Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6dd4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLN 3.A OE1 no hydrogen 2.440 N/A ALA 5.A N GLU 8.A OE2 no hydrogen 2.747 N/A GLY 7.A N VAL 20.A O no hydrogen 2.670 N/A GLU 8.A N ALA 5.A O no hydrogen 3.022 N/A ILE 10.A N TRP 18.A O no hydrogen 2.931 N/A ASP 12.A N ALA 16.A O no hydrogen 2.889 N/A MET 13.A N SER 92.A O no hydrogen 2.946 N/A ALA 14.A N ASP 12.A OD1 no hydrogen 2.971 N/A ALA 15.A N ASP 12.A O no hydrogen 3.015 N/A ALA 16.A N ASP 12.A OD1 no hydrogen 2.955 N/A TRP 18.A N ILE 10.A O no hydrogen 2.909 N/A TRP 18.A NE1 ASP 12.A OD2 no hydrogen 2.936 N/A LYS 19.A N ASP 31.A O no hydrogen 2.705 N/A LYS 19.A NZ SER 34.A O no hydrogen 2.536 N/A LYS 19.A NZ GLU 36.A O no hydrogen 2.883 N/A VAL 20.A N GLU 8.A O no hydrogen 2.963 N/A GLY 21.A N LEU 29.A O no hydrogen 2.875 N/A ILE 24.A N ILE 27.A O no hydrogen 3.127 N/A TYR 28.A N VAL 46.A O no hydrogen 2.830 N/A TYR 28.A OH GLN 3.A OE1 no hydrogen 3.073 N/A LEU 29.A N LEU 22.A O no hydrogen 2.761 N/A ALA 30.A N CYS 44.A O no hydrogen 2.968 N/A ASP 31.A N LYS 19.A O no hydrogen 3.183 N/A MET 32.A N ASP 31.A OD1 no hydrogen 2.680 N/A ASN 33.A N ALA 17.A O no hydrogen 3.262 N/A GLU 36.A N SER 34.A OG no hydrogen 2.915 N/A ALA 42.A N GLY 39.A O no hydrogen 3.177 N/A CYS 44.A N ALA 30.A O no hydrogen 3.197 N/A VAL 45.A N MET 107.A O no hydrogen 2.862 N/A VAL 46.A N TYR 28.A O no hydrogen 2.734 N/A LYS 47.A N MET 105.A O no hydrogen 2.999 N/A LYS 47.A NZ GLU 59.A OE1 no hydrogen 2.542 N/A LYS 47.A NZ GLU 59.A OE2 no hydrogen 3.389 N/A VAL 48.A N CYS 26.A O no hydrogen 3.021 N/A GLU 49.A N ARG 103.A O no hydrogen 3.000 N/A SER 51.A N SER 101.A O no hydrogen 2.926 N/A SER 51.A OG SER 101.A O no hydrogen 3.515 N/A ASN 53.A N PRO 50.A O no hydrogen 3.000 N/A LEU 56.A N ASN 53.A OD1 no hydrogen 2.956 N/A PHE 57.A N ASN 53.A O no hydrogen 3.451 N/A THR 58.A N GLY 54.A O no hydrogen 3.004 N/A THR 58.A OG1 GLY 54.A O no hydrogen 3.273 N/A GLU 59.A N PRO 55.A O no hydrogen 2.881 N/A LEU 60.A N LEU 56.A O no hydrogen 2.792 N/A LYS 61.A N PHE 57.A O no hydrogen 2.916 N/A LYS 61.A NZ GLN 64.A OE1 no hydrogen 2.986 N/A PHE 62.A N THR 58.A O no hydrogen 3.009 N/A TYR 63.A N GLU 59.A O no hydrogen 2.845 N/A GLN 64.A N LEU 60.A O no hydrogen 2.824 N/A ARG 65.A N LYS 61.A O no hydrogen 3.012 N/A ARG 65.A NH1 TYR 149.A OH no hydrogen 2.668 N/A ALA 66.A N PHE 62.A O no hydrogen 2.920 N/A ALA 67.A N TYR 63.A O no hydrogen 2.900 N/A LYS 68.A N GLN 71.A OE1 no hydrogen 3.097 N/A LYS 68.A NZ GLN 64.A O no hydrogen 2.908 N/A LYS 68.A NZ GLN 71.A OE1 no hydrogen 2.920 N/A GLN 71.A NE2 ARG 65.A O no hydrogen 2.867 N/A ILE 72.A N LYS 68.A O no hydrogen 3.019 N/A GLN 73.A N PRO 69.A O no hydrogen 3.008 N/A LYS 74.A N GLU 70.A O no hydrogen 2.852 N/A TRP 75.A N GLN 71.A O no hydrogen 3.072 N/A ILE 76.A N ILE 72.A O no hydrogen 2.899 N/A ARG 77.A N GLN 73.A O no hydrogen 3.069 N/A THR 78.A N LYS 74.A O no hydrogen 3.011 N/A THR 78.A OG1 LYS 74.A O no hydrogen 3.236 N/A THR 78.A OG1 TRP 75.A O no hydrogen 3.192 N/A ARG 79.A N TRP 75.A O no hydrogen 2.914 N/A ARG 79.A NH1 GLU 142.A OE2 no hydrogen 3.267 N/A ARG 79.A NH2 GLU 142.A OE2 no hydrogen 3.179 N/A LYS 80.A N ARG 77.A O no hydrogen 3.359 N/A LEU 81.A N ILE 76.A O no hydrogen 3.028 N/A TYR 83.A OH VAL 169.A O no hydrogen 2.698 N/A LYS 88.A N ASP 108.A OD2 no hydrogen 2.809 N/A LYS 88.A NZ GLN 73.A OE1 no hydrogen 2.704 N/A TYR 89.A N ALA 67.A O no hydrogen 3.009 N/A TYR 89.A OH SER 92.A OG no hydrogen 2.861 N/A TRP 90.A N ILE 106.A O no hydrogen 2.940 N/A TRP 90.A NE1 ASP 108.A OD1 no hydrogen 3.124 N/A SER 92.A OG TYR 89.A OH no hydrogen 2.861 N/A GLY 93.A N PHE 104.A O no hydrogen 3.076 N/A HIS 95.A N TYR 102.A O no hydrogen 2.787 N/A HIS 95.A NE2 GLN 3.A O no hydrogen 2.802 N/A LYS 97.A N LYS 100.A O no hydrogen 2.967 N/A LYS 100.A N LYS 97.A O no hydrogen 2.946 N/A SER 101.A OG ASP 96.A OD1 no hydrogen 3.351 N/A TYR 102.A N HIS 95.A O no hydrogen 2.767 N/A ARG 103.A N GLU 49.A O no hydrogen 2.824 N/A ARG 103.A NH2 SER 51.A O no hydrogen 2.970 N/A PHE 104.A N GLY 93.A O no hydrogen 3.041 N/A MET 105.A N LYS 47.A O no hydrogen 3.062 N/A ILE 106.A N GLY 91.A O no hydrogen 2.758 N/A MET 107.A N VAL 45.A O no hydrogen 3.051 N/A ASP 108.A N LYS 88.A O no hydrogen 3.246 N/A ARG 109.A N PRO 43.A O no hydrogen 2.978 N/A ARG 109.A NE PHE 110.A O no hydrogen 3.235 N/A ARG 109.A NH1 SER 40.A O no hydrogen 2.711 N/A ARG 109.A NH1 ALA 42.A O no hydrogen 2.820 N/A ARG 109.A NH2 SER 40.A O no hydrogen 2.962 N/A GLY 111.A N LEU 161.A O no hydrogen 2.789 N/A SER 112.A OG ASP 113.A O no hydrogen 2.923 N/A LEU 114.A N LEU 159.A O no hydrogen 2.813 N/A GLN 115.A NE2 GLU 119.A OE1 no hydrogen 2.700 N/A LYS 116.A N ASP 113.A OD1 no hydrogen 2.999 N/A TYR 118.A N LEU 114.A O no hydrogen 2.746 N/A TYR 118.A OH GLN 229.A O no hydrogen 2.739 N/A GLU 119.A N GLN 115.A O no hydrogen 2.934 N/A ALA 120.A N LYS 116.A O no hydrogen 2.941 N/A ASN 121.A N TYR 118.A O no hydrogen 3.093 N/A ALA 122.A N GLU 119.A O no hydrogen 3.062 N/A LYS 123.A N TYR 118.A O no hydrogen 2.927 N/A ARG 124.A N ASN 121.A O no hydrogen 3.333 N/A ARG 124.A NH1 LYS 123.A O no hydrogen 3.382 N/A PHE 125.A N TRP 230.A O no hydrogen 2.947 N/A SER 126.A OG THR 129.A OG1 no hydrogen 2.828 N/A ARG 127.A NE GLU 274.A OE2 no hydrogen 3.007 N/A ARG 127.A NH2 GLU 274.A OE1 no hydrogen 2.659 N/A ARG 127.A NH2 GLU 274.A OE2 no hydrogen 3.457 N/A LYS 128.A NZ GLN 132.A OE1 no hydrogen 2.812 N/A LYS 128.A NZ SER 309.A OG no hydrogen 3.105 N/A LYS 128.A NZ ASP 312.A OD1 no hydrogen 2.908 N/A THR 129.A N SER 126.A OG no hydrogen 3.002 N/A THR 129.A OG1 SER 126.A OG no hydrogen 2.828 N/A THR 129.A OG1 LEU 315.A O no hydrogen 2.722 N/A THR 129.A OG1 ASP 316.A O no hydrogen 3.221 N/A VAL 130.A N SER 126.A O no hydrogen 2.822 N/A LEU 131.A N ARG 127.A O no hydrogen 2.899 N/A GLN 132.A N LYS 128.A O no hydrogen 2.951 N/A GLN 132.A NE2 ASP 311.A OD1 no hydrogen 3.034 N/A LEU 133.A N THR 129.A O no hydrogen 2.836 N/A SER 134.A N VAL 130.A O no hydrogen 3.018 N/A SER 134.A OG VAL 130.A O no hydrogen 2.610 N/A LEU 135.A N LEU 131.A O no hydrogen 2.983 N/A ARG 136.A NE ASP 139.A OD2 no hydrogen 2.873 N/A ARG 136.A NH1 ASP 311.A OD1 no hydrogen 3.155 N/A ARG 136.A NH1 ASP 311.A OD2 no hydrogen 3.406 N/A ARG 136.A NH2 ASP 139.A OD2 no hydrogen 3.525 N/A ARG 136.A NH2 ASP 311.A OD2 no hydrogen 3.003 N/A ILE 137.A N LEU 133.A O no hydrogen 2.949 N/A LEU 138.A N SER 134.A O no hydrogen 2.873 N/A ASP 139.A N LEU 135.A O no hydrogen 3.101 N/A ILE 140.A N ARG 136.A O no hydrogen 3.085 N/A LEU 141.A N ILE 137.A O no hydrogen 2.726 N/A GLU 142.A N LEU 138.A O no hydrogen 2.909 N/A TYR 143.A N ASP 139.A O no hydrogen 3.046 N/A TYR 143.A OH ALA 66.A O no hydrogen 2.613 N/A ILE 144.A N ILE 140.A O no hydrogen 2.931 N/A HIS 145.A N LEU 141.A O no hydrogen 2.870 N/A HIS 145.A ND1 TYR 293.A OH no hydrogen 2.574 N/A HIS 145.A NE2 ASP 219.A OD2 no hydrogen 2.786 N/A GLU 146.A N GLU 142.A O no hydrogen 2.921 N/A HIS 147.A N TYR 143.A O no hydrogen 3.103 N/A HIS 147.A ND1 TYR 143.A O no hydrogen 2.944 N/A GLU 148.A N HIS 145.A O no hydrogen 3.088 N/A TYR 149.A N ILE 144.A O no hydrogen 3.097 N/A VAL 150.A N TYR 178.A O no hydrogen 2.840 N/A HIS 151.A N ASP 219.A OD2 no hydrogen 3.015 N/A HIS 151.A NE2 VAL 172.A O no hydrogen 2.915 N/A GLY 152.A N ASP 219.A OD1 no hydrogen 2.825 N/A ASP 153.A N HIS 151.A ND1 no hydrogen 3.026 N/A LYS 155.A NZ THR 200.A OG1 no hydrogen 2.775 N/A ASN 158.A N LYS 155.A O no hydrogen 2.945 N/A ASN 158.A ND2 ASP 153.A O no hydrogen 2.859 N/A LEU 159.A N ALA 156.A O no hydrogen 3.058 N/A LEU 160.A N TYR 170.A O no hydrogen 2.913 N/A LEU 161.A N SER 112.A O no hydrogen 2.902 N/A ASN 162.A N GLN 168.A O no hydrogen 2.914 N/A ASN 162.A ND2 GLN 168.A OE1 no hydrogen 2.975 N/A LYS 164.A N ASN 162.A OD1 no hydrogen 2.752 N/A ASN 165.A N ASN 162.A O no hydrogen 3.168 N/A ASP 167.A N ASN 165.A OD1 no hydrogen 3.036 N/A GLN 168.A N ASN 165.A O no hydrogen 3.181 N/A VAL 169.A N TYR 83.A OH no hydrogen 2.812 N/A TYR 170.A N LEU 160.A O no hydrogen 2.831 N/A LEU 171.A N GLY 85.A O no hydrogen 2.846 N/A VAL 172.A N ASN 158.A O no hydrogen 2.910 N/A TYR 174.A N GLU 59.A OE2 no hydrogen 2.961 N/A TYR 174.A OH LEU 171.A O no hydrogen 2.721 N/A GLY 175.A N ASP 173.A OD1 no hydrogen 3.352 N/A ALA 177.A N TYR 174.A O no hydrogen 3.081 N/A TYR 178.A N VAL 150.A O no hydrogen 3.032 N/A TYR 178.A OH ASP 192.A OD2 no hydrogen 2.491 N/A ARG 179.A NH2 GLU 148.A OE1 no hydrogen 3.384 N/A TYR 180.A OH HIS 145.A O no hydrogen 2.649 N/A CYS 181.A N GLU 148.A O no hydrogen 3.436 N/A GLU 183.A N GLU 148.A OE1 no hydrogen 3.393 N/A GLY 184.A N GLU 148.A OE2 no hydrogen 3.086 N/A GLY 184.A N CYS 181.A O no hydrogen 2.989 N/A VAL 185.A N PRO 182.A O no hydrogen 3.073 N/A HIS 186.A ND1 LYS 187.A O no hydrogen 2.772 N/A LYS 187.A N TYR 180.A O no hydrogen 2.914 N/A LYS 194.A N ASP 192.A OD1 no hydrogen 3.193 N/A ARG 195.A N ASP 192.A O no hydrogen 2.735 N/A ARG 195.A NH1 LEU 176.A O no hydrogen 2.725 N/A ARG 195.A NH2 LEU 176.A O no hydrogen 3.514 N/A THR 200.A OG1 ASP 153.A OD1 no hydrogen 2.640 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 2.745 N/A PHE 203.A N THR 200.A O no hydrogen 2.990 N/A THR 204.A OG1 ASP 198.A O no hydrogen 2.575 N/A ILE 206.A N GLU 221.A OE1 no hydrogen 3.388 N/A ILE 206.A N GLU 221.A OE2 no hydrogen 3.048 N/A ALA 208.A N SER 205.A OG no hydrogen 2.996 N/A HIS 209.A N SER 205.A O no hydrogen 2.982 N/A ASN 210.A N ILE 206.A O no hydrogen 2.839 N/A GLY 211.A N ALA 208.A O no hydrogen 2.867 N/A VAL 212.A N ASP 207.A O no hydrogen 3.125 N/A ALA 213.A N ALA 190.A O no hydrogen 2.930 N/A SER 215.A OG TYR 287.A O no hydrogen 2.697 N/A ARG 216.A NH2 THR 288.A O no hydrogen 3.016 N/A ARG 217.A NE ASP 207.A OD2 no hydrogen 2.871 N/A ARG 217.A NH1 LEU 285.A O no hydrogen 2.994 N/A ARG 217.A NH2 ASP 207.A OD1 no hydrogen 2.737 N/A ARG 217.A NH2 ASP 207.A OD2 no hydrogen 3.555 N/A LEU 220.A N ARG 216.A O no hydrogen 3.243 N/A GLU 221.A N ARG 217.A O no hydrogen 2.912 N/A ILE 222.A N GLY 218.A O no hydrogen 2.945 N/A LEU 223.A N ASP 219.A O no hydrogen 3.140 N/A GLY 224.A N LEU 220.A O no hydrogen 3.066 N/A TYR 225.A N GLU 221.A O no hydrogen 3.120 N/A TYR 225.A OH GLU 221.A OE2 no hydrogen 2.592 N/A CYS 226.A N ILE 222.A O no hydrogen 2.983 N/A CYS 226.A SG ILE 154.A O no hydrogen 3.440 N/A CYS 226.A SG ILE 222.A O no hydrogen 3.618 N/A MET 227.A N LEU 223.A O no hydrogen 2.824 N/A ILE 228.A N GLY 224.A O no hydrogen 3.161 N/A GLN 229.A N TYR 225.A O no hydrogen 2.964 N/A GLN 229.A NE2 TYR 118.A OH no hydrogen 2.913 N/A TRP 230.A N CYS 226.A O no hydrogen 2.761 N/A LEU 231.A N MET 227.A O no hydrogen 2.919 N/A THR 232.A N ILE 228.A O no hydrogen 2.875 N/A THR 232.A OG1 ILE 228.A O no hydrogen 2.808 N/A GLY 233.A N GLN 229.A O no hydrogen 2.983 N/A HIS 234.A N THR 232.A OG1 no hydrogen 3.196 N/A HIS 234.A ND1 GLU 238.A OE1 no hydrogen 2.615 N/A LEU 235.A N GLU 238.A OE2 no hydrogen 3.139 N/A TRP 237.A NE1 GLU 202.A O no hydrogen 2.766 N/A GLU 238.A N LEU 235.A O no hydrogen 3.162 N/A ASN 240.A N TRP 237.A O no hydrogen 3.077 N/A ASP 243.A N ASN 240.A O no hydrogen 3.206 N/A LYS 245.A N ASP 243.A OD1 no hydrogen 3.036 N/A LYS 245.A NZ ASP 243.A OD1 no hydrogen 3.018 N/A LYS 245.A NZ ASP 243.A OD2 no hydrogen 3.471 N/A VAL 247.A N ASP 243.A O no hydrogen 3.302 N/A ARG 248.A N PRO 244.A O no hydrogen 2.919 N/A ARG 248.A NH1 ASN 210.A OD1 no hydrogen 2.790 N/A ASP 249.A N LYS 245.A O no hydrogen 3.052 N/A SER 250.A N.A TYR 246.A O no hydrogen 2.996 N/A SER 250.A N.B TYR 246.A O no hydrogen 2.992 N/A SER 250.A OG.B TYR 246.A O no hydrogen 3.560 N/A LYS 251.A N VAL 247.A O no hydrogen 3.064 N/A LYS 251.A NZ ILE 201.A O no hydrogen 2.828 N/A LYS 251.A NZ THR 204.A O no hydrogen 2.747 N/A LYS 251.A NZ HIS 209.A NE2 no hydrogen 2.951 N/A ILE 252.A N ARG 248.A O no hydrogen 2.888 N/A ARG 253.A N ASP 249.A O no hydrogen 3.043 N/A ARG 253.A NE ASP 249.A OD1 no hydrogen 3.350 N/A ARG 253.A NE ASP 249.A OD2 no hydrogen 2.950 N/A TYR 254.A N SER 250.A O.A no hydrogen 2.997 N/A TYR 254.A N SER 250.A O.B no hydrogen 2.972 N/A ARG 255.A N LYS 251.A O no hydrogen 2.959 N/A GLU 256.A N ILE 252.A O no hydrogen 3.173 N/A ASN 257.A N ARG 253.A O no hydrogen 3.047 N/A SER 260.A N ASN 257.A O no hydrogen 3.156 N/A SER 260.A OG ASN 257.A O no hydrogen 3.245 N/A LEU 261.A N ASN 257.A O no hydrogen 3.374 N/A MET 262.A N ILE 258.A O no hydrogen 2.956 N/A ASP 263.A N ALA 259.A O no hydrogen 2.907 N/A LYS 264.A N SER 260.A O no hydrogen 2.922 N/A CYS 265.A N LEU 261.A O no hydrogen 2.814 N/A CYS 265.A SG LEU 261.A O no hydrogen 3.322 N/A PHE 266.A N MET 262.A O no hydrogen 2.888 N/A GLU 274.A N GLU 274.A OE1 no hydrogen 2.890 N/A ILE 275.A N PRO 272.A O no hydrogen 3.151 N/A LYS 277.A N GLY 273.A O no hydrogen 2.829 N/A TYR 278.A N GLU 274.A O no hydrogen 2.773 N/A TYR 278.A OH LEU 220.A O no hydrogen 2.684 N/A MET 279.A N ILE 275.A O no hydrogen 2.994 N/A GLU 280.A N ALA 276.A O no hydrogen 2.958 N/A THR 281.A N LYS 277.A O no hydrogen 3.007 N/A THR 281.A OG1 LYS 277.A O no hydrogen 3.136 N/A VAL 282.A N TYR 278.A O no hydrogen 3.135 N/A LYS 283.A N MET 279.A O no hydrogen 2.962 N/A LYS 283.A NZ ARG 255.A O no hydrogen 2.777 N/A LYS 283.A NZ GLU 256.A O no hydrogen 3.241 N/A LEU 284.A N THR 281.A O no hydrogen 3.188 N/A LEU 285.A N VAL 282.A O no hydrogen 3.083 N/A ASP 286.A N GLU 289.A OE1 no hydrogen 2.850 N/A TYR 287.A OH ALA 213.A O no hydrogen 2.390 N/A GLU 289.A N ASP 286.A O no hydrogen 3.194 N/A TYR 293.A OH HIS 145.A ND1 no hydrogen 2.574 N/A LEU 296.A N LEU 292.A O no hydrogen 3.095 N/A ARG 297.A N TYR 293.A O no hydrogen 2.923 N/A ARG 297.A NE GLU 294.A OE1 no hydrogen 2.912 N/A ARG 297.A NH1 GLU 142.A OE1 no hydrogen 2.765 N/A ARG 297.A NH2 GLU 142.A OE1 no hydrogen 2.730 N/A ARG 297.A NH2 GLU 294.A OE1 no hydrogen 2.601 N/A ASP 298.A N GLU 294.A O no hydrogen 2.855 N/A ILE 299.A N ASN 295.A O no hydrogen 3.026 N/A LEU 300.A N LEU 296.A O no hydrogen 3.174 N/A LEU 301.A N ARG 297.A O no hydrogen 2.694 N/A GLN 302.A N ASP 298.A O no hydrogen 2.847 N/A GLY 303.A N ILE 299.A O no hydrogen 3.352 N/A LEU 304.A N LEU 300.A O no hydrogen 3.317 N/A LYS 305.A N LEU 301.A O no hydrogen 3.108 N/A ALA 306.A N GLN 302.A O no hydrogen 3.028 N/A ILE 307.A N GLY 303.A O no hydrogen 3.220 N/A GLY 308.A N LYS 305.A O no hydrogen 2.823 N/A SER 309.A N LEU 304.A O no hydrogen 2.769 N/A ASP 312.A N LYS 310.A O no hydrogen 2.891 N/A GLY 313.A N ASP 311.A OD1 no hydrogen 3.260 N/A LYS 314.A N ASP 312.A OD1 no hydrogen 3.008 N/A LEU 315.A N ASP 167.A OD1 no hydrogen 3.017 N/A