Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1u6d_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N THR 288.A O no hydrogen 2.921 N/A ILE 7.A N TYR 24.A O no hydrogen 2.963 N/A TYR 8.A N ALA 286.A O no hydrogen 2.861 N/A THR 9.A N GLU 22.A O no hydrogen 2.869 N/A ALA 10.A N GLY 284.A O no hydrogen 2.816 N/A GLY 11.A N TYR 20.A O no hydrogen 2.820 N/A GLY 12.A N ARG 41.A O no hydrogen 2.864 N/A TYR 13.A N SER 281.A O no hydrogen 2.718 N/A PHE 14.A N GLN 16.A O no hydrogen 3.101 N/A SER 17.A N ASN 61.A O no hydrogen 2.913 N/A SER 17.A OG SER 42.A OG no hydrogen 2.679 N/A SER 17.A OG ARG 59.A O no hydrogen 3.429 N/A SER 17.A OG ASN 61.A O no hydrogen 3.414 N/A LEU 18.A N GLY 12.A O no hydrogen 2.823 N/A GLU 22.A N THR 9.A O no hydrogen 3.121 N/A ALA 23.A N LEU 32.A O no hydrogen 2.886 N/A TYR 24.A N ILE 7.A O no hydrogen 2.801 N/A ASN 25.A N THR 30.A O no hydrogen 2.986 N/A SER 27.A N ASN 25.A OD1 no hydrogen 2.954 N/A SER 27.A OG ASN 25.A OD1 no hydrogen 3.382 N/A GLY 29.A N ASN 25.A O no hydrogen 2.872 N/A THR 30.A N ASP 28.A OD1 no hydrogen 3.086 N/A THR 30.A OG1 ASP 28.A OD1 no hydrogen 2.531 N/A THR 30.A OG1 ASP 28.A OD2 no hydrogen 3.373 N/A LEU 32.A N ALA 23.A O no hydrogen 2.838 N/A ARG 33.A NH2 ASP 36.A OD1 no hydrogen 3.026 N/A LEU 34.A N LEU 21.A O no hydrogen 2.820 N/A ALA 35.A N ASN 80.A OD1 no hydrogen 3.037 N/A LEU 37.A N SER 19.A O no hydrogen 2.877 N/A ARG 41.A N LEU 18.A O no hydrogen 2.947 N/A ARG 41.A NH1 ALA 55.A O no hydrogen 3.141 N/A ARG 41.A NH1 GLY 57.A O no hydrogen 2.978 N/A ARG 41.A NH2 ALA 55.A O no hydrogen 3.303 N/A SER 42.A N ARG 59.A O no hydrogen 2.876 N/A SER 42.A OG SER 17.A OG no hydrogen 2.679 N/A SER 42.A OG ARG 59.A O no hydrogen 3.544 N/A GLY 43.A N GLY 282.A O no hydrogen 2.949 N/A ALA 45.A N VAL 56.A O no hydrogen 3.113 N/A CYS 47.A N TYR 54.A O no hydrogen 3.169 N/A VAL 49.A N LEU 52.A O no hydrogen 2.996 N/A LEU 52.A N VAL 49.A O no hydrogen 3.090 N/A LEU 53.A N TYR 75.A O no hydrogen 2.993 N/A TYR 54.A N CYS 47.A O no hydrogen 2.820 N/A ALA 55.A N ASP 73.A O no hydrogen 2.863 N/A VAL 56.A N ALA 45.A O no hydrogen 2.941 N/A GLY 57.A N ALA 71.A O no hydrogen 2.968 N/A GLY 58.A N ARG 92.A O no hydrogen 2.958 N/A ARG 59.A NE ASP 68.A OD1 no hydrogen 2.940 N/A ARG 59.A NH2 ASP 68.A OD1 no hydrogen 3.113 N/A ASN 60.A N THR 67.A O no hydrogen 2.883 N/A ASN 61.A N SER 17.A OG no hydrogen 2.895 N/A SER 62.A N GLY 65.A O no hydrogen 3.093 N/A ASP 64.A N SER 62.A OG no hydrogen 3.033 N/A GLY 65.A N SER 62.A O no hydrogen 2.866 N/A THR 67.A N ASN 60.A O no hydrogen 2.996 N/A SER 69.A N GLY 58.A O no hydrogen 2.832 N/A ALA 71.A N SER 69.A OG no hydrogen 3.110 N/A ASP 73.A N ALA 55.A O no hydrogen 3.088 N/A CYS 74.A N SER 83.A O no hydrogen 2.895 N/A CYS 74.A SG.B SER 83.A O no hydrogen 3.841 N/A TYR 75.A N LEU 53.A O no hydrogen 2.718 N/A TYR 75.A OH ASN 80.A OD1 no hydrogen 2.635 N/A ASN 76.A N GLN 81.A O no hydrogen 3.109 N/A MET 78.A N ASN 76.A OD1 no hydrogen 3.102 N/A THR 79.A N ASN 76.A O no hydrogen 3.086 N/A THR 79.A OG1 ASN 76.A O no hydrogen 3.427 N/A ASN 80.A N ASN 76.A O no hydrogen 2.888 N/A TRP 82.A NE1 ALA 35.A O no hydrogen 3.030 N/A SER 83.A N CYS 74.A O no hydrogen 2.751 N/A CYS 85.A N LEU 72.A O no hydrogen 2.919 N/A CYS 85.A SG SER 83.A O no hydrogen 4.042 N/A CYS 85.A SG TYR 122.A OH no hydrogen 3.706 N/A ALA 86.A N ASP 127.A OD1 no hydrogen 2.993 N/A MET 88.A N SER 70.A O no hydrogen 2.849 N/A SER 89.A N GLU 120.A OE1 no hydrogen 2.886 N/A SER 89.A OG GLU 120.A OE1 no hydrogen 3.369 N/A SER 89.A OG GLU 120.A OE2 no hydrogen 2.798 N/A ARG 92.A N SER 69.A O no hydrogen 3.044 N/A ARG 92.A NE GLU 120.A OE2 no hydrogen 3.250 N/A ARG 92.A NH1 GLY 108.A O no hydrogen 2.874 N/A ARG 92.A NH1 SER 118.A O no hydrogen 3.047 N/A ARG 92.A NH1 SER 118.A OG no hydrogen 3.319 N/A ARG 92.A NH2 SER 118.A OG no hydrogen 2.885 N/A ARG 92.A NH2 GLU 120.A OE2 no hydrogen 2.857 N/A ASN 93.A N SER 110.A O no hydrogen 2.844 N/A ARG 94.A N GLY 43.A O no hydrogen 2.918 N/A GLY 96.A N VAL 107.A O no hydrogen 3.052 N/A GLY 98.A N TYR 105.A O no hydrogen 3.216 N/A ILE 100.A N HIS 103.A O no hydrogen 3.125 N/A HIS 103.A N ILE 100.A O no hydrogen 3.030 N/A HIS 103.A ND1.A ASP 101.A O no hydrogen 3.033 N/A ILE 104.A N TYR 122.A O no hydrogen 3.034 N/A TYR 105.A N GLY 98.A O no hydrogen 2.777 N/A ALA 106.A N GLU 120.A O no hydrogen 2.777 N/A VAL 107.A N GLY 96.A O no hydrogen 2.870 N/A GLY 108.A N SER 118.A O no hydrogen 3.254 N/A GLY 109.A N ARG 139.A O no hydrogen 2.961 N/A SER 110.A N ASN 93.A O no hydrogen 2.903 N/A HIS 111.A N ILE 114.A O no hydrogen 3.040 N/A GLY 112.A N ASP 68.A OD2 no hydrogen 2.833 N/A ILE 114.A N HIS 111.A O no hydrogen 2.903 N/A HIS 116.A N GLY 109.A O no hydrogen 2.973 N/A HIS 116.A NE2 PRO 91.A O no hydrogen 2.766 N/A GLU 120.A N ALA 106.A O no hydrogen 3.024 N/A ARG 121.A N HIS 130.A O no hydrogen 2.866 N/A TYR 122.A N ILE 104.A O no hydrogen 2.792 N/A TYR 122.A OH ASP 127.A OD1 no hydrogen 2.524 N/A GLU 123.A N GLU 128.A O no hydrogen 2.960 N/A ARG 126.A N GLU 123.A O no hydrogen 3.148 N/A ASP 127.A N PRO 124.A O no hydrogen 3.263 N/A TRP 129.A NE1 ALA 86.A O no hydrogen 2.930 N/A HIS 130.A N ARG 121.A O no hydrogen 2.919 N/A VAL 132.A N VAL 119.A O no hydrogen 3.041 N/A ALA 133.A N ASN 174.A OD1 no hydrogen 3.035 N/A MET 135.A N ASN 117.A O no hydrogen 2.830 N/A LEU 136.A N GLU 167.A OE1 no hydrogen 2.887 N/A THR 137.A N GLU 167.A OE2 no hydrogen 3.256 N/A THR 137.A OG1 GLU 167.A OE2 no hydrogen 3.357 N/A ARG 138.A NH1 HIS 115.A O no hydrogen 2.910 N/A ARG 139.A N HIS 116.A O no hydrogen 3.158 N/A ARG 139.A NE GLU 167.A OE2 no hydrogen 2.970 N/A ARG 139.A NH1 GLY 155.A O no hydrogen 2.912 N/A ARG 139.A NH1 SER 165.A O no hydrogen 3.156 N/A ARG 139.A NH1 SER 165.A OG no hydrogen 3.207 N/A ARG 139.A NH2 SER 165.A OG no hydrogen 3.057 N/A ARG 139.A NH2 GLU 167.A OE2 no hydrogen 2.962 N/A ILE 140.A N PHE 157.A O no hydrogen 2.956 N/A GLY 141.A N ARG 94.A O no hydrogen 2.994 N/A GLY 143.A N VAL 154.A O no hydrogen 3.119 N/A ALA 145.A N TYR 152.A O no hydrogen 3.155 N/A LEU 147.A N LEU 150.A O no hydrogen 2.928 N/A ARG 149.A NE ASP 101.A OD1 no hydrogen 2.913 N/A ARG 149.A NH1 GLU 172.A OE2 no hydrogen 2.925 N/A ARG 149.A NH2 ASP 101.A OD2 no hydrogen 2.845 N/A ARG 149.A NH2 GLU 172.A OE2 no hydrogen 2.899 N/A LEU 150.A N LEU 147.A O no hydrogen 3.137 N/A LEU 151.A N TYR 169.A O no hydrogen 3.219 N/A TYR 152.A N ALA 145.A O no hydrogen 2.835 N/A ALA 153.A N GLU 167.A O no hydrogen 2.905 N/A VAL 154.A N GLY 143.A O no hydrogen 2.796 N/A GLY 155.A N SER 165.A O no hydrogen 2.938 N/A GLY 156.A N ARG 186.A O no hydrogen 2.886 N/A PHE 157.A N ILE 140.A O no hydrogen 2.845 N/A ASP 158.A N ASN 161.A O no hydrogen 2.950 N/A THR 160.A N ASP 158.A OD1 no hydrogen 2.899 N/A ASN 161.A N ASP 158.A OD1 no hydrogen 2.746 N/A ASN 161.A ND2 ASP 158.A OD2 no hydrogen 2.874 N/A ARG 162.A NH1 SER 187.A OG no hydrogen 2.885 N/A LEU 163.A N GLY 156.A O no hydrogen 2.875 N/A ASN 164.A ND2 MET 182.A O no hydrogen 3.180 N/A GLU 167.A N ALA 153.A O no hydrogen 2.929 N/A CYS 168.A N ARG 177.A O no hydrogen 2.791 N/A CYS 168.A SG LEU 151.A O no hydrogen 3.960 N/A TYR 169.A N LEU 151.A O no hydrogen 2.706 N/A TYR 169.A OH ASN 174.A OD1 no hydrogen 2.688 N/A TYR 170.A N GLU 175.A O no hydrogen 2.914 N/A ASN 174.A N TYR 170.A O no hydrogen 2.814 N/A GLU 175.A N TYR 170.A O no hydrogen 3.373 N/A TRP 176.A NE1 ALA 133.A O no hydrogen 2.961 N/A ARG 177.A N CYS 168.A O no hydrogen 2.942 N/A ILE 179.A N ALA 166.A O no hydrogen 2.937 N/A THR 180.A OG1 GLU 221.A O no hydrogen 2.989 N/A MET 182.A N ASN 164.A O no hydrogen 2.821 N/A ASN 183.A N GLU 214.A OE1 no hydrogen 2.803 N/A ASN 183.A ND2 GLU 214.A OE1 no hydrogen 2.858 N/A ASN 183.A ND2 TRP 223.A O no hydrogen 3.106 N/A THR 184.A N GLU 214.A OE2 no hydrogen 3.186 N/A THR 184.A OG1 GLU 214.A OE2 no hydrogen 3.560 N/A ARG 186.A N LEU 163.A O no hydrogen 3.127 N/A ARG 186.A NE GLU 214.A OE2 no hydrogen 3.066 N/A ARG 186.A NH1 GLY 202.A O no hydrogen 2.873 N/A ARG 186.A NH1 SER 212.A O no hydrogen 3.037 N/A ARG 186.A NH1 SER 212.A OG no hydrogen 3.307 N/A ARG 186.A NH2 SER 212.A OG no hydrogen 2.936 N/A ARG 186.A NH2 GLU 214.A OE2 no hydrogen 2.940 N/A SER 187.A N TYR 204.A O no hydrogen 2.947 N/A SER 187.A OG TYR 204.A O no hydrogen 3.434 N/A GLY 188.A N GLY 141.A O no hydrogen 2.869 N/A GLY 190.A N ALA 201.A O no hydrogen 2.906 N/A CYS 192.A N TYR 199.A O no hydrogen 3.212 N/A LEU 194.A N CYS 197.A O no hydrogen 3.033 N/A ASN 196.A ND2 ASP 217.A OD1 no hydrogen 3.356 N/A CYS 197.A N LEU 194.A O no hydrogen 3.192 N/A ILE 198.A N TYR 216.A O no hydrogen 2.946 N/A TYR 199.A N CYS 192.A O no hydrogen 2.815 N/A ALA 200.A N GLU 214.A O no hydrogen 2.848 N/A ALA 201.A N GLY 190.A O no hydrogen 2.838 N/A GLY 202.A N SER 212.A O no hydrogen 2.928 N/A GLY 203.A N ARG 233.A O no hydrogen 2.823 N/A TYR 204.A N SER 187.A O no hydrogen 2.825 N/A ASP 205.A N ASP 208.A O no hydrogen 3.197 N/A GLN 207.A N ASP 205.A OD1 no hydrogen 2.955 N/A ASP 208.A N ASP 205.A OD1 no hydrogen 2.969 N/A LEU 210.A N GLY 203.A O no hydrogen 2.813 N/A ASN 211.A ND2 MET 229.A O no hydrogen 3.193 N/A GLU 214.A N ALA 200.A O no hydrogen 3.022 N/A ARG 215.A N THR 224.A O no hydrogen 2.858 N/A ARG 215.A NH1 TYR 199.A OH no hydrogen 2.892 N/A TYR 216.A N ILE 198.A O no hydrogen 2.832 N/A ASP 217.A N THR 222.A O no hydrogen 3.121 N/A VAL 218.A N ASN 196.A O no hydrogen 3.125 N/A GLU 219.A N ASP 217.A OD1 no hydrogen 2.899 N/A THR 220.A N ASP 217.A OD1 no hydrogen 3.265 N/A THR 220.A OG1 THR 222.A OG1 no hydrogen 3.331 N/A GLU 221.A N ASP 217.A O no hydrogen 2.776 N/A THR 222.A OG1 THR 220.A OG1 no hydrogen 3.331 N/A TRP 223.A NE1 THR 180.A O no hydrogen 2.829 N/A THR 224.A N ARG 215.A O no hydrogen 2.981 N/A VAL 226.A N VAL 213.A O no hydrogen 2.959 N/A ALA 227.A N ASP 268.A OD1 no hydrogen 3.023 N/A MET 229.A N ASN 211.A O no hydrogen 2.881 N/A LYS 230.A N GLU 261.A OE1 no hydrogen 2.852 N/A HIS 231.A N GLU 261.A OE2 no hydrogen 3.131 N/A ARG 232.A NH1 GLN 209.A O no hydrogen 2.851 N/A ARG 233.A N LEU 210.A O no hydrogen 3.023 N/A ARG 233.A NH1 GLY 249.A O no hydrogen 2.815 N/A ARG 233.A NH1 SER 259.A O no hydrogen 3.019 N/A ARG 233.A NH2 SER 259.A OG no hydrogen 2.958 N/A ARG 233.A NH2 GLU 261.A OE2 no hydrogen 2.667 N/A SER 234.A N TYR 251.A O no hydrogen 2.988 N/A ALA 235.A N GLY 188.A O no hydrogen 2.814 N/A GLY 237.A N LEU 248.A O no hydrogen 2.951 N/A THR 239.A N TYR 246.A O no hydrogen 3.011 N/A HIS 241.A N ARG 244.A O no hydrogen 2.982 N/A HIS 241.A NE2 ARG 5.A O no hydrogen 2.931 N/A ARG 244.A N HIS 241.A O no hydrogen 3.093 N/A ILE 245.A N TYR 263.A O no hydrogen 3.182 N/A TYR 246.A N THR 239.A O no hydrogen 2.866 N/A VAL 247.A N GLU 261.A O no hydrogen 2.960 N/A LEU 248.A N GLY 237.A O no hydrogen 2.823 N/A GLY 249.A N SER 259.A O no hydrogen 3.159 N/A GLY 250.A N ARG 280.A O no hydrogen 2.892 N/A TYR 251.A N SER 234.A O no hydrogen 2.879 N/A ASP 252.A N THR 255.A O no hydrogen 3.143 N/A HIS 254.A N ASP 252.A OD1 no hydrogen 2.875 N/A THR 255.A N ASP 252.A OD1 no hydrogen 2.701 N/A LEU 257.A N GLY 250.A O no hydrogen 2.803 N/A VAL 260.A N THR 274.A O no hydrogen 3.073 N/A GLU 261.A N VAL 247.A O no hydrogen 3.141 N/A CYS 262.A N SER 271.A O no hydrogen 2.774 N/A CYS 262.A SG ILE 245.A O no hydrogen 3.796 N/A TYR 263.A N ILE 245.A O no hydrogen 2.833 N/A TYR 263.A OH ASP 268.A OD1 no hydrogen 2.629 N/A ASP 264.A N THR 269.A O no hydrogen 3.085 N/A ASP 266.A N ASP 264.A OD1 no hydrogen 3.108 N/A THR 267.A OG1 THR 269.A OG1 no hydrogen 2.826 N/A THR 269.A N ASP 264.A O no hydrogen 3.445 N/A THR 269.A OG1 THR 267.A OG1 no hydrogen 2.826 N/A TRP 270.A NE1 ALA 227.A O no hydrogen 2.866 N/A SER 271.A N CYS 262.A O no hydrogen 2.958 N/A VAL 273.A N VAL 260.A O no hydrogen 3.057 N/A THR 274.A OG1 ARG 275.A O no hydrogen 3.481 N/A MET 276.A N ASP 258.A O no hydrogen 2.786 N/A THR 277.A OG1 GLU 22.A OE1 no hydrogen 3.256 N/A THR 277.A OG1 GLU 22.A OE2 no hydrogen 2.605 N/A ARG 280.A N LEU 257.A O no hydrogen 3.119 N/A ARG 280.A NE SER 278.A O no hydrogen 3.089 N/A ARG 280.A NH1 GLU 22.A OE1 no hydrogen 2.789 N/A ARG 280.A NH2 GLU 22.A OE1 no hydrogen 2.986 N/A ARG 280.A NH2 THR 277.A OG1 no hydrogen 3.238 N/A ARG 280.A NH2 SER 278.A O no hydrogen 3.221 N/A ARG 280.A NH2 SER 278.A OG no hydrogen 2.981 N/A SER 281.A N TYR 13.A O no hydrogen 3.067 N/A GLY 282.A N ALA 235.A O no hydrogen 2.878 N/A GLY 284.A N ALA 10.A O no hydrogen 2.997 N/A ALA 286.A N TYR 8.A O no hydrogen 3.162 N/A THR 288.A N LEU 6.A O no hydrogen 3.210 N/A