Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s6o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N ASP 2.A O no hydrogen 3.085 N/A ARG 7.A NH1 TYR 5.A OH no hydrogen 2.936 N/A ILE 10.A N ASP 8.A OD1 no hydrogen 2.974 N/A GLY 11.A N ASP 8.A OD1 no hydrogen 2.875 N/A TYR 12.A OH PRO 193.A O no hydrogen 2.531 N/A GLY 13.A N ILE 10.A O no hydrogen 3.101 N/A GLN 18.A NE2 GLU 251.A O no hydrogen 2.798 N/A TRP 21.A NE1 LYS 254.A O no hydrogen 2.970 N/A ARG 24.A N TRP 21.A O no hydrogen 3.199 N/A ALA 25.A N PRO 22.A O no hydrogen 3.299 N/A ARG 26.A N ARG 286.A O no hydrogen 2.742 N/A ARG 26.A NE TYR 246.A O no hydrogen 3.059 N/A ARG 26.A NH2 TYR 246.A O no hydrogen 2.890 N/A ALA 28.A N LYS 254.A O no hydrogen 3.078 N/A VAL 29.A N TRP 288.A O no hydrogen 2.714 N/A GLN 30.A N MET 256.A O no hydrogen 2.890 N/A GLN 30.A NE2 PHE 31.A O no hydrogen 2.951 N/A GLN 30.A NE2 ALA 290.A O no hydrogen 2.855 N/A VAL 32.A N ILE 258.A O no hydrogen 2.704 N/A LEU 33.A N THR 97.A O no hydrogen 2.842 N/A ASN 34.A N MET 260.A O no hydrogen 2.859 N/A ASN 34.A ND2 TYR 213.A OH no hydrogen 3.046 N/A ASN 34.A ND2 MET 260.A O no hydrogen 3.022 N/A TYR 35.A N PHE 99.A O no hydrogen 2.851 N/A GLU 36.A N GLU 37.A OE1 no hydrogen 3.140 N/A GLU 37.A N GLU 37.A OE1 no hydrogen 2.672 N/A GLY 38.A N GLU 40.A OE1 no hydrogen 2.785 N/A GLY 39.A N GLU 36.A O no hydrogen 2.794 N/A GLU 40.A N GLU 40.A OE1 no hydrogen 2.828 N/A ASN 41.A N GLU 51.A OE1 no hydrogen 2.982 N/A ASN 41.A ND2 GLU 51.A OE1 no hydrogen 3.020 N/A CYS 42.A N ASP 47.A OD2 no hydrogen 2.871 N/A CYS 42.A SG GLU 71.A OE2 no hydrogen 3.644 N/A HIS 45.A N CYS 42.A O no hydrogen 2.863 N/A HIS 45.A ND1 GLU 40.A O no hydrogen 2.780 N/A GLY 46.A N VAL 43.A O no hydrogen 3.063 N/A ASP 47.A N CYS 42.A O no hydrogen 3.360 N/A SER 50.A N TYR 63.A O no hydrogen 2.927 N/A SER 50.A OG TYR 63.A O no hydrogen 3.474 N/A GLN 52.A N GLU 51.A OE2 no hydrogen 3.030 N/A GLN 52.A NE2 ALA 60.A O no hydrogen 3.004 N/A PHE 53.A N GLU 51.A OE2 no hydrogen 2.842 N/A ILE 57.A N SER 55.A OG no hydrogen 3.043 N/A ALA 60.A N ILE 57.A O no hydrogen 3.168 N/A TYR 63.A N SER 50.A OG no hydrogen 2.911 N/A ARG 66.A NE GLU 71.A OE1 no hydrogen 3.345 N/A ARG 66.A NE GLU 71.A OE2 no hydrogen 2.958 N/A ARG 66.A NH2 GLU 71.A OE1 no hydrogen 2.844 N/A GLU 71.A N HIS 67.A O no hydrogen 2.966 N/A SER 72.A N MET 68.A O no hydrogen 2.935 N/A SER 72.A OG MET 68.A O no hydrogen 3.505 N/A SER 72.A OG SER 69.A O no hydrogen 3.389 N/A ILE 73.A N SER 69.A O no hydrogen 2.928 N/A TYR 74.A N MET 70.A O no hydrogen 3.104 N/A TYR 74.A OH PHE 53.A O no hydrogen 2.601 N/A TYR 74.A OH LEU 54.A O no hydrogen 3.398 N/A GLU 75.A N GLU 71.A O no hydrogen 2.892 N/A TYR 76.A N SER 72.A O no hydrogen 2.869 N/A SER 78.A OG GLU 75.A O no hydrogen 3.132 N/A ARG 79.A N GLU 75.A O no hydrogen 2.852 N/A ALA 80.A N TYR 76.A O no hydrogen 2.969 N/A GLY 81.A N TYR 76.A O no hydrogen 2.980 N/A VAL 82.A N GLY 77.A O no hydrogen 2.985 N/A ARG 84.A N ALA 80.A O no hydrogen 3.286 N/A ARG 84.A NH1 TYR 76.A OH no hydrogen 2.985 N/A ARG 84.A NH1 GLY 266.A O no hydrogen 2.850 N/A ILE 85.A N GLY 81.A O no hydrogen 3.097 N/A LEU 86.A N VAL 82.A O no hydrogen 2.892 N/A ARG 87.A N TRP 83.A O no hydrogen 2.854 N/A GLU 88.A N ILE 85.A O no hydrogen 3.120 N/A PHE 89.A N ILE 85.A O no hydrogen 3.200 N/A ASP 90.A N LEU 86.A O no hydrogen 2.935 N/A LYS 91.A N ARG 87.A O no hydrogen 2.917 N/A ARG 92.A N GLU 88.A O no hydrogen 3.223 N/A ARG 92.A NE GLU 88.A OE2 no hydrogen 2.801 N/A ARG 92.A NH1 ASP 279.A OD1 no hydrogen 2.594 N/A ARG 92.A NH2 GLU 88.A OE2 no hydrogen 2.875 N/A ARG 92.A NH2 ASP 279.A OD1 no hydrogen 2.822 N/A GLY 93.A N ASP 90.A O no hydrogen 3.019 N/A LEU 94.A N PHE 89.A O no hydrogen 3.082 N/A LEU 96.A N HIS 120.A ND1 no hydrogen 3.232 N/A THR 97.A N PHE 31.A O no hydrogen 3.064 N/A THR 97.A OG1 GLU 121.A OE1 no hydrogen 2.670 N/A VAL 98.A N GLU 121.A O no hydrogen 2.771 N/A PHE 99.A N LEU 33.A O no hydrogen 2.905 N/A GLY 100.A N ALA 123.A O no hydrogen 2.878 N/A VAL 101.A N TYR 35.A O no hydrogen 2.859 N/A GLY 102.A N GLY 126.A O no hydrogen 2.804 N/A MET 103.A N TRP 127.A O no hydrogen 2.985 N/A ILE 105.A N VAL 101.A O no hydrogen 2.855 N/A GLU 106.A N GLY 102.A O no hydrogen 2.961 N/A ARG 107.A N MET 103.A O no hydrogen 3.094 N/A ARG 107.A N ALA 104.A O no hydrogen 3.035 N/A ARG 107.A NE GLY 38.A O no hydrogen 2.919 N/A HIS 108.A N ALA 104.A O no hydrogen 3.276 N/A HIS 108.A N ILE 105.A O no hydrogen 3.305 N/A LEU 111.A N HIS 108.A ND1 no hydrogen 3.424 N/A ALA 112.A N HIS 108.A O no hydrogen 3.035 N/A ARG 113.A N PRO 109.A O no hydrogen 3.013 N/A ARG 113.A NH1.B VAL 154.A O no hydrogen 2.702 N/A ALA 114.A N GLU 110.A O no hydrogen 2.976 N/A PHE 115.A N LEU 111.A O no hydrogen 3.003 N/A GLU 117.A N ARG 113.A O no hydrogen 2.859 N/A LEU 118.A N ALA 114.A O no hydrogen 2.935 N/A GLY 119.A N VAL 116.A O no hydrogen 2.971 N/A HIS 120.A N PHE 115.A O no hydrogen 3.053 N/A GLU 121.A N LEU 96.A O no hydrogen 3.308 N/A ALA 123.A N VAL 98.A O no hydrogen 2.749 N/A CYS 124.A N GLY 161.A O no hydrogen 2.978 N/A HIS 125.A N GLY 100.A O no hydrogen 2.853 N/A HIS 125.A ND1 TYR 163.A O no hydrogen 2.834 N/A HIS 125.A NE2 GLU 36.A OE2 no hydrogen 2.694 N/A ARG 128.A NE GLY 39.A O no hydrogen 3.162 N/A ARG 128.A NH1 ASP 47.A OD1 no hydrogen 2.971 N/A ARG 128.A NH2 GLY 39.A O no hydrogen 3.186 N/A ARG 128.A NH2 GLU 40.A O no hydrogen 2.906 N/A ARG 128.A NH2 ASP 47.A OD1 no hydrogen 3.472 N/A ARG 128.A NH2 ASP 47.A OD2 no hydrogen 2.668 N/A TRP 129.A N GLY 39.A O no hydrogen 3.008 N/A TYR 132.A N ARG 166.A O no hydrogen 2.859 N/A TYR 132.A OH HIS 143.A ND1 no hydrogen 2.681 N/A GLN 133.A N HIS 131.A ND1 no hydrogen 3.418 N/A MET 135.A N TYR 132.A O no hydrogen 3.016 N/A ARG 139.A N THR 136.A OG1 no hydrogen 3.341 N/A GLU 140.A N THR 136.A O no hydrogen 2.895 N/A ALA 141.A N PRO 137.A O no hydrogen 2.767 N/A GLU 142.A N GLU 138.A O no hydrogen 3.151 N/A HIS 143.A N ARG 139.A O no hydrogen 3.136 N/A HIS 143.A ND1 TYR 132.A OH no hydrogen 2.681 N/A MET 144.A N GLU 140.A O no hydrogen 3.077 N/A ARG 145.A N ALA 141.A O no hydrogen 3.222 N/A LEU 146.A N GLU 142.A O no hydrogen 3.011 N/A GLY 147.A N HIS 143.A O no hydrogen 2.794 N/A MET 148.A N MET 144.A O no hydrogen 2.993 N/A GLU 149.A N ARG 145.A O no hydrogen 3.082 N/A ALA 150.A N LEU 146.A O no hydrogen 2.984 N/A ILE 151.A N GLY 147.A O no hydrogen 3.230 N/A GLU 152.A N MET 148.A O no hydrogen 3.150 N/A ARG 153.A N GLU 149.A O no hydrogen 2.845 N/A ARG 153.A NE GLU 106.A OE1 no hydrogen 3.543 N/A ARG 153.A NH2 GLU 106.A OE1 no hydrogen 3.344 N/A ARG 153.A NH2 GLU 106.A OE2 no hydrogen 3.541 N/A VAL 154.A N ALA 150.A O no hydrogen 3.180 N/A THR 155.A N ILE 151.A O no hydrogen 2.912 N/A THR 155.A OG1 ILE 151.A O no hydrogen 2.812 N/A GLY 156.A N GLU 152.A O no hydrogen 2.728 N/A VAL 157.A N THR 155.A OG1 no hydrogen 3.077 N/A ARG 158.A NH1 GLU 152.A OE1 no hydrogen 3.352 N/A ARG 158.A NH2 TYR 178.A OH no hydrogen 3.319 N/A TRP 162.A N TYR 183.A O no hydrogen 3.080 N/A TRP 162.A NE1 THR 164.A OG1 no hydrogen 2.802 N/A TYR 163.A N CYS 124.A O no hydrogen 3.010 N/A TYR 163.A OH TYR 188.A OH no hydrogen 2.568 N/A THR 164.A N ASP 186.A OD2 no hydrogen 2.861 N/A GLY 165.A N ASP 186.A OD1 no hydrogen 2.901 N/A SER 168.A N THR 171.A OG1 no hydrogen 2.851 N/A SER 168.A OG GLU 140.A OE1 no hydrogen 2.478 N/A SER 168.A OG THR 171.A OG1 no hydrogen 3.276 N/A ASN 170.A N SER 168.A OG no hydrogen 2.947 N/A THR 171.A N SER 168.A O no hydrogen 3.240 N/A THR 171.A OG1 GLU 140.A OE2 no hydrogen 2.735 N/A THR 171.A OG1 SER 168.A O no hydrogen 3.250 N/A THR 171.A OG1 SER 168.A OG no hydrogen 3.276 N/A HIS 172.A ND1 ASP 184.A OD1 no hydrogen 3.217 N/A ARG 173.A NH1 GLU 177.A OE2 no hydrogen 3.150 N/A LEU 174.A N ASN 170.A O no hydrogen 2.872 N/A VAL 175.A N THR 171.A O no hydrogen 2.942 N/A ALA 176.A N HIS 172.A O no hydrogen 2.966 N/A GLU 177.A N ARG 173.A O no hydrogen 2.912 N/A TYR 178.A N LEU 174.A O no hydrogen 2.965 N/A GLY 179.A N VAL 175.A O no hydrogen 2.953 N/A LEU 182.A N LEU 160.A O no hydrogen 2.734 N/A TYR 183.A N LEU 160.A O no hydrogen 3.385 N/A TYR 183.A OH GLU 121.A OE2 no hydrogen 2.670 N/A ASP 184.A N LEU 209.A O no hydrogen 2.902 N/A SER 185.A N TRP 162.A O no hydrogen 2.858 N/A SER 185.A OG VAL 211.A O no hydrogen 2.711 N/A ASP 186.A N ASP 184.A OD2 no hydrogen 2.778 N/A HIS 187.A N SER 185.A O no hydrogen 2.813 N/A TYR 188.A OH TYR 163.A OH no hydrogen 2.568 N/A GLY 189.A N HIS 187.A ND1 no hydrogen 3.039 N/A ASP 191.A N ASP 190.A OD1 no hydrogen 3.002 N/A PHE 194.A N ILE 210.A O no hydrogen 3.072 N/A TRP 195.A NE1 HIS 303.A O no hydrogen 2.883 N/A MET 196.A N GLN 208.A O no hydrogen 2.939 N/A VAL 198.A N VAL 206.A O no hydrogen 2.858 N/A VAL 200.A N ALA 204.A O no hydrogen 2.714 N/A SER 201.A N GLU 177.A OE2 no hydrogen 3.066 N/A SER 201.A OG GLU 177.A OE2 no hydrogen 2.701 N/A GLY 203.A N VAL 200.A O no hydrogen 2.681 N/A VAL 206.A N VAL 198.A O no hydrogen 2.841 N/A GLN 208.A N MET 196.A O no hydrogen 2.765 N/A GLN 208.A NE2 PHE 181.A O no hydrogen 3.162 N/A GLN 208.A NE2 LEU 209.A O no hydrogen 3.347 N/A ILE 210.A N PHE 194.A O no hydrogen 2.757 N/A VAL 211.A N ASP 184.A O no hydrogen 3.054 N/A TYR 213.A N HIS 187.A O no hydrogen 2.900 N/A THR 214.A OG1 ASP 216.A OD1 no hydrogen 2.916 N/A ASP 216.A N THR 214.A OG1 no hydrogen 3.234 N/A ALA 217.A N THR 214.A OG1 no hydrogen 2.912 N/A ASN 218.A ND2 THR 214.A O no hydrogen 2.835 N/A ASP 219.A N GLY 259.A O no hydrogen 3.042 N/A MET 220.A N ASN 218.A OD1 no hydrogen 2.871 N/A ARG 221.A N ASN 218.A O no hydrogen 3.205 N/A ARG 221.A NE GLN 226.A O no hydrogen 3.331 N/A ARG 221.A NH2 LEU 215.A O no hydrogen 2.972 N/A PHE 222.A N ASP 219.A O no hydrogen 2.905 N/A ALA 223.A N MET 220.A O no hydrogen 2.766 N/A THR 224.A OG1 ARG 221.A O no hydrogen 3.406 N/A THR 224.A OG1 GLN 226.A O no hydrogen 2.772 N/A THR 230.A OG1 HIS 233.A ND1 no hydrogen 2.509 N/A HIS 233.A N THR 230.A O no hydrogen 3.162 N/A HIS 233.A N THR 230.A OG1 no hydrogen 3.380 N/A HIS 233.A ND1 THR 230.A OG1 no hydrogen 2.509 N/A PHE 234.A N THR 230.A O no hydrogen 3.503 N/A PHE 235.A N ALA 231.A O no hydrogen 2.823 N/A HIS 236.A N ASP 232.A O no hydrogen 2.876 N/A TYR 237.A N HIS 233.A O no hydrogen 3.108 N/A TYR 237.A OH ASP 216.A OD2 no hydrogen 2.557 N/A LEU 238.A N PHE 234.A O no hydrogen 2.992 N/A ARG 239.A N PHE 235.A O no hydrogen 2.828 N/A ARG 239.A NE ASP 240.A OD1 no hydrogen 3.238 N/A ARG 239.A NH2 ASP 240.A OD1 no hydrogen 2.933 N/A ASP 240.A N HIS 236.A O no hydrogen 2.879 N/A ALA 241.A N TYR 237.A O no hydrogen 2.869 N/A PHE 242.A N LEU 238.A O no hydrogen 2.881 N/A ASP 243.A N ARG 239.A O no hydrogen 2.836 N/A VAL 244.A N ASP 240.A O no hydrogen 2.934 N/A LEU 245.A N ALA 241.A O no hydrogen 2.954 N/A TYR 246.A N PHE 242.A O no hydrogen 2.697 N/A TYR 246.A OH ASP 285.A O no hydrogen 2.573 N/A GLU 247.A N ASP 243.A O no hydrogen 3.082 N/A GLU 248.A N VAL 244.A O no hydrogen 3.217 N/A GLY 249.A N LEU 245.A O no hydrogen 3.039 N/A GLY 249.A N TYR 246.A O no hydrogen 3.184 N/A GLU 251.A N GLU 248.A O no hydrogen 2.877 N/A ALA 252.A N GLU 248.A O no hydrogen 2.807 N/A LYS 254.A NZ GLU 248.A OE1 no hydrogen 3.251 N/A LYS 254.A NZ ALA 252.A O no hydrogen 3.051 N/A MET 255.A N ASP 191.A O no hydrogen 2.859 N/A MET 256.A N ALA 28.A O no hydrogen 2.821 N/A SER 257.A OG PRO 212.A O no hydrogen 3.413 N/A ILE 258.A N GLN 30.A O no hydrogen 3.001 N/A GLY 259.A N ALA 217.A O no hydrogen 3.043 N/A MET 260.A N VAL 32.A O no hydrogen 2.904 N/A HIS 261.A N ASP 219.A OD2 no hydrogen 2.706 N/A HIS 261.A ND1 ASP 219.A OD1 no hydrogen 2.649 N/A CYS 262.A SG ASN 34.A O no hydrogen 3.698 N/A ARG 263.A N GLU 37.A OE2 no hydrogen 2.988 N/A ARG 263.A NE LEU 54.A O no hydrogen 2.879 N/A ARG 263.A NH1 GLU 36.A OE1 no hydrogen 3.134 N/A ARG 263.A NH1 GLU 37.A OE2 no hydrogen 2.741 N/A ARG 263.A NH2 GLU 36.A OE1 no hydrogen 2.841 N/A LEU 264.A N HIS 261.A O no hydrogen 3.101 N/A LEU 265.A N ASP 219.A OD2 no hydrogen 3.033 N/A LEU 265.A N HIS 261.A O no hydrogen 2.897 N/A ARG 267.A N LEU 264.A O no hydrogen 3.079 N/A ARG 270.A N ARG 267.A O no hydrogen 2.987 N/A ARG 270.A NH1 GLU 56.A OE2 no hydrogen 2.913 N/A ARG 270.A NH1 LEU 264.A O no hydrogen 3.174 N/A ARG 270.A NH2 GLU 56.A OE1 no hydrogen 2.667 N/A ARG 270.A NH2 GLU 56.A OE2 no hydrogen 3.222 N/A PHE 271.A N ARG 267.A O no hydrogen 2.919 N/A ARG 272.A NH1 GLN 275.A OE1 no hydrogen 2.599 N/A ALA 273.A N ARG 270.A O no hydrogen 3.018 N/A LEU 274.A N PHE 271.A O no hydrogen 3.009 N/A GLN 275.A N PHE 271.A O no hydrogen 3.454 N/A GLN 275.A NE2 GLU 88.A OE1 no hydrogen 2.995 N/A ARG 276.A N ARG 272.A O no hydrogen 2.894 N/A PHE 277.A N ALA 273.A O no hydrogen 2.963 N/A LEU 278.A N LEU 274.A O no hydrogen 2.893 N/A ASP 279.A N GLN 275.A O no hydrogen 2.975 N/A HIS 280.A N ARG 276.A O no hydrogen 2.968 N/A HIS 280.A NE2 ASP 243.A OD1 no hydrogen 2.785 N/A ILE 281.A N PHE 277.A O no hydrogen 2.968 N/A GLU 282.A N LEU 278.A O no hydrogen 2.987 N/A ARG 283.A N HIS 280.A O no hydrogen 3.283 N/A HIS 284.A N ILE 281.A O no hydrogen 3.032 N/A HIS 284.A ND1 HIS 280.A O no hydrogen 2.890 N/A ARG 286.A NE ARG 24.A O no hydrogen 2.816 N/A ARG 286.A NH2 ARG 24.A O no hydrogen 3.080 N/A TRP 288.A N VAL 27.A O no hydrogen 3.181 N/A ALA 290.A N VAL 29.A O no hydrogen 2.908 N/A ARG 291.A N GLU 294.A OE1 no hydrogen 2.879 N/A ARG 291.A NE GLY 119.A O no hydrogen 2.827 N/A ARG 291.A NH1 GLU 294.A OE2 no hydrogen 2.645 N/A ARG 291.A NH2 GLY 119.A O no hydrogen 3.069 N/A ARG 292.A N THR 97.A OG1 no hydrogen 2.767 N/A ARG 292.A NE GLN 30.A OE1 no hydrogen 2.818 N/A ARG 292.A NH1 SER 185.A OG no hydrogen 3.100 N/A ARG 292.A NH1 PRO 212.A O no hydrogen 3.211 N/A ARG 292.A NH2 GLN 30.A OE1 no hydrogen 2.974 N/A ARG 292.A NH2 SER 257.A OG no hydrogen 2.516 N/A VAL 293.A N GLU 121.A OE1 no hydrogen 2.792 N/A ILE 295.A N ARG 291.A O no hydrogen 3.257 N/A ALA 296.A N ARG 292.A O no hydrogen 3.051 N/A ARG 297.A N VAL 293.A O no hydrogen 2.839 N/A HIS 298.A N GLU 294.A O no hydrogen 2.859 N/A HIS 298.A NE2 ALA 19.A O no hydrogen 2.870 N/A TRP 299.A N ILE 295.A O no hydrogen 2.963 N/A ARG 300.A N ALA 296.A O no hydrogen 2.886 N/A ARG 300.A NH2 LEU 182.A O no hydrogen 2.860 N/A GLU 301.A N ARG 297.A O no hydrogen 3.042 N/A HIS 302.A N HIS 298.A O no hydrogen 2.909 N/A HIS 302.A ND1 HIS 298.A O no hydrogen 3.280 N/A HIS 303.A N TRP 299.A O no hydrogen 2.642 N/A HIS 303.A NE2 GLN 18.A O no hydrogen 2.635 N/A TYR 305.A OH ASP 197.A OD1 no hydrogen 2.659 N/A