Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dsd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 260.A OD2 no hydrogen 3.259 N/A LYS 2.A N ASP 42.A OD1 no hydrogen 2.945 N/A LYS 2.A NZ GLU 39.A O no hydrogen 2.834 N/A PHE 3.A N VAL 258.A O no hydrogen 2.882 N/A ALA 4.A N PHE 43.A O no hydrogen 3.177 N/A HIS 5.A N TYR 256.A O no hydrogen 2.869 N/A HIS 5.A ND1 TYR 201.A OH no hydrogen 3.016 N/A HIS 5.A NE2 LEU 204.A O no hydrogen 2.883 N/A LEU 6.A N LEU 45.A O no hydrogen 2.861 N/A ASP 8.A N GLY 48.A O no hydrogen 2.946 N/A HIS 10.A N ASP 49.A O no hydrogen 2.917 N/A HIS 10.A ND1 HIS 52.A ND1 no hydrogen 3.012 N/A LEU 11.A N LEU 50.A O no hydrogen 2.951 N/A TYR 13.A N HIS 10.A O no hydrogen 3.108 N/A GLN 15.A NE2 ARG 228.A O no hydrogen 2.934 N/A GLN 15.A NE2 TRP 229.A O no hydrogen 2.643 N/A HIS 17.A N GLU 14.A O no hydrogen 3.172 N/A LYS 18.A N GLN 15.A O no hydrogen 3.062 N/A ARG 21.A N LYS 18.A O no hydrogen 2.969 N/A ARG 21.A NE GLN 15.A OE1 no hydrogen 2.610 N/A ARG 21.A NH1 GLN 15.A OE1 no hydrogen 2.784 N/A ARG 21.A NH1 GLU 227.A OE2 no hydrogen 3.177 N/A ARG 21.A NH1 ARG 228.A O no hydrogen 3.170 N/A ARG 21.A NH2 GLU 24.A OE1 no hydrogen 2.990 N/A ARG 21.A NH2 GLU 227.A OE2 no hydrogen 2.644 N/A GLU 23.A N PRO 19.A O no hydrogen 3.333 N/A GLU 24.A N GLN 20.A O no hydrogen 3.083 N/A PHE 25.A N ARG 21.A O no hydrogen 3.019 N/A ALA 26.A N GLU 22.A O no hydrogen 3.325 N/A GLU 27.A N GLU 23.A O no hydrogen 2.985 N/A ALA 28.A N GLU 24.A O no hydrogen 2.957 N/A PHE 29.A N PHE 25.A O no hydrogen 3.254 N/A LYS 30.A N ALA 26.A O no hydrogen 2.891 N/A LYS 30.A NZ GLU 34.A OE1 no hydrogen 3.162 N/A LYS 30.A NZ GLU 34.A OE2 no hydrogen 2.746 N/A ASN 31.A N GLU 27.A O no hydrogen 2.809 N/A ALA 32.A N ALA 28.A O no hydrogen 2.915 N/A LEU 33.A N PHE 29.A O no hydrogen 2.953 N/A GLU 34.A N LYS 30.A O no hydrogen 3.090 N/A ILE 35.A N ASN 31.A O no hydrogen 3.103 N/A ALA 36.A N ALA 32.A O no hydrogen 2.924 N/A VAL 37.A N LEU 33.A O no hydrogen 2.925 N/A GLN 38.A N GLU 34.A O no hydrogen 2.858 N/A GLU 39.A N ILE 35.A O no hydrogen 2.608 N/A ASN 40.A N VAL 37.A O no hydrogen 2.773 N/A VAL 41.A N ALA 36.A O no hydrogen 3.313 N/A ASP 42.A N LYS 2.A O no hydrogen 2.593 N/A ILE 44.A N PRO 77.A O no hydrogen 2.978 N/A LEU 45.A N ALA 4.A O no hydrogen 2.837 N/A ILE 46.A N PHE 79.A O no hydrogen 2.837 N/A ALA 47.A N LEU 6.A O no hydrogen 2.861 N/A GLY 48.A N ILE 46.A O no hydrogen 2.924 N/A PHE 51.A N ASP 86.A OD1 no hydrogen 3.191 N/A HIS 52.A N LEU 11.A O no hydrogen 3.000 N/A HIS 52.A ND1 HIS 10.A ND1 no hydrogen 3.012 N/A ARG 55.A N SER 53.A OG no hydrogen 2.973 N/A SER 57.A OG THR 60.A OG1 no hydrogen 2.979 N/A THR 60.A N SER 57.A OG no hydrogen 2.852 N/A THR 60.A OG1 GLU 22.A OE1 no hydrogen 3.218 N/A THR 60.A OG1 SER 57.A OG no hydrogen 2.979 N/A LEU 61.A N SER 57.A O no hydrogen 2.877 N/A LYS 62.A N PRO 58.A O no hydrogen 2.788 N/A LYS 63.A N GLY 59.A O no hydrogen 2.914 N/A ALA 64.A N THR 60.A O no hydrogen 2.867 N/A ILE 65.A N LEU 61.A O no hydrogen 2.823 N/A ALA 66.A N LYS 62.A O no hydrogen 3.076 N/A LEU 67.A N LYS 63.A O no hydrogen 3.004 N/A LEU 68.A N ALA 64.A O no hydrogen 2.929 N/A GLN 69.A N ILE 65.A O no hydrogen 3.247 N/A GLN 69.A NE2 ILE 65.A O no hydrogen 3.456 N/A ILE 70.A N LEU 67.A O no hydrogen 3.048 N/A LYS 72.A N LEU 68.A O no hydrogen 3.421 N/A LYS 72.A NZ PHE 101.A O no hydrogen 2.969 N/A GLU 73.A N GLN 69.A O no hydrogen 2.752 N/A HIS 74.A N PRO 71.A O no hydrogen 2.997 N/A HIS 74.A ND1 ILE 70.A O no hydrogen 3.055 N/A SER 75.A N LYS 72.A O no hydrogen 2.981 N/A ILE 76.A N PRO 71.A O no hydrogen 2.914 N/A PHE 79.A N ILE 44.A O no hydrogen 2.781 N/A ALA 80.A N TYR 105.A O no hydrogen 2.988 N/A ILE 81.A N ILE 46.A O no hydrogen 3.387 N/A GLY 83.A N ASP 86.A OD2 no hydrogen 2.829 N/A SER 85.A N ASP 49.A OD2 no hydrogen 2.872 N/A SER 85.A OG ASP 49.A OD1 no hydrogen 3.143 N/A ARG 87.A N GLY 83.A O no hydrogen 3.124 N/A ARG 87.A NH2 TYR 145.A O no hydrogen 2.738 N/A THR 88.A N GLU 82.A OE2 no hydrogen 3.424 N/A THR 88.A OG1 GLY 91.A O no hydrogen 2.951 N/A SER 93.A N ASN 96.A OD1 no hydrogen 3.000 N/A SER 93.A OG GLU 82.A OE1 no hydrogen 2.547 N/A SER 93.A OG ASN 96.A OD1 no hydrogen 3.450 N/A LEU 97.A N SER 93.A O no hydrogen 3.322 N/A LEU 98.A N VAL 94.A O no hydrogen 2.909 N/A GLU 99.A N LEU 95.A O no hydrogen 2.887 N/A ASP 100.A N ASN 96.A O no hydrogen 3.151 N/A PHE 101.A N LEU 98.A O no hydrogen 3.072 N/A GLY 102.A N GLU 99.A O no hydrogen 2.864 N/A LEU 103.A N LEU 98.A O no hydrogen 2.965 N/A TYR 105.A N VAL 78.A O no hydrogen 2.649 N/A VAL 106.A N GLU 99.A OE2 no hydrogen 2.830 N/A ILE 107.A N ALA 80.A O no hydrogen 2.908 N/A GLY 108.A N VAL 131.A O no hydrogen 3.112 N/A ARG 110.A N TYR 129.A O no hydrogen 2.852 N/A ARG 110.A NH1 GLU 99.A OE1 no hydrogen 3.294 N/A ARG 110.A NH1 GLU 99.A OE2 no hydrogen 2.843 N/A ARG 110.A NH1 VAL 106.A O no hydrogen 3.031 N/A ARG 110.A NH2 GLU 99.A OE1 no hydrogen 2.989 N/A LYS 113.A NZ GLU 115.A OE1 no hydrogen 2.852 N/A VAL 114.A N SER 121.A OG no hydrogen 2.763 N/A ASN 116.A N LEU 119.A O no hydrogen 2.902 N/A TYR 118.A N ASN 116.A OD1 no hydrogen 2.836 N/A THR 120.A N LYS 132.A O no hydrogen 2.923 N/A THR 120.A OG1 GLU 115.A OE1 no hydrogen 3.434 N/A THR 120.A OG1 GLU 115.A OE2 no hydrogen 2.618 N/A SER 121.A N GLU 115.A OE1 no hydrogen 2.848 N/A SER 121.A OG VAL 114.A O no hydrogen 2.478 N/A GLU 122.A N LEU 130.A O no hydrogen 2.902 N/A LEU 124.A N GLU 128.A O no hydrogen 2.850 N/A GLY 127.A N LEU 124.A O no hydrogen 2.904 N/A GLU 128.A N ASN 126.A OD1 no hydrogen 3.069 N/A TYR 129.A N ARG 110.A O no hydrogen 2.670 N/A LEU 130.A N GLU 122.A O no hydrogen 2.888 N/A VAL 131.A N GLY 108.A O no hydrogen 2.958 N/A LYS 132.A N THR 120.A O no hydrogen 2.807 N/A LYS 132.A NZ GLU 122.A OE2 no hydrogen 2.350 N/A GLY 133.A N ILE 140.A O no hydrogen 2.780 N/A VAL 134.A N TYR 118.A O no hydrogen 2.759 N/A TYR 135.A N LEU 138.A O no hydrogen 2.858 N/A ASP 137.A N ASP 137.A OD1 no hydrogen 2.581 N/A LEU 138.A N TYR 135.A O no hydrogen 2.835 N/A GLU 139.A N ASN 167.A O no hydrogen 3.011 N/A ILE 140.A N GLY 133.A O no hydrogen 2.903 N/A HIS 141.A N ILE 169.A O no hydrogen 2.852 N/A HIS 141.A ND1 TYR 199.A OH no hydrogen 2.775 N/A HIS 141.A NE2 GLU 139.A OE1 no hydrogen 2.900 N/A TYR 145.A N GLU 82.A O no hydrogen 3.035 N/A MET 146.A N GLN 174.A OE1 no hydrogen 2.825 N/A SER 148.A OG GLU 152.A OE2 no hydrogen 3.251 N/A TRP 150.A N SER 147.A O no hydrogen 3.149 N/A GLU 152.A N SER 148.A O no hydrogen 3.050 N/A ALA 153.A N ALA 149.A O no hydrogen 2.865 N/A ASN 154.A N TRP 150.A O no hydrogen 3.041 N/A ASN 154.A ND2 TRP 150.A O no hydrogen 2.902 N/A LYS 159.A NZ GLY 193.A O no hydrogen 2.843 N/A ARG 160.A N GLU 156.A O no hydrogen 3.020 N/A ARG 160.A NH2 LYS 155.A O no hydrogen 2.434 N/A LEU 161.A N ILE 157.A O no hydrogen 2.718 N/A PHE 162.A N LEU 158.A O no hydrogen 2.882 N/A ASN 167.A N THR 165.A OG1 no hydrogen 3.154 N/A ILE 169.A N GLU 139.A O no hydrogen 2.943 N/A LEU 170.A N TYR 201.A O no hydrogen 2.926 N/A MET 171.A N HIS 141.A O no hydrogen 2.763 N/A LEU 172.A N ALA 203.A O no hydrogen 3.137 N/A HIS 173.A ND1 ALA 47.A O no hydrogen 2.721 N/A HIS 173.A NE2 ASN 84.A OD1 no hydrogen 3.034 N/A HIS 173.A NE2 HIS 206.A ND1 no hydrogen 3.087 N/A GLN 174.A NE2 MET 146.A O no hydrogen 2.822 N/A GLN 174.A NE2 GLU 189.A OE1 no hydrogen 2.868 N/A GLY 175.A N GLU 189.A OE1 no hydrogen 2.731 N/A ARG 177.A N ILE 190.A O no hydrogen 2.686 N/A SER 180.A N VAL 176.A O no hydrogen 3.039 N/A SER 180.A OG VAL 176.A O no hydrogen 3.470 N/A SER 180.A OG ARG 177.A O no hydrogen 2.860 N/A GLU 181.A N ARG 177.A O no hydrogen 2.757 N/A ALA 182.A N GLU 178.A O no hydrogen 2.781 N/A ARG 183.A N SER 180.A O no hydrogen 3.034 N/A ARG 183.A NH1 ARG 210.A O no hydrogen 2.544 N/A ARG 183.A NH2 LYS 209.A O no hydrogen 2.672 N/A GLU 189.A N GLY 175.A O no hydrogen 3.061 N/A ILE 190.A N GLY 175.A O no hydrogen 3.323 N/A GLY 191.A N ASP 194.A OD2 no hydrogen 2.822 N/A LEU 192.A N GLU 178.A OE2 no hydrogen 2.820 N/A ASP 194.A N GLY 191.A O no hydrogen 2.927 N/A LEU 195.A N LEU 192.A O no hydrogen 3.050 N/A TYR 199.A N TYR 202.A OH no hydrogen 3.337 N/A TYR 199.A OH HIS 141.A ND1 no hydrogen 2.775 N/A LEU 200.A N ALA 168.A O no hydrogen 2.777 N/A TYR 201.A OH HIS 5.A ND1 no hydrogen 3.016 N/A TYR 202.A N PRO 219.A O no hydrogen 2.947 N/A TYR 202.A OH PRO 196.A O no hydrogen 2.533 N/A ALA 203.A N LEU 170.A O no hydrogen 2.834 N/A LEU 204.A N VAL 221.A O no hydrogen 2.949 N/A HIS 206.A N ASP 8.A OD2 no hydrogen 2.815 N/A HIS 206.A ND1 HIS 173.A NE2 no hydrogen 3.087 N/A LYS 209.A NZ GLY 232.A O no hydrogen 3.266 N/A TYR 211.A N TYR 222.A O no hydrogen 2.952 N/A THR 213.A N VAL 220.A O no hydrogen 2.722 N/A SER 214.A N THR 213.A OG1 no hydrogen 2.780 N/A SER 214.A OG SER 218.A O no hydrogen 3.420 N/A TYR 215.A N SER 218.A O no hydrogen 3.000 N/A TYR 215.A OH LEU 195.A O no hydrogen 2.616 N/A SER 218.A N TYR 215.A O no hydrogen 3.023 N/A SER 218.A OG TYR 199.A O no hydrogen 2.556 N/A VAL 220.A N THR 213.A O no hydrogen 2.766 N/A VAL 221.A N TYR 202.A O no hydrogen 3.032 N/A TYR 222.A N TYR 211.A O no hydrogen 2.843 N/A TYR 222.A OH GLN 174.A O no hydrogen 2.572 N/A SER 225.A N HIS 208.A O no hydrogen 2.868 N/A SER 225.A OG HIS 208.A O no hydrogen 3.394 N/A SER 225.A OG GLU 227.A O no hydrogen 2.746 N/A ARG 228.A NH1 VAL 251.A O no hydrogen 3.148 N/A ARG 228.A NH2 ASP 233.A O no hydrogen 2.987 N/A ARG 228.A NH2 VAL 251.A O no hydrogen 3.179 N/A TRP 229.A N ASP 233.A OD1 no hydrogen 3.103 N/A ASP 233.A N ASP 230.A O no hydrogen 2.929 N/A ASP 233.A N ASP 230.A OD2 no hydrogen 3.197 N/A GLU 235.A N PHE 273.A O no hydrogen 2.738 N/A ARG 237.A N ARG 248.A O no hydrogen 2.685 N/A ARG 237.A NH1 GLU 239.A OE2 no hydrogen 2.739 N/A TYR 238.A N ASP 275.A O no hydrogen 2.782 N/A GLU 239.A N LYS 246.A O no hydrogen 3.001 N/A TRP 240.A N LYS 277.A O no hydrogen 3.030 N/A TRP 240.A NE1 GLU 284.A OE2 no hydrogen 2.800 N/A ASP 241.A N LYS 244.A O no hydrogen 2.851 N/A ILE 243.A N ASP 241.A OD2 no hydrogen 2.941 N/A LYS 244.A N ASP 241.A OD2 no hydrogen 2.858 N/A LYS 246.A N GLU 239.A O no hydrogen 2.844 N/A ARG 248.A N ARG 237.A O no hydrogen 2.777 N/A ARG 248.A NE TYR 234.A OH no hydrogen 3.482 N/A ARG 248.A NH2 TYR 234.A OH no hydrogen 3.265 N/A GLY 250.A N GLU 235.A O no hydrogen 2.842 N/A LYS 253.A NZ HIS 208.A O no hydrogen 2.828 N/A LYS 253.A NZ SER 225.A OG no hydrogen 3.054 N/A LYS 253.A NZ ASP 233.A OD1 no hydrogen 2.488 N/A LYS 253.A NZ ASP 233.A OD2 no hydrogen 3.379 N/A PHE 255.A N VAL 266.A O no hydrogen 3.054 N/A TYR 256.A N HIS 5.A O no hydrogen 3.195 N/A ILE 257.A N ARG 264.A O no hydrogen 2.824 N/A VAL 258.A N PHE 3.A O no hydrogen 2.740 N/A GLU 259.A N LYS 262.A O no hydrogen 3.162 N/A ASP 260.A N MET 1.A O no hydrogen 2.861 N/A LYS 262.A N GLU 259.A O no hydrogen 3.018 N/A ARG 264.A N ILE 257.A O no hydrogen 2.714 N/A ARG 264.A NH1 GLU 39.A OE2 no hydrogen 2.972 N/A ARG 264.A NH2 GLU 39.A OE2 no hydrogen 2.506 N/A VAL 266.A N PHE 255.A O no hydrogen 2.784 N/A ILE 268.A N LYS 253.A O no hydrogen 2.849 N/A LYS 269.A NZ GLU 267.A OE2 no hydrogen 2.646 N/A ARG 271.A NH2 GLN 20.A OE1 no hydrogen 2.726 N/A ILE 274.A N TYR 301.A O no hydrogen 2.875 N/A ASP 275.A N VAL 236.A O no hydrogen 3.123 N/A VAL 276.A N ARG 303.A O no hydrogen 2.667 N/A LYS 277.A N TYR 238.A O no hydrogen 2.745 N/A LYS 277.A NZ GLU 239.A OE1 no hydrogen 3.110 N/A ILE 278.A N ASN 305.A O no hydrogen 2.899 N/A GLY 280.A N GLY 307.A O no hydrogen 3.019 N/A ILE 285.A N SER 281.A O no hydrogen 2.874 N/A ARG 286.A N GLU 282.A O no hydrogen 2.764 N/A ARG 286.A NE GLU 282.A OE1 no hydrogen 2.980 N/A ARG 286.A NH2 GLU 316.A OE2 no hydrogen 2.779 N/A LYS 287.A N GLU 283.A O no hydrogen 3.022 N/A ALA 288.A N GLU 284.A O no hydrogen 2.827 N/A ILE 289.A N ILE 285.A O no hydrogen 2.818 N/A LYS 290.A N ARG 286.A O no hydrogen 3.080 N/A ARG 291.A N LYS 287.A O no hydrogen 3.274 N/A LEU 292.A N ALA 288.A O no hydrogen 3.065 N/A LEU 292.A N ILE 289.A O no hydrogen 3.323 N/A LEU 295.A N LEU 292.A O no hydrogen 2.818 N/A ILE 296.A N ILE 293.A O no hydrogen 3.140 N/A ALA 300.A N PRO 297.A O no hydrogen 3.230 N/A TYR 301.A N PRO 272.A O no hydrogen 3.002 N/A VAL 302.A N TYR 325.A O no hydrogen 3.090 N/A ARG 303.A N ILE 274.A O no hydrogen 2.869 N/A ARG 303.A NE ASP 275.A OD2 no hydrogen 2.716 N/A ARG 303.A NH1 ASP 275.A OD1 no hydrogen 3.073 N/A ARG 303.A NH1 ASP 275.A OD2 no hydrogen 3.254 N/A LEU 304.A N LYS 327.A O no hydrogen 2.838 N/A ASN 305.A N VAL 276.A O no hydrogen 2.738 N/A ASN 305.A ND2 ASP 329.A O no hydrogen 2.879 N/A ILE 306.A N ASP 329.A O no hydrogen 2.913 N/A GLY 307.A N ILE 278.A O no hydrogen 2.768 N/A TRP 308.A N TRP 331.A O no hydrogen 3.059 N/A THR 315.A OG1 ASP 313.A OD1 no hydrogen 2.747 N/A LYS 318.A N LEU 314.A O no hydrogen 3.166 N/A GLU 319.A N GLU 316.A O no hydrogen 3.064 N/A LEU 320.A N GLU 316.A O no hydrogen 2.772 N/A LEU 321.A N ILE 317.A O no hydrogen 3.143 N/A LYS 327.A N VAL 302.A O no hydrogen 2.787 N/A ASP 329.A N LEU 304.A O no hydrogen 2.842 N/A TRP 331.A N ILE 306.A O no hydrogen 3.138 N/A ILE 333.A N TRP 308.A O no hydrogen 2.926 N/A