918 N/A GLN 258.A N GLN 254.A O no hydrogen 3.157 N/A SER 259.A N LEU 256.A O no hydrogen 3.277 N/A SER 259.A OG GLY 255.A O no hydrogen 2.938 N/A SER 259.A OG LEU 256.A O no hydrogen 3.243 N/A