Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xfm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N SER 4.A OG no hydrogen 2.804 N/A GLY 5.A N PHE 3.A O no hydrogen 2.646 N/A PHE 7.A N GLU 79.A OE2 no hydrogen 3.273 N/A GLU 8.A N GLU 8.A OE1 no hydrogen 2.530 N/A ASP 9.A N ARG 6.A O no hydrogen 2.692 N/A VAL 10.A N ARG 6.A O no hydrogen 3.208 N/A VAL 10.A N PHE 7.A O no hydrogen 2.925 N/A TYR 11.A N PHE 7.A O no hydrogen 2.637 N/A TYR 11.A OH GLU 75.A OE1 no hydrogen 2.746 N/A GLN 12.A N ILE 30.A O no hydrogen 2.628 N/A GLN 14.A N THR 28.A O no hydrogen 2.916 N/A GLN 14.A NE2 GLN 12.A O no hydrogen 3.033 N/A GLN 14.A NE2 GLN 12.A OE1 no hydrogen 3.244 N/A LEU 18.A N VAL 26.A O no hydrogen 2.795 N/A GLY 19.A N VAL 26.A O no hydrogen 3.189 N/A GLY 21.A N ALA 24.A O no hydrogen 2.847 N/A ARG 25.A N ILE 42.A O no hydrogen 3.084 N/A VAL 26.A N GLY 19.A O no hydrogen 2.701 N/A GLN 27.A N VAL 40.A O no hydrogen 2.922 N/A THR 28.A N ASP 16.A OD1 no hydrogen 2.716 N/A THR 28.A OG1 ASP 16.A OD1 no hydrogen 2.849 N/A THR 28.A OG1 ASP 16.A OD2 no hydrogen 2.794 N/A CYS 29.A N TYR 38.A O no hydrogen 2.849 N/A ILE 30.A N GLN 12.A O no hydrogen 2.709 N/A ASN 31.A N GLN 36.A O no hydrogen 3.156 N/A LEU 32.A N VAL 10.A O no hydrogen 3.213 N/A THR 34.A N ASN 31.A OD1 no hydrogen 2.464 N/A SER 35.A N ASN 31.A O no hydrogen 2.613 N/A GLN 36.A N THR 34.A OG1 no hydrogen 3.224 N/A GLN 36.A NE2 GLU 37.A O no hydrogen 3.186 N/A TYR 38.A N CYS 29.A O no hydrogen 2.784 N/A ALA 39.A N PHE 87.A O no hydrogen 2.968 N/A VAL 40.A N GLN 27.A O no hydrogen 2.783 N/A LYS 41.A N LEU 85.A O no hydrogen 2.663 N/A LYS 41.A NZ GLU 57.A OE2 no hydrogen 2.920 N/A ILE 42.A N ARG 25.A O no hydrogen 2.749 N/A ILE 43.A N PHE 83.A O no hydrogen 3.058 N/A GLU 44.A N HIS 23.A O no hydrogen 3.066 N/A LYS 45.A N ASP 81.A O no hydrogen 2.827 N/A LYS 45.A NZ GLU 78.A OE2 no hydrogen 2.897 N/A LYS 45.A NZ GLU 79.A O no hydrogen 2.778 N/A GLN 46.A N GLN 46.A OE1 no hydrogen 2.979 N/A HIS 49.A N GLN 46.A O no hydrogen 3.232 N/A ARG 51.A NH1 GLU 78.A OE2 no hydrogen 2.476 N/A ARG 51.A NH2 GLU 78.A OE1 no hydrogen 3.007 N/A ARG 51.A NH2 GLU 78.A OE2 no hydrogen 2.956 N/A VAL 54.A N ARG 51.A O no hydrogen 3.153 N/A PHE 55.A N ARG 51.A O no hydrogen 3.336 N/A ARG 56.A N SER 52.A O no hydrogen 2.971 N/A ARG 56.A NE LEU 157.A O no hydrogen 2.986 N/A ARG 56.A NH2 LEU 157.A O no hydrogen 3.168 N/A GLU 57.A N ARG 53.A O no hydrogen 3.044 N/A VAL 58.A N VAL 54.A O no hydrogen 2.927 N/A GLU 59.A N PHE 55.A O no hydrogen 2.926 N/A MET 60.A N ARG 56.A O no hydrogen 2.837 N/A LEU 61.A N GLU 57.A O no hydrogen 2.839 N/A TYR 62.A N VAL 58.A O no hydrogen 2.944 N/A GLN 63.A N GLU 59.A O no hydrogen 2.981 N/A CYS 64.A N LEU 61.A O no hydrogen 3.032 N/A CYS 64.A SG MET 60.A O no hydrogen 3.403 N/A GLN 65.A N TYR 62.A O no hydrogen 3.299 N/A GLN 65.A NE2 LEU 61.A O no hydrogen 2.872 N/A GLN 65.A NE2 LEU 71.A O no hydrogen 3.568 N/A GLY 66.A N GLU 72.A OE1 no hydrogen 3.101 N/A ARG 68.A NH1 ASP 116.A OD1 no hydrogen 2.880 N/A ASN 69.A N HIS 67.A ND1 no hydrogen 3.117 N/A ASN 69.A ND2 VAL 150.A O no hydrogen 2.919 N/A VAL 70.A N HIS 67.A O no hydrogen 3.142 N/A LEU 71.A N ILE 152.A O no hydrogen 2.972 N/A GLU 72.A N GLU 88.A OE2 no hydrogen 2.801 N/A LEU 73.A N GLN 65.A OE1 no hydrogen 3.047 N/A ILE 74.A N VAL 86.A O no hydrogen 2.663 N/A GLU 75.A N VAL 86.A O no hydrogen 3.274 N/A PHE 77.A N TYR 84.A O no hydrogen 2.912 N/A GLU 79.A N ARG 82.A O no hydrogen 3.134 N/A ARG 82.A NE GLU 44.A OE1 no hydrogen 3.466 N/A ARG 82.A NH1 TYR 84.A OH no hydrogen 3.191 N/A PHE 83.A N ILE 43.A O no hydrogen 2.842 N/A TYR 84.A N PHE 77.A O no hydrogen 2.783 N/A LEU 85.A N LYS 41.A O no hydrogen 2.874 N/A VAL 86.A N GLU 75.A O no hydrogen 2.896 N/A PHE 87.A N ALA 39.A O no hydrogen 2.576 N/A GLU 88.A N GLU 72.A O no hydrogen 3.150 N/A LYS 89.A NZ THR 28.A OG1 no hydrogen 3.293 N/A LYS 89.A NZ GLU 37.A OE2 no hydrogen 2.815 N/A ARG 91.A NH2 HIS 143.A ND1 no hydrogen 3.145 N/A GLY 92.A N CYS 141.A O no hydrogen 2.881 N/A GLY 93.A N MET 90.A O no hydrogen 3.045 N/A SER 94.A OG PRO 136.A O no hydrogen 2.819 N/A ILE 95.A N ILE 139.A O no hydrogen 2.838 N/A LEU 96.A N SER 94.A OG no hydrogen 2.969 N/A SER 97.A N SER 94.A O no hydrogen 3.143 N/A SER 97.A OG SER 94.A O no hydrogen 2.900 N/A HIS 98.A NE2 GLY 92.A O no hydrogen 2.746 N/A ILE 99.A N ILE 95.A O no hydrogen 2.902 N/A HIS 100.A N LEU 96.A O no hydrogen 2.981 N/A LYS 101.A N SER 97.A O no hydrogen 3.161 N/A ARG 102.A N HIS 98.A O no hydrogen 3.071 N/A ARG 102.A N ILE 99.A O no hydrogen 3.148 N/A ARG 102.A NH1 GLU 109.A OE1 no hydrogen 3.148 N/A ARG 102.A NH1 GLU 109.A OE2 no hydrogen 2.490 N/A ARG 102.A NH2 GLU 109.A OE1 no hydrogen 2.823 N/A HIS 104.A N ARG 102.A O no hydrogen 2.662 N/A HIS 104.A ND1 PHE 105.A O no hydrogen 3.307 N/A PHE 105.A N LEU 197.A O no hydrogen 2.763 N/A ASN 106.A N GLU 109.A OE1 no hydrogen 2.865 N/A GLU 109.A N ASN 106.A OD1 no hydrogen 3.236 N/A ALA 110.A N ASN 106.A O no hydrogen 2.938 N/A SER 111.A N GLU 107.A O no hydrogen 2.886 N/A SER 111.A OG GLU 107.A O no hydrogen 3.297 N/A SER 111.A OG LEU 108.A O no hydrogen 2.668 N/A VAL 112.A N LEU 108.A O no hydrogen 3.240 N/A VAL 113.A N GLU 109.A O no hydrogen 3.303 N/A VAL 114.A N ALA 110.A O no hydrogen 3.091 N/A GLN 115.A N SER 111.A O no hydrogen 2.795 N/A ASP 116.A N VAL 112.A O no hydrogen 2.976 N/A VAL 117.A N VAL 113.A O no hydrogen 2.953 N/A ALA 118.A N VAL 114.A O no hydrogen 2.765 N/A SER 119.A N GLN 115.A O no hydrogen 2.848 N/A SER 119.A OG GLN 115.A O no hydrogen 3.133 N/A ALA 120.A N ASP 116.A O no hydrogen 3.154 N/A LEU 121.A N VAL 117.A O no hydrogen 2.948 N/A ASP 122.A N ALA 118.A O no hydrogen 2.783 N/A PHE 123.A N SER 119.A O no hydrogen 3.124 N/A LEU 124.A N ALA 120.A O no hydrogen 2.924 N/A HIS 125.A N LEU 121.A O no hydrogen 2.731 N/A HIS 125.A ND1 ILE 129.A O no hydrogen 3.043 N/A ASN 126.A N ASP 122.A O no hydrogen 2.922 N/A LYS 127.A N PHE 123.A O no hydrogen 3.381 N/A GLY 128.A N HIS 125.A O no hydrogen 2.807 N/A ILE 129.A N LEU 124.A O no hydrogen 2.654 N/A HIS 131.A N ASP 186.A OD2 no hydrogen 2.871 N/A HIS 131.A NE2 CYS 153.A O no hydrogen 2.844 N/A ARG 132.A N ASP 186.A OD1 no hydrogen 2.766 N/A ARG 132.A NH2 ASP 182.A O no hydrogen 2.849 N/A ASP 133.A N HIS 131.A ND1 no hydrogen 2.981 N/A LYS 135.A NZ ASP 133.A OD2 no hydrogen 3.463 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.895 N/A ASN 138.A N LYS 135.A O no hydrogen 2.788 N/A ILE 139.A N PRO 136.A O no hydrogen 3.260 N/A LEU 140.A N LYS 151.A O no hydrogen 2.836 N/A CYS 141.A N GLY 93.A O no hydrogen 2.688 N/A CYS 141.A SG VAL 147.A O no hydrogen 3.532 N/A GLU 142.A N PRO 149.A O no hydrogen 3.031 N/A GLN 146.A NE2 SER 148.A O no hydrogen 3.038 N/A VAL 150.A N ASP 116.A OD2 no hydrogen 3.127 N/A LYS 151.A N LEU 140.A O no hydrogen 2.841 N/A LYS 151.A NZ GLU 88.A OE1 no hydrogen 2.890 N/A LYS 151.A NZ GLU 88.A OE2 no hydrogen 2.897 N/A ILE 152.A N ASN 69.A O no hydrogen 2.793 N/A CYS 153.A N ASN 138.A O no hydrogen 3.154 N/A CYS 153.A SG ASN 138.A O no hydrogen 3.747 N/A TYR 165.A N SER 162.A O no hydrogen 2.752 N/A MET 166.A N ALA 163.A O no hydrogen 3.051 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 3.085 N/A VAL 170.A N ALA 167.A O no hydrogen 3.234 N/A VAL 171.A N ALA 167.A O no hydrogen 3.016 N/A GLU 172.A N PRO 168.A O no hydrogen 2.645 N/A ALA 173.A N GLU 169.A O no hydrogen 2.844 N/A PHE 174.A N VAL 171.A O no hydrogen 3.271 N/A SER 175.A N GLU 172.A O no hydrogen 2.752 N/A SER 175.A OG GLU 172.A O no hydrogen 2.890 N/A SER 175.A OG GLU 172.A OE1 no hydrogen 3.529 N/A GLU 177.A N GLU 177.A OE2 no hydrogen 2.832 N/A SER 179.A OG GLU 176.A O no hydrogen 2.994 N/A ILE 180.A N GLU 176.A O no hydrogen 3.343 N/A TYR 181.A N GLU 177.A O no hydrogen 2.969 N/A ASP 182.A N ALA 178.A O no hydrogen 3.189 N/A LYS 183.A N ILE 180.A O no hydrogen 3.271 N/A LYS 183.A NZ SER 179.A O no hydrogen 2.947 N/A LYS 183.A NZ ASP 182.A OD1.B no hydrogen 2.603 N/A ARG 184.A N TYR 181.A O no hydrogen 3.184 N/A ARG 184.A NH1 ALA 257.A O no hydrogen 2.965 N/A ARG 184.A NH1 LYS 258.A O no hydrogen 3.406 N/A CYS 185.A SG.B ASP 182.A O no hydrogen 3.282 N/A CYS 185.A SG.B ASP 186.A OD1 no hydrogen 3.659 N/A ASP 186.A N LYS 183.A O no hydrogen 3.368 N/A LEU 187.A N ARG 184.A O no hydrogen 2.945 N/A TRP 188.A N ARG 184.A O no hydrogen 3.296 N/A SER 189.A N CYS 185.A O no hydrogen 3.300 N/A LEU 190.A N ASP 186.A O no hydrogen 2.815 N/A GLY 191.A N LEU 187.A O no hydrogen 3.167 N/A VAL 192.A N TRP 188.A O no hydrogen 3.002 N/A ILE 193.A N SER 189.A O no hydrogen 3.046 N/A LEU 194.A N LEU 190.A O no hydrogen 2.840 N/A TYR 195.A N GLY 191.A O no hydrogen 2.998 N/A TYR 195.A OH GLU 232.A O no hydrogen 2.658 N/A ILE 196.A N VAL 192.A O no hydrogen 3.245 N/A LEU 197.A N ILE 193.A O no hydrogen 2.958 N/A LEU 198.A N LEU 194.A O no hydrogen 3.006 N/A LEU 198.A N TYR 195.A O no hydrogen 3.311 N/A SER 199.A N TYR 195.A O no hydrogen 3.073 N/A SER 199.A OG TYR 195.A O no hydrogen 3.021 N/A GLY 200.A N ILE 196.A O no hydrogen 2.737 N/A TYR 201.A N SER 199.A OG no hydrogen 3.134 N/A TYR 201.A OH ASP 237.A OD2 no hydrogen 3.090 N/A CYS 208.A SG ARG 207.A O no hydrogen 2.698 N/A CYS 208.A SG ASP 211.A O no hydrogen 3.468 N/A CYS 212.A N ASP 211.A OD1 no hydrogen 2.799 N/A CYS 218.A SG GLY 206.A O no hydrogen 3.463 N/A GLN 219.A N CYS 215.A O no hydrogen 3.003 N/A ASN 220.A N PRO 216.A O no hydrogen 2.846 N/A MET 221.A N ALA 217.A O no hydrogen 2.933 N/A LEU 222.A N CYS 218.A O no hydrogen 2.934 N/A PHE 223.A N GLN 219.A O no hydrogen 2.835 N/A GLU 224.A N ASN 220.A O no hydrogen 2.807 N/A SER 225.A N MET 221.A O no hydrogen 2.838 N/A ILE 226.A N LEU 222.A O no hydrogen 2.791 N/A GLN 227.A N PHE 223.A O no hydrogen 2.834 N/A GLU 228.A N GLU 224.A O no hydrogen 3.014 N/A GLY 229.A N SER 225.A O no hydrogen 2.840 N/A LYS 230.A NZ GLU 228.A OE1 no hydrogen 3.569 N/A ASP 237.A N PRO 234.A O no hydrogen 3.068 N/A TRP 238.A N PRO 234.A O no hydrogen 2.879 N/A ALA 239.A N ASP 235.A O no hydrogen 3.062 N/A ILE 241.A N TRP 238.A O no hydrogen 3.134 N/A SER 242.A N GLU 107.A OE2 no hydrogen 2.974 N/A SER 242.A OG GLU 107.A OE1 no hydrogen 2.774 N/A LYS 246.A NZ TRP 238.A O no hydrogen 2.774 N/A LYS 246.A NZ ILE 241.A O no hydrogen 3.097 N/A ASP 247.A N CYS 243.A O no hydrogen 2.719 N/A LEU 248.A N ALA 244.A O no hydrogen 2.952 N/A ILE 249.A N ALA 245.A O no hydrogen 3.103 N/A SER 250.A N LYS 246.A O no hydrogen 2.929 N/A SER 250.A OG LYS 246.A O no hydrogen 3.214 N/A SER 250.A OG ASP 247.A O no hydrogen 2.477 N/A LYS 251.A N ASP 247.A O no hydrogen 2.897 N/A LYS 251.A NZ ASP 247.A OD1 no hydrogen 2.786 N/A LYS 251.A NZ ASP 247.A OD2 no hydrogen 3.419 N/A LEU 252.A N ILE 249.A O no hydrogen 3.234 N/A LEU 253.A N ILE 249.A O no hydrogen 2.810 N/A ARG 255.A NH1 GLN 227.A O no hydrogen 2.649 N/A GLN 259.A N ASP 256.A O no hydrogen 2.823 N/A ARG 260.A N ASP 256.A O no hydrogen 2.970 N/A ARG 260.A NE VAL 254.A O no hydrogen 2.884 N/A ARG 260.A NH1 ARG 184.A O no hydrogen 2.774 N/A ARG 260.A NH2 VAL 254.A O no hydrogen 3.180 N/A LEU 261.A N LYS 251.A O no hydrogen 3.307 N/A SER 262.A N GLN 265.A OE1 no hydrogen 3.035 N/A GLN 265.A N SER 262.A O no hydrogen 3.058 N/A GLN 265.A N SER 262.A OG no hydrogen 3.135 N/A VAL 266.A N SER 262.A O no hydrogen 2.873 N/A LEU 267.A N ALA 263.A O no hydrogen 2.972 N/A GLN 268.A N GLN 265.A O no hydrogen 2.821 N/A HIS 269.A N GLN 265.A O no hydrogen 2.911 N/A HIS 269.A NE2 ASP 247.A OD2 no hydrogen 3.149 N/A TRP 271.A N HIS 269.A ND1 no hydrogen 3.040 N/A TRP 271.A NE1 GLU 107.A OE1 no hydrogen 2.955 N/A GLN 273.A N HIS 269.A O no hydrogen 3.021 N/A GLN 273.A NE2 LEU 267.A O no hydrogen 3.638 N/A GLY 274.A N PRO 270.A O no hydrogen 2.571 N/A CYS 275.A N TRP 271.A O no hydrogen 3.139 N/A ALA 276.A N VAL 272.A O no hydrogen 3.124 N/A