Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8u4s_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 11.A N GLU 9.A O no hydrogen 2.975 N/A ASN 14.A N ASN 10.A O no hydrogen 3.053 N/A LYS 15.A N ALA 11.A O no hydrogen 2.912 N/A ILE 16.A N PHE 13.A O no hydrogen 3.253 N/A PHE 17.A N PHE 13.A O no hydrogen 2.888 N/A LEU 18.A N ASN 14.A O no hydrogen 2.907 N/A ILE 21.A N PHE 17.A O no hydrogen 3.255 N/A TYR 22.A N LEU 18.A O no hydrogen 2.920 N/A SER 23.A N PRO 19.A O no hydrogen 2.848 N/A SER 23.A OG PRO 19.A O no hydrogen 2.723 N/A ILE 24.A N THR 20.A O no hydrogen 2.943 N/A ILE 25.A N ILE 21.A O no hydrogen 2.942 N/A PHE 26.A N TYR 22.A O no hydrogen 2.821 N/A LEU 27.A N SER 23.A O no hydrogen 2.931 N/A THR 28.A N ILE 24.A O no hydrogen 2.981 N/A THR 28.A OG1 ILE 24.A O no hydrogen 3.093 N/A GLY 29.A N ILE 25.A O no hydrogen 2.823 N/A ILE 30.A N PHE 26.A O no hydrogen 2.883 N/A VAL 31.A N LEU 27.A O no hydrogen 2.975 N/A GLY 32.A N THR 28.A O no hydrogen 2.913 N/A ASN 33.A N GLY 29.A O no hydrogen 2.857 N/A ASN 33.A ND2 GLY 29.A O no hydrogen 2.443 N/A GLY 34.A N ILE 30.A O no hydrogen 2.910 N/A LEU 35.A N VAL 31.A O no hydrogen 2.956 N/A VAL 36.A N GLY 32.A O no hydrogen 2.916 N/A ILE 37.A N ASN 33.A O no hydrogen 2.895 N/A LEU 38.A N GLY 34.A O no hydrogen 2.912 N/A VAL 39.A N LEU 35.A O no hydrogen 2.900 N/A MET 40.A N VAL 36.A O no hydrogen 2.886 N/A GLY 41.A N ILE 37.A O no hydrogen 3.016 N/A LYS 44.A NZ ASP 51.A OD2 no hydrogen 2.945 N/A SER 48.A N ASP 51.A OD2 no hydrogen 3.344 N/A ARG 54.A N THR 50.A O no hydrogen 2.935 N/A LEU 55.A N ASP 51.A O no hydrogen 2.871 N/A HIS 56.A N LYS 52.A O no hydrogen 2.921 N/A LEU 57.A N TYR 53.A O no hydrogen 2.941 N/A SER 58.A N ARG 54.A O no hydrogen 2.895 N/A SER 58.A OG ARG 54.A O no hydrogen 2.851 N/A VAL 59.A N LEU 55.A O no hydrogen 2.892 N/A ALA 60.A N HIS 56.A O no hydrogen 2.963 N/A ASP 61.A N LEU 57.A O no hydrogen 2.925 N/A LEU 62.A N SER 58.A O no hydrogen 2.879 N/A LEU 63.A N VAL 59.A O no hydrogen 2.913 N/A PHE 64.A N ALA 60.A O no hydrogen 2.990 N/A VAL 65.A N ASP 61.A O no hydrogen 2.880 N/A ILE 66.A N LEU 62.A O no hydrogen 2.942 N/A THR 67.A OG1 PHE 64.A O no hydrogen 2.906 N/A LEU 68.A N VAL 65.A O no hydrogen 3.017 N/A TRP 71.A N THR 67.A O no hydrogen 3.440 N/A ALA 72.A N LEU 68.A O no hydrogen 2.930 N/A VAL 73.A N PRO 69.A O no hydrogen 2.901 N/A ASP 74.A N PHE 70.A O no hydrogen 2.915 N/A ALA 75.A N TRP 71.A O no hydrogen 2.889 N/A VAL 76.A N ALA 72.A O no hydrogen 2.920 N/A ALA 77.A N VAL 73.A O no hydrogen 2.651 N/A ASN 78.A ND2 TYR 80.A OH no hydrogen 3.072 N/A TRP 79.A NE1 GLY 82.A O no hydrogen 3.145 N/A CYS 86.A N GLY 82.A O no hydrogen 3.192 N/A LYS 87.A N ASN 83.A O no hydrogen 2.941 N/A LYS 87.A NZ ALA 152.A O no hydrogen 2.339 N/A ALA 88.A N PHE 84.A O no hydrogen 2.917 N/A VAL 89.A N LEU 85.A O no hydrogen 2.875 N/A HIS 90.A N CYS 86.A O no hydrogen 2.987 N/A VAL 91.A N LYS 87.A O no hydrogen 2.916 N/A ILE 92.A N ALA 88.A O no hydrogen 2.937 N/A TYR 93.A N VAL 89.A O no hydrogen 2.921 N/A THR 94.A N HIS 90.A O no hydrogen 2.932 N/A THR 94.A OG1 HIS 90.A O no hydrogen 3.034 N/A VAL 95.A N VAL 91.A O no hydrogen 2.912 N/A SER 96.A N ILE 92.A O no hydrogen 2.954 N/A SER 96.A OG ILE 92.A O no hydrogen 2.957 N/A SER 96.A OG TYR 93.A O no hydrogen 3.189 N/A TYR 98.A OH HIS 180.A ND1 no hydrogen 2.461 N/A SER 99.A N VAL 95.A O no hydrogen 2.946 N/A SER 99.A OG VAL 95.A O no hydrogen 2.661 N/A SER 100.A N SER 96.A O no hydrogen 2.913 N/A SER 100.A OG SER 96.A O no hydrogen 3.181 N/A SER 100.A OG LEU 97.A O no hydrogen 2.620 N/A VAL 101.A N LEU 97.A O no hydrogen 2.962 N/A LEU 102.A N TYR 98.A O no hydrogen 2.974 N/A ILE 103.A N SER 99.A O no hydrogen 2.897 N/A LEU 104.A N SER 100.A O no hydrogen 2.922 N/A ALA 105.A N VAL 101.A O no hydrogen 3.014 N/A PHE 106.A N LEU 102.A O no hydrogen 2.889 N/A ILE 107.A N ILE 103.A O no hydrogen 2.858 N/A SER 108.A N LEU 104.A O no hydrogen 3.003 N/A LEU 109.A N ALA 105.A O no hydrogen 2.920 N/A ASP 110.A N PHE 106.A O no hydrogen 2.868 N/A ARG 111.A N ILE 107.A O no hydrogen 2.933 N/A TYR 112.A N SER 108.A O no hydrogen 2.938 N/A LEU 113.A N LEU 109.A O no hydrogen 2.934 N/A ALA 114.A N ASP 110.A O no hydrogen 2.883 N/A ILE 115.A N ARG 111.A O no hydrogen 2.921 N/A VAL 116.A N TYR 112.A O no hydrogen 3.320 N/A SER 121.A OG ALA 118.A O no hydrogen 3.341 N/A ARG 125.A N SER 121.A O no hydrogen 3.129 N/A ARG 125.A NE ASP 110.A OD1 no hydrogen 3.463 N/A LYS 126.A N GLN 122.A O no hydrogen 2.935 N/A LEU 127.A N ARG 123.A O no hydrogen 2.908 N/A LEU 128.A N PRO 124.A O no hydrogen 2.879 N/A ALA 129.A N ARG 125.A O no hydrogen 2.933 N/A GLU 130.A N LYS 126.A O no hydrogen 2.912 N/A LYS 131.A N LEU 127.A O no hydrogen 2.994 N/A VAL 132.A N LEU 127.A O no hydrogen 3.304 N/A GLY 136.A N VAL 132.A O no hydrogen 2.896 N/A GLY 136.A N VAL 133.A O no hydrogen 3.228 N/A VAL 137.A N VAL 133.A O no hydrogen 2.932 N/A TRP 138.A N TYR 134.A O no hydrogen 2.916 N/A ILE 139.A N TYR 134.A O no hydrogen 3.400 N/A LEU 142.A N TRP 138.A O no hydrogen 2.991 N/A LEU 143.A N ILE 139.A O no hydrogen 2.919 N/A LEU 144.A N PRO 140.A O no hydrogen 2.923 N/A THR 145.A N LEU 142.A O no hydrogen 3.313 N/A THR 145.A OG1 LEU 142.A O no hydrogen 2.778 N/A ILE 146.A N LEU 143.A O no hydrogen 3.361 N/A PHE 149.A N THR 145.A O no hydrogen 2.511 N/A ILE 150.A N ILE 146.A O no hydrogen 2.914 N/A PHE 151.A N PRO 147.A O no hydrogen 2.894 N/A VAL 154.A N ASN 83.A OD1 no hydrogen 3.417 N/A SER 155.A N ILE 162.A O no hydrogen 2.899 N/A ARG 160.A N ALA 157.A O no hydrogen 2.909 N/A ARG 160.A NH1 ASN 78.A OD1 no hydrogen 3.348 N/A ILE 162.A N SER 155.A O no hydrogen 2.916 N/A CYS 163.A SG HIS 90.A NE2 no hydrogen 3.724 N/A PHE 166.A N PHE 151.A O no hydrogen 3.134 N/A TRP 172.A N ASN 169.A O no hydrogen 3.198 N/A VAL 174.A N ASP 170.A O no hydrogen 2.876 N/A VAL 175.A N LEU 171.A O no hydrogen 2.907 N/A PHE 176.A N TRP 172.A O no hydrogen 2.999 N/A GLN 177.A N VAL 173.A O no hydrogen 2.905 N/A PHE 178.A N VAL 174.A O no hydrogen 2.874 N/A GLN 179.A N VAL 175.A O no hydrogen 2.946 N/A GLN 179.A NE2 TYR 98.A OH no hydrogen 3.387 N/A HIS 180.A N PHE 176.A O no hydrogen 2.940 N/A HIS 180.A ND1 TYR 98.A OH no hydrogen 2.461 N/A ILE 181.A N GLN 177.A O no hydrogen 2.940 N/A MET 182.A N PHE 178.A O no hydrogen 2.857 N/A VAL 183.A N GLN 179.A O no hydrogen 2.970 N/A GLY 184.A N HIS 180.A O no hydrogen 2.961 N/A LEU 185.A N ILE 181.A O no hydrogen 2.921 N/A ILE 186.A N MET 182.A O no hydrogen 2.904 N/A LEU 187.A N VAL 183.A O no hydrogen 3.048 N/A GLY 189.A N LEU 185.A O no hydrogen 3.112 N/A ILE 190.A N ILE 186.A O no hydrogen 2.953 N/A VAL 191.A N LEU 187.A O no hydrogen 2.985 N/A ILE 192.A N PRO 188.A O no hydrogen 2.882 N/A LEU 193.A N GLY 189.A O no hydrogen 2.937 N/A SER 194.A N ILE 190.A O no hydrogen 2.916 N/A SER 194.A OG ILE 190.A O no hydrogen 2.863 N/A SER 194.A OG VAL 191.A O no hydrogen 3.301 N/A CYS 195.A N ILE 192.A O no hydrogen 3.146 N/A CYS 195.A SG SER 108.A O no hydrogen 3.042 N/A CYS 195.A SG SER 108.A OG no hydrogen 3.028 N/A TYR 196.A N ILE 192.A O no hydrogen 2.957 N/A CYS 197.A SG LEU 193.A O no hydrogen 3.292 N/A ILE 199.A N CYS 195.A O no hydrogen 2.954 N/A ILE 200.A N TYR 196.A O no hydrogen 2.971 N/A SER 201.A N CYS 197.A O no hydrogen 2.890 N/A SER 201.A OG CYS 197.A O no hydrogen 2.935 N/A LYS 202.A N ILE 198.A O no hydrogen 2.952 N/A LEU 203.A N ILE 199.A O no hydrogen 2.944 N/A SER 204.A OG SER 201.A O no hydrogen 3.304 N/A HIS 205.A N LYS 202.A O no hydrogen 3.489 N/A HIS 205.A ND1 LYS 202.A O no hydrogen 3.067 N/A LYS 213.A N HIS 209.A O no hydrogen 3.463 N/A ALA 214.A N GLN 210.A O no hydrogen 2.921 N/A LEU 215.A N LYS 211.A O no hydrogen 2.887 N/A LYS 216.A N ARG 212.A O no hydrogen 2.947 N/A THR 217.A N LYS 213.A O no hydrogen 2.916 N/A THR 217.A OG1 LYS 213.A O no hydrogen 2.905 N/A THR 218.A N ALA 214.A O no hydrogen 2.895 N/A THR 218.A OG1 ALA 214.A O no hydrogen 3.116 N/A VAL 219.A N LEU 215.A O no hydrogen 3.478 N/A ILE 220.A N LYS 216.A O no hydrogen 3.025 N/A LEU 221.A N THR 217.A O no hydrogen 2.918 N/A ILE 222.A N THR 218.A O no hydrogen 2.895 N/A LEU 223.A N VAL 219.A O no hydrogen 2.907 N/A ALA 224.A N ILE 220.A O no hydrogen 2.950 N/A PHE 225.A N LEU 221.A O no hydrogen 2.933 N/A PHE 226.A N ILE 222.A O no hydrogen 2.941 N/A ALA 227.A N LEU 223.A O no hydrogen 2.900 N/A CYS 228.A N ALA 224.A O no hydrogen 2.935 N/A CYS 228.A SG ALA 224.A O no hydrogen 3.179 N/A TRP 229.A N PHE 225.A O no hydrogen 2.986 N/A TRP 229.A N PHE 226.A O no hydrogen 3.176 N/A LEU 230.A N PHE 226.A O no hydrogen 2.877 N/A TYR 233.A N TRP 229.A O no hydrogen 3.313 N/A ILE 234.A N LEU 230.A O no hydrogen 2.885 N/A GLY 235.A N PRO 231.A O no hydrogen 2.930 N/A ILE 236.A N TYR 232.A O no hydrogen 2.944 N/A SER 237.A N TYR 233.A O no hydrogen 2.859 N/A SER 237.A OG TYR 233.A O no hydrogen 2.501 N/A ILE 238.A N ILE 234.A O no hydrogen 2.961 N/A ASP 239.A N GLY 235.A O no hydrogen 2.914 N/A SER 240.A N ILE 236.A O no hydrogen 2.873 N/A SER 240.A OG GLN 177.A OE1 no hydrogen 2.407 N/A SER 240.A OG ILE 236.A O no hydrogen 3.379 N/A PHE 241.A N SER 237.A O no hydrogen 2.910 N/A ILE 242.A N ILE 238.A O no hydrogen 2.928 N/A LEU 243.A N ASP 239.A O no hydrogen 2.881 N/A LEU 244.A N SER 240.A O no hydrogen 2.917 N/A LEU 244.A N PHE 241.A O no hydrogen 3.127 N/A GLU 245.A N ILE 242.A O no hydrogen 3.371 N/A ILE 246.A N PHE 241.A O no hydrogen 3.508 N/A ASN 255.A N CYS 251.A O no hydrogen 3.089 N/A THR 256.A N GLU 252.A O no hydrogen 2.939 N/A THR 256.A OG1 GLU 252.A O no hydrogen 3.269 N/A VAL 257.A N PHE 253.A O no hydrogen 2.883 N/A HIS 258.A N GLU 254.A O no hydrogen 2.935 N/A HIS 258.A ND1 GLU 254.A O no hydrogen 2.561 N/A LYS 259.A N ASN 255.A O no hydrogen 2.963 N/A TRP 260.A N THR 256.A O no hydrogen 2.918 N/A TRP 260.A NE1 PRO 231.A O no hydrogen 3.267 N/A ILE 261.A N VAL 257.A O no hydrogen 2.863 N/A SER 262.A N HIS 258.A O no hydrogen 2.960 N/A SER 262.A OG HIS 258.A O no hydrogen 3.558 N/A SER 262.A OG LYS 259.A O no hydrogen 2.674 N/A ILE 263.A N LYS 259.A O no hydrogen 2.963 N/A THR 264.A N TRP 260.A O no hydrogen 2.896 N/A THR 264.A OG1 TRP 260.A O no hydrogen 2.694 N/A GLU 265.A N ILE 261.A O no hydrogen 2.840 N/A ALA 266.A N SER 262.A O no hydrogen 2.987 N/A LEU 267.A N ILE 263.A O no hydrogen 2.923 N/A ALA 268.A N THR 264.A O no hydrogen 2.847 N/A PHE 270.A N LEU 267.A O no hydrogen 3.349 N/A HIS 271.A N ALA 268.A O no hydrogen 3.484 N/A CYS 272.A N PHE 269.A O no hydrogen 3.349 N/A CYS 272.A SG PHE 269.A O no hydrogen 3.154 N/A CYS 273.A SG PHE 270.A O no hydrogen 3.131 N/A LEU 274.A N PHE 270.A O no hydrogen 2.919 N/A LEU 274.A N HIS 271.A O no hydrogen 3.269 N/A ASN 275.A N HIS 271.A O no hydrogen 2.910 N/A ASN 275.A ND2 HIS 271.A NE2 no hydrogen 2.996 N/A LEU 278.A N LEU 274.A O no hydrogen 3.423 N/A TYR 279.A N ASN 275.A O no hydrogen 3.080 N/A