Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3si9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N VAL 202.A O no hydrogen 2.879 N/A ALA 6.A N ASN 38.A OD1 no hydrogen 2.930 N/A VAL 7.A N CYS 204.A O no hydrogen 3.052 N/A THR 8.A N GLY 39.A O no hydrogen 2.953 N/A THR 8.A OG1 GLN 32.A OE1 no hydrogen 2.419 N/A THR 8.A OG1 SER 209.A O no hydrogen 3.489 N/A THR 8.A OG1 SER 209.A OG no hydrogen 2.522 N/A ALA 9.A N SER 206.A O no hydrogen 2.871 N/A LEU 10.A N SER 41.A O no hydrogen 2.938 N/A ILE 11.A N ASN 210.A OD1 no hydrogen 3.084 N/A THR 12.A OG1 GLY 47.A O no hydrogen 2.609 N/A ASP 15.A N ALA 19.A O no hydrogen 2.846 N/A ASN 17.A N ASP 15.A OD1 no hydrogen 2.839 N/A GLY 18.A N ASP 15.A O no hydrogen 2.998 N/A ALA 19.A N ASP 15.A OD1 no hydrogen 3.104 N/A ASP 21.A N PRO 13.A O no hydrogen 2.900 N/A ALA 24.A N ASP 21.A OD1 no hydrogen 2.847 N/A PHE 25.A N ASP 21.A O no hydrogen 3.068 N/A CYS 26.A N GLU 22.A O no hydrogen 2.923 N/A CYS 26.A SG GLU 22.A O no hydrogen 3.396 N/A ASN 27.A N LYS 23.A O no hydrogen 2.959 N/A PHE 28.A N ALA 24.A O no hydrogen 2.883 N/A VAL 29.A N PHE 25.A O no hydrogen 2.978 N/A GLU 30.A N CYS 26.A O no hydrogen 2.995 N/A TRP 31.A N ASN 27.A O no hydrogen 2.956 N/A GLN 32.A N PHE 28.A O no hydrogen 2.906 N/A GLN 32.A NE2 SER 209.A O no hydrogen 2.792 N/A ILE 33.A N VAL 29.A O no hydrogen 3.037 N/A THR 34.A N GLU 30.A O no hydrogen 3.080 N/A THR 34.A OG1 GLU 30.A O no hydrogen 3.377 N/A THR 34.A OG1 TRP 31.A O no hydrogen 3.154 N/A GLN 35.A N TRP 31.A O no hydrogen 2.917 N/A GLY 36.A N ILE 33.A O no hydrogen 2.944 N/A ILE 37.A N GLN 32.A O no hydrogen 3.143 N/A ASN 38.A N ALA 6.A O no hydrogen 2.850 N/A VAL 40.A N PRO 73.A O no hydrogen 2.958 N/A SER 41.A N THR 8.A O no hydrogen 2.796 N/A SER 41.A OG VAL 75.A O no hydrogen 2.748 N/A GLU 48.A N THR 45.A O no hydrogen 3.017 N/A SER 49.A N GLY 44.A O no hydrogen 2.975 N/A SER 49.A OG GLY 44.A O no hydrogen 2.790 N/A THR 51.A N GLU 48.A O no hydrogen 2.871 N/A THR 51.A OG1 GLU 48.A O no hydrogen 3.192 N/A LEU 52.A N SER 49.A O no hydrogen 3.233 N/A THR 53.A N GLU 56.A OE1 no hydrogen 3.043 N/A THR 53.A OG1 GLU 55.A OE1 no hydrogen 2.781 N/A HIS 54.A NE2 GLU 85.A OE2 no hydrogen 2.588 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.648 N/A GLU 56.A N THR 53.A OG1 no hydrogen 3.115 N/A HIS 57.A N THR 53.A O no hydrogen 2.865 N/A HIS 57.A NE2 GLY 77.A O no hydrogen 2.768 N/A LYS 58.A N HIS 54.A O no hydrogen 2.979 N/A ARG 59.A N GLU 55.A O no hydrogen 3.045 N/A ARG 59.A NE GLU 22.A OE2 no hydrogen 3.077 N/A ARG 59.A NH2 GLU 22.A OE1 no hydrogen 3.129 N/A ILE 60.A N GLU 56.A O no hydrogen 2.799 N/A ILE 61.A N HIS 57.A O no hydrogen 3.255 N/A GLU 62.A N LYS 58.A O no hydrogen 2.987 N/A LEU 63.A N ARG 59.A O no hydrogen 2.924 N/A CYS 64.A N ILE 60.A O no hydrogen 2.943 N/A VAL 65.A N ILE 61.A O no hydrogen 2.817 N/A GLU 66.A N GLU 62.A O no hydrogen 2.965 N/A GLN 67.A N LEU 63.A O no hydrogen 2.758 N/A GLN 67.A NE2 GLU 30.A OE1 no hydrogen 2.818 N/A VAL 68.A N CYS 64.A O no hydrogen 2.862 N/A ALA 69.A N VAL 65.A O no hydrogen 3.133 N/A ARG 71.A N VAL 68.A O no hydrogen 3.078 N/A ARG 71.A NE VAL 68.A O no hydrogen 2.919 N/A ARG 71.A NH1 GLU 30.A OE1 no hydrogen 3.370 N/A ARG 71.A NH1 GLU 30.A OE2 no hydrogen 2.873 N/A ARG 71.A NH2 GLU 30.A OE1 no hydrogen 2.829 N/A ARG 71.A NH2 GLN 67.A O no hydrogen 2.629 N/A ARG 71.A NH2 VAL 68.A O no hydrogen 3.480 N/A VAL 74.A N ASP 99.A OD2 no hydrogen 2.750 N/A VAL 75.A N VAL 40.A O no hydrogen 2.873 N/A ALA 76.A N ALA 100.A O no hydrogen 2.817 N/A GLY 77.A N PRO 42.A O no hydrogen 2.801 N/A ALA 78.A N LEU 102.A O no hydrogen 2.829 N/A SER 80.A OG GLU 85.A OE1 no hydrogen 2.539 N/A ASN 81.A ND2 TYR 107.A O no hydrogen 3.086 N/A SER 82.A N SER 80.A OG no hydrogen 3.038 N/A THR 83.A OG1 HIS 119.A ND1 no hydrogen 2.767 N/A GLU 85.A N SER 82.A OG no hydrogen 3.353 N/A ALA 86.A N SER 82.A O no hydrogen 2.859 N/A VAL 87.A N THR 83.A O no hydrogen 2.856 N/A GLU 88.A N.A SER 84.A O no hydrogen 3.265 N/A GLU 88.A N.A GLU 85.A O no hydrogen 3.107 N/A GLU 88.A N.B SER 84.A O no hydrogen 3.267 N/A LEU 89.A N GLU 85.A O no hydrogen 2.911 N/A ALA 90.A N ALA 86.A O no hydrogen 2.840 N/A LYS 91.A N VAL 87.A O no hydrogen 3.110 N/A HIS 92.A N GLU 88.A O.A no hydrogen 3.112 N/A HIS 92.A N GLU 88.A O.B no hydrogen 3.124 N/A ALA 93.A N LEU 89.A O no hydrogen 3.027 N/A GLU 94.A N ALA 90.A O no hydrogen 2.969 N/A LYS 95.A N LYS 91.A O no hydrogen 2.793 N/A ALA 96.A N HIS 92.A O no hydrogen 2.838 N/A ALA 96.A N ALA 93.A O no hydrogen 3.249 N/A GLY 97.A N GLU 94.A O no hydrogen 2.936 N/A ALA 98.A N ALA 93.A O no hydrogen 3.048 N/A ASP 99.A N VAL 74.A O no hydrogen 2.929 N/A ALA 100.A N VAL 74.A O no hydrogen 3.169 N/A VAL 101.A N PRO 130.A O no hydrogen 2.911 N/A LEU 102.A N ALA 76.A O no hydrogen 2.853 N/A VAL 103.A N ILE 132.A O no hydrogen 3.121 N/A THR 105.A N TYR 134.A O no hydrogen 3.104 N/A THR 105.A OG1 SER 140.A OG no hydrogen 3.209 N/A ASN 109.A N TYR 107.A O no hydrogen 2.794 N/A ASN 109.A ND2 ASN 81.A O no hydrogen 3.016 N/A GLN 113.A NE2 ASP 143.A O no hydrogen 2.875 N/A GLY 115.A N ASN 112.A OD1 no hydrogen 3.009 N/A LEU 116.A N ASN 112.A O no hydrogen 2.981 N/A TYR 117.A N GLN 113.A O no hydrogen 3.029 N/A TYR 117.A OH ASP 155.A OD2 no hydrogen 2.612 N/A THR 118.A N ARG 114.A O.A no hydrogen 3.015 N/A THR 118.A N ARG 114.A O.B no hydrogen 2.923 N/A THR 118.A OG1 ARG 114.A O.A no hydrogen 2.856 N/A THR 118.A OG1 ARG 114.A O.B no hydrogen 2.978 N/A HIS 119.A N GLY 115.A O no hydrogen 2.817 N/A HIS 119.A ND1 THR 83.A OG1 no hydrogen 2.767 N/A PHE 120.A N LEU 116.A O no hydrogen 3.005 N/A SER 121.A N TYR 117.A O no hydrogen 2.941 N/A SER 121.A OG TYR 117.A O no hydrogen 2.601 N/A SER 121.A OG THR 118.A O no hydrogen 3.023 N/A SER 122.A N THR 118.A O no hydrogen 3.095 N/A SER 122.A OG THR 118.A O no hydrogen 2.696 N/A ILE 123.A N HIS 119.A O no hydrogen 3.402 N/A ALA 124.A N PHE 120.A O no hydrogen 3.023 N/A LYS 125.A N SER 121.A O no hydrogen 3.011 N/A ALA 126.A N ILE 123.A O no hydrogen 2.909 N/A ILE 127.A N ILE 123.A O no hydrogen 3.269 N/A SER 128.A N GLU 94.A OE1 no hydrogen 2.746 N/A ILE 129.A N GLU 94.A OE1 no hydrogen 2.991 N/A ILE 131.A N ASN 158.A O no hydrogen 2.623 N/A ILE 132.A N VAL 101.A O no hydrogen 2.856 N/A ILE 133.A N GLY 161.A O no hydrogen 2.673 N/A TYR 134.A N VAL 103.A O no hydrogen 3.009 N/A ASN 135.A N LYS 163.A O no hydrogen 3.018 N/A ASN 135.A ND2 ASP 143.A OD1 no hydrogen 2.751 N/A ARG 139.A N ILE 136.A O no hydrogen 2.964 N/A SER 140.A N ILE 136.A O no hydrogen 2.904 N/A SER 140.A OG THR 105.A O no hydrogen 2.762 N/A SER 140.A OG THR 105.A OG1 no hydrogen 3.209 N/A VAL 141.A N PRO 137.A O no hydrogen 2.856 N/A MET 144.A N ASN 135.A OD1 no hydrogen 3.007 N/A ALA 145.A N GLN 113.A OE1 no hydrogen 2.943 N/A THR 148.A OG1 GLN 113.A OE1 no hydrogen 2.684 N/A MET 149.A N ALA 145.A O no hydrogen 2.985 N/A ARG 150.A N VAL 146.A O no hydrogen 2.821 N/A ARG 150.A NE ASP 151.A OD1 no hydrogen 3.467 N/A ARG 150.A NH2 ASP 151.A OD1 no hydrogen 3.003 N/A ASP 151.A N GLU 147.A O no hydrogen 2.864 N/A LEU 152.A N THR 148.A O no hydrogen 3.037 N/A CYS 153.A N.A MET 149.A O no hydrogen 2.998 N/A CYS 153.A N.B MET 149.A O no hydrogen 3.018 N/A CYS 153.A SG.A MET 149.A O no hydrogen 3.657 N/A CYS 153.A SG.A ARG 150.A O no hydrogen 3.362 N/A CYS 153.A SG.A CYS 179.A O no hydrogen 3.938 N/A CYS 153.A SG.B MET 149.A O no hydrogen 3.610 N/A CYS 153.A SG.B ILE 159.A O no hydrogen 3.265 N/A ARG 154.A N ARG 150.A O no hydrogen 2.955 N/A ASP 155.A N ASP 151.A O no hydrogen 2.924 N/A PHE 156.A N LEU 152.A O no hydrogen 2.996 N/A ASN 158.A ND2 ALA 124.A O no hydrogen 2.997 N/A ASN 158.A ND2 ILE 129.A O no hydrogen 3.433 N/A ILE 159.A N PHE 156.A O no hydrogen 3.271 N/A ILE 160.A N ILE 131.A O no hydrogen 3.106 N/A VAL 162.A N VAL 184.A O no hydrogen 2.840 N/A LYS 163.A N ILE 133.A O no hydrogen 2.602 N/A ASP 164.A N LEU 186.A O no hydrogen 2.830 N/A ALA 165.A N ASN 135.A O no hydrogen 2.845 N/A THR 166.A N ASP 164.A OD1 no hydrogen 2.907 N/A THR 166.A OG1 ASP 164.A OD1 no hydrogen 2.559 N/A LYS 168.A N THR 166.A OG1 no hydrogen 3.235 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.744 N/A ARG 171.A N LYS 168.A O no hydrogen 2.796 N/A ARG 171.A NE GLN 175.A OE1 no hydrogen 2.861 N/A ARG 171.A NH1 ASP 143.A OD1 no hydrogen 2.959 N/A ARG 171.A NH1 ASP 143.A OD2 no hydrogen 2.696 N/A ARG 171.A NH1 MET 144.A O no hydrogen 3.558 N/A ARG 171.A NH2 MET 144.A O no hydrogen 2.888 N/A ARG 171.A NH2 GLN 175.A OE1 no hydrogen 2.852 N/A ALA 172.A N ILE 169.A O no hydrogen 3.021 N/A GLU 174.A N GLU 170.A O no hydrogen 3.015 N/A GLN 175.A N ARG 171.A O no hydrogen 2.807 N/A GLN 175.A NE2 ASP 164.A OD2 no hydrogen 3.220 N/A GLN 175.A NE2 GLN 185.A OE1 no hydrogen 2.857 N/A ARG 176.A N ALA 172.A O no hydrogen 2.944 N/A GLU 177.A N SER 173.A O no hydrogen 2.981 N/A LYS 178.A N GLU 174.A O no hydrogen 3.065 N/A LYS 178.A NZ GLU 174.A OE1 no hydrogen 2.706 N/A CYS 179.A N GLN 175.A O no hydrogen 2.858 N/A PHE 183.A N GLY 180.A O no hydrogen 3.388 N/A VAL 184.A N ILE 160.A O no hydrogen 2.874 N/A GLN 185.A NE2 ALA 172.A O no hydrogen 2.999 N/A LEU 186.A N VAL 162.A O no hydrogen 2.902 N/A SER 187.A N GLY 203.A O no hydrogen 2.917 N/A SER 187.A OG ASP 189.A O no hydrogen 3.239 N/A GLY 188.A N ASP 164.A O no hydrogen 2.798 N/A ASP 189.A N SER 187.A OG no hydrogen 2.790 N/A CYS 191.A N ASP 189.A OD1 no hydrogen 3.322 N/A THR 192.A N ASP 189.A O no hydrogen 2.786 N/A THR 192.A OG1 ASP 189.A O no hydrogen 3.366 N/A THR 192.A OG1 ASP 189.A OD2 no hydrogen 2.415 N/A ALA 193.A N ASP 190.A O no hydrogen 3.418 N/A PHE 196.A N THR 192.A O no hydrogen 2.925 N/A ASN 197.A N ALA 193.A O no hydrogen 2.879 N/A ASN 197.A ND2 HIS 220.A ND1 no hydrogen 2.829 N/A ALA 198.A N LEU 194.A O no hydrogen 3.201 N/A HIS 199.A N GLY 195.A O no hydrogen 3.102 N/A HIS 199.A ND1 SER 173.A OG no hydrogen 2.681 N/A GLY 200.A N ASN 197.A O no hydrogen 3.035 N/A GLY 201.A N PHE 196.A O no hydrogen 2.887 N/A VAL 202.A N GLN 185.A O no hydrogen 2.884 N/A GLY 203.A N ASN 197.A OD1 no hydrogen 3.010 N/A CYS 204.A N GLY 5.A O no hydrogen 3.124 N/A CYS 204.A SG SER 187.A O no hydrogen 3.450 N/A CYS 204.A SG ASP 190.A OD1 no hydrogen 3.566 N/A ILE 205.A N SER 187.A O no hydrogen 2.919 N/A SER 206.A N VAL 7.A O no hydrogen 2.807 N/A SER 206.A OG ASP 190.A OD1 no hydrogen 2.641 N/A SER 206.A OG ASP 190.A OD2 no hydrogen 3.418 N/A VAL 207.A N ASP 190.A OD2 no hydrogen 2.849 N/A SER 208.A N ASP 190.A OD2 no hydrogen 2.915 N/A SER 208.A OG ASN 242.A OD1 no hydrogen 2.461 N/A SER 209.A N SER 206.A OG no hydrogen 2.888 N/A SER 209.A OG THR 8.A OG1 no hydrogen 2.522 N/A SER 209.A OG SER 206.A O no hydrogen 3.533 N/A SER 209.A OG SER 206.A OG no hydrogen 3.377 N/A ASN 210.A N VAL 207.A O no hydrogen 2.991 N/A ASN 210.A ND2 ALA 9.A O no hydrogen 2.922 N/A ASN 210.A ND2 VAL 207.A O no hydrogen 2.725 N/A VAL 211.A N SER 208.A O no hydrogen 3.049 N/A ALA 212.A N SER 208.A O no hydrogen 3.019 N/A CYS 216.A N ALA 212.A O no hydrogen 3.005 N/A CYS 216.A SG ALA 212.A O no hydrogen 3.304 N/A ALA 217.A N PRO 213.A O no hydrogen 2.920 N/A GLN 218.A N LYS 214.A O no hydrogen 2.849 N/A LEU 219.A N LEU 215.A O no hydrogen 2.904 N/A HIS 220.A N CYS 216.A O no hydrogen 3.059 N/A ALA 221.A N ALA 217.A O no hydrogen 2.955 N/A ALA 222.A N GLN 218.A O no hydrogen 2.961 N/A CYS 223.A N LEU 219.A O no hydrogen 3.059 N/A CYS 223.A SG LEU 219.A O no hydrogen 3.715 N/A LEU 224.A N HIS 220.A O no hydrogen 2.774 N/A CYS 225.A N ALA 221.A O no hydrogen 2.999 N/A CYS 225.A SG ALA 221.A O no hydrogen 3.570 N/A CYS 225.A SG ALA 222.A O no hydrogen 3.511 N/A SER 226.A N CYS 223.A O no hydrogen 2.737 N/A ASP 227.A N ALA 222.A O no hydrogen 2.721 N/A THR 230.A N ASP 227.A OD1 no hydrogen 3.218 N/A THR 230.A OG1 ASP 227.A OD1 no hydrogen 3.182 N/A THR 230.A OG1 ASP 227.A OD2 no hydrogen 2.445 N/A ALA 231.A N ASP 227.A O no hydrogen 3.092 N/A LEU 232.A N TYR 228.A O no hydrogen 2.880 N/A LYS 233.A N LYS 229.A O no hydrogen 3.240 N/A LEU 234.A N THR 230.A O no hydrogen 2.966 N/A ASN 235.A N ALA 231.A O no hydrogen 2.748 N/A ASP 236.A N LEU 232.A O no hydrogen 2.836 N/A LEU 237.A N LYS 233.A O no hydrogen 3.350 N/A LEU 238.A N LEU 234.A O no hydrogen 3.260 N/A LEU 238.A N ASN 235.A O no hydrogen 3.128 N/A MET 239.A N ASN 235.A O no hydrogen 3.019 N/A ASN 242.A N LEU 238.A O no hydrogen 2.825 N/A ARG 243.A N MET 239.A O no hydrogen 2.916 N/A ALA 244.A N PRO 240.A O no hydrogen 2.921 N/A VAL 245.A N LEU 241.A O no hydrogen 3.029 N/A PHE 246.A N ARG 243.A O no hydrogen 2.856 N/A ILE 247.A N ALA 244.A O no hydrogen 3.200 N/A ALA 252.A N PRO 249.A O no hydrogen 3.301 N/A LYS 255.A N PRO 251.A O no hydrogen 2.928 N/A LYS 255.A NZ THR 12.A O no hydrogen 2.539 N/A LYS 255.A NZ GLU 48.A OE2 no hydrogen 2.886 N/A LYS 255.A NZ ILE 267.A O no hydrogen 3.015 N/A TYR 256.A N ALA 252.A O no hydrogen 3.114 N/A TYR 256.A OH ASP 284.A OD1 no hydrogen 2.703 N/A ALA 257.A N GLY 253.A O no hydrogen 3.064 N/A ALA 258.A N ILE 254.A O no hydrogen 2.816 N/A ALA 259.A N LYS 255.A O no hydrogen 2.770 N/A LYS 260.A N TYR 256.A O no hydrogen 2.828 N/A LEU 261.A N ALA 258.A O no hydrogen 2.996 N/A GLY 262.A N ALA 259.A O no hydrogen 3.026 N/A LEU 263.A N ALA 258.A O no hydrogen 3.050 N/A CYS 264.A SG LYS 255.A O no hydrogen 4.008 N/A CYS 264.A SG GLY 265.A O no hydrogen 3.290 N/A ARG 269.A N GLU 48.A OE1 no hydrogen 2.991 N/A ARG 269.A NE GLY 18.A O no hydrogen 2.976 N/A ARG 269.A NH1 THR 51.A O no hydrogen 2.897 N/A ARG 269.A NH1 GLU 56.A OE1 no hydrogen 2.755 N/A ARG 269.A NH1 GLU 56.A OE2 no hydrogen 3.361 N/A ARG 269.A NH2 GLY 18.A O no hydrogen 2.710 N/A ARG 269.A NH2 GLU 56.A OE2 no hydrogen 2.878 N/A ILE 272.A N ARG 269.A O no hydrogen 3.095 N/A SER 276.A N GLU 248.A OE1 no hydrogen 3.095 N/A SER 276.A OG GLU 248.A OE1 no hydrogen 3.046 N/A THR 279.A OG1 GLU 248.A OE1 no hydrogen 2.520 N/A LYS 280.A N SER 276.A O no hydrogen 3.261 N/A LYS 281.A N ASP 277.A O no hydrogen 3.026 N/A LYS 281.A NZ GLU 285.A OE2 no hydrogen 2.707 N/A ILE 282.A N THR 278.A O no hydrogen 3.229 N/A ILE 283.A N THR 279.A O no hydrogen 2.771 N/A ASP 284.A N LYS 280.A O no hydrogen 2.899 N/A GLU 285.A N LYS 281.A O no hydrogen 2.879 N/A ALA 286.A N ILE 282.A O no hydrogen 3.087 N/A LEU 287.A N ILE 283.A O no hydrogen 2.945 N/A TYR 288.A N ASP 284.A O no hydrogen 2.944 N/A HIS 289.A N GLU 285.A O no hydrogen 2.926 N/A HIS 289.A NE2 ASP 236.A O no hydrogen 2.838 N/A ALA 290.A N ALA 286.A O no hydrogen 2.985 N/A GLY 291.A N TYR 288.A O no hydrogen 3.071 N/A LEU 292.A N LEU 287.A O no hydrogen 2.971 N/A