Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q0j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 5.A N GLY 2.A O no hydrogen 2.929 N/A ARG 12.A NE GLY 231.A O no hydrogen 2.771 N/A ARG 12.A NH2 GLY 231.A O no hydrogen 3.145 N/A LEU 13.A N LEU 233.A O no hydrogen 2.828 N/A GLY 17.A N LEU 25.A O no hydrogen 2.938 N/A GLN 18.A NE2 ASP 20.A O no hydrogen 2.785 N/A LEU 19.A N LEU 23.A O no hydrogen 2.752 N/A ASP 20.A N LEU 23.A O no hydrogen 3.211 N/A ASP 21.A N ASP 20.A OD1 no hydrogen 2.779 N/A LEU 23.A N ASP 20.A O no hydrogen 3.201 N/A CYS 24.A N LEU 35.A O no hydrogen 2.911 N/A LEU 25.A N GLY 17.A O no hydrogen 2.932 N/A LEU 26.A N VAL 33.A O no hydrogen 2.778 N/A GLY 27.A N ASP 60.A OD2 no hydrogen 2.576 N/A GLN 30.A N ASP 28.A OD1 no hydrogen 2.941 N/A VAL 31.A N ASP 28.A O no hydrogen 2.947 N/A VAL 33.A N LEU 26.A O no hydrogen 3.298 N/A PHE 34.A N VAL 46.A O no hydrogen 2.772 N/A LEU 35.A N CYS 24.A O no hydrogen 2.953 N/A LEU 36.A N ALA 44.A O no hydrogen 2.794 N/A ARG 37.A N ASP 22.A O no hydrogen 2.975 N/A ARG 37.A NE GLY 39.A O no hydrogen 2.798 N/A ARG 37.A NH2 GLU 40.A O no hydrogen 2.931 N/A LEU 38.A N SER 42.A O no hydrogen 2.797 N/A GLY 39.A N SER 42.A O no hydrogen 3.146 N/A TRP 43.A N GLN 70.A O no hydrogen 2.887 N/A ALA 44.A N LEU 36.A O no hydrogen 2.922 N/A LEU 45.A N TYR 73.A O no hydrogen 2.938 N/A VAL 46.A N PHE 34.A O no hydrogen 2.799 N/A GLU 47.A N LEU 75.A O no hydrogen 2.913 N/A SER 51.A N ASN 122.A OD1 no hydrogen 2.918 N/A SER 51.A OG GLY 85.A O no hydrogen 2.581 N/A ARG 52.A NE ASP 53.A OD1 no hydrogen 2.890 N/A ARG 52.A NH1 LEU 125.A O no hydrogen 2.886 N/A ARG 52.A NH1 ASP 284.A O no hydrogen 3.019 N/A ARG 52.A NH2 ASP 284.A O no hydrogen 2.947 N/A ASP 53.A N ILE 50.A O no hydrogen 3.122 N/A ALA 54.A N SER 51.A O no hydrogen 3.053 N/A VAL 57.A N ASP 53.A O no hydrogen 2.777 N/A TRP 58.A N ALA 54.A O no hydrogen 2.783 N/A ALA 59.A N GLU 55.A O no hydrogen 2.981 N/A ASP 60.A N LEU 56.A O no hydrogen 3.275 N/A LEU 61.A N VAL 57.A O no hydrogen 2.801 N/A CYS 62.A N TRP 58.A O no hydrogen 2.845 N/A CYS 62.A SG TRP 58.A O no hydrogen 3.347 N/A ARG 63.A N ALA 59.A O no hydrogen 3.091 N/A ARG 63.A N ASP 60.A O no hydrogen 3.080 N/A TRP 64.A N LEU 61.A O no hydrogen 3.166 N/A VAL 65.A N LEU 61.A O no hydrogen 2.960 N/A SER 69.A N ASP 67.A OD1 no hydrogen 3.105 N/A SER 69.A OG ASP 67.A OD1 no hydrogen 2.604 N/A SER 69.A OG ASP 67.A OD2 no hydrogen 2.815 N/A GLN 70.A N ASP 67.A O no hydrogen 2.857 N/A VAL 71.A N PRO 68.A O no hydrogen 3.245 N/A HIS 72.A N TRP 43.A O no hydrogen 2.795 N/A TRP 74.A N GLN 98.A O no hydrogen 2.888 N/A TRP 74.A NE1 GLU 47.A O no hydrogen 2.812 N/A LEU 75.A N LEU 45.A O no hydrogen 2.842 N/A ILE 76.A N LEU 100.A O no hydrogen 2.988 N/A THR 77.A OG1 GLU 47.A OE1 no hydrogen 2.936 N/A THR 77.A OG1 HIS 78.A ND1 no hydrogen 2.748 N/A HIS 78.A ND1 THR 77.A OG1 no hydrogen 2.748 N/A LYS 79.A N ASP 171.A OD2 no hydrogen 2.912 N/A LYS 79.A NZ ASP 170.A OD1 no hydrogen 3.000 N/A TYR 81.A OH PHE 285.A O no hydrogen 2.509 N/A HIS 83.A N HIS 80.A O no hydrogen 2.868 N/A HIS 83.A ND1 GLU 47.A OE1 no hydrogen 3.050 N/A CYS 84.A SG LYS 79.A O no hydrogen 3.481 N/A CYS 84.A SG HIS 80.A O no hydrogen 3.633 N/A GLY 85.A N GLY 49.A O no hydrogen 2.826 N/A LEU 86.A N GLY 48.A O no hydrogen 2.999 N/A LEU 87.A N CYS 84.A O no hydrogen 3.300 N/A TYR 89.A N LEU 86.A O no hydrogen 2.976 N/A LEU 90.A N LEU 86.A O no hydrogen 2.903 N/A CYS 91.A N LEU 87.A O no hydrogen 3.002 N/A ARG 93.A N LEU 90.A O no hydrogen 2.856 N/A ARG 93.A NH1 GLU 55.A OE1 no hydrogen 3.254 N/A ARG 93.A NH2 GLU 55.A OE2 no hydrogen 2.897 N/A LEU 94.A N CYS 91.A O no hydrogen 3.071 N/A ASN 96.A ND2 SER 69.A O no hydrogen 2.694 N/A VAL 97.A N LEU 94.A O no hydrogen 3.268 N/A GLN 98.A N HIS 72.A O no hydrogen 2.847 N/A VAL 99.A N PRO 142.A O no hydrogen 2.828 N/A LEU 100.A N TRP 74.A O no hydrogen 2.841 N/A ALA 101.A N ARG 144.A O no hydrogen 3.261 N/A SER 102.A OG THR 105.A OG1 no hydrogen 2.636 N/A SER 102.A OG ASP 171.A O no hydrogen 3.101 N/A ARG 104.A NH1 ASP 170.A O no hydrogen 2.997 N/A THR 105.A N SER 102.A OG no hydrogen 2.935 N/A THR 105.A OG1 SER 102.A OG no hydrogen 2.636 N/A THR 105.A OG1 ASP 171.A OD2 no hydrogen 2.609 N/A CYS 106.A N SER 102.A O no hydrogen 2.888 N/A CYS 106.A SG ALA 101.A O no hydrogen 3.982 N/A CYS 106.A SG SER 102.A O no hydrogen 3.447 N/A GLN 107.A N GLU 103.A O no hydrogen 2.961 N/A ALA 108.A N ARG 104.A O no hydrogen 3.257 N/A TRP 109.A N CYS 106.A O no hydrogen 3.252 N/A LYS 110.A N GLN 107.A O no hydrogen 2.989 N/A LYS 110.A NZ ASP 139.A O no hydrogen 3.031 N/A SER 111.A N ALA 108.A O no hydrogen 3.035 N/A ALA 114.A N SER 111.A OG no hydrogen 3.085 N/A VAL 115.A N SER 111.A O no hydrogen 2.950 N/A ARG 116.A N GLU 112.A O no hydrogen 3.191 N/A VAL 117.A N SER 113.A O no hydrogen 3.355 N/A VAL 118.A N ALA 114.A O no hydrogen 3.137 N/A GLU 119.A N VAL 115.A O no hydrogen 2.918 N/A ARG 120.A N ARG 116.A O no hydrogen 2.800 N/A LEU 121.A N VAL 117.A O no hydrogen 2.945 N/A ASN 122.A N VAL 118.A O no hydrogen 3.147 N/A ASN 122.A ND2 TYR 81.A O no hydrogen 2.951 N/A ASN 122.A ND2 VAL 118.A O no hydrogen 2.884 N/A ARG 123.A N GLU 119.A O no hydrogen 2.970 N/A GLN 124.A N ARG 120.A O no hydrogen 3.439 N/A GLN 124.A N LEU 121.A O no hydrogen 3.240 N/A LEU 125.A N ASN 122.A O no hydrogen 3.255 N/A LEU 126.A N ARG 123.A O no hydrogen 3.329 N/A ARG 127.A NH1 ASP 284.A OD1 no hydrogen 3.061 N/A ARG 127.A NH2 ASP 284.A OD1 no hydrogen 3.567 N/A ARG 127.A NH2 ASP 284.A OD2 no hydrogen 2.781 N/A GLN 130.A N ARG 127.A O no hydrogen 3.027 N/A CYS 136.A N PRO 88.A O no hydrogen 2.715 N/A CYS 136.A SG ALA 137.A O no hydrogen 3.328 N/A TRP 138.A NE1 GLU 119.A OE2 no hydrogen 2.935 N/A ALA 140.A N ALA 137.A O no hydrogen 2.945 N/A LEU 141.A N TRP 138.A O no hydrogen 3.362 N/A ARG 144.A N VAL 99.A O no hydrogen 2.717 N/A ARG 144.A NH1 GLU 150.A OE2 no hydrogen 3.031 N/A ARG 144.A NH2 GLU 150.A OE2 no hydrogen 3.017 N/A VAL 146.A N ALA 101.A O no hydrogen 2.785 N/A ALA 147.A N GLU 150.A OE1 no hydrogen 2.857 N/A GLY 149.A N VAL 162.A O no hydrogen 2.790 N/A GLU 150.A N ALA 147.A O no hydrogen 3.105 N/A LEU 152.A N LEU 160.A O no hydrogen 2.706 N/A LEU 154.A N HIS 158.A O no hydrogen 2.894 N/A GLY 155.A N HIS 158.A O no hydrogen 3.342 N/A ARG 157.A NE LEU 38.A O no hydrogen 3.227 N/A ARG 157.A NH2 LEU 38.A O no hydrogen 2.876 N/A HIS 158.A N GLY 155.A O no hydrogen 3.074 N/A LEU 160.A N LEU 152.A O no hydrogen 2.995 N/A GLN 161.A N TYR 176.A O no hydrogen 2.840 N/A GLN 161.A NE2 GLY 149.A O no hydrogen 3.051 N/A VAL 162.A N GLU 150.A O no hydrogen 2.866 N/A ILE 163.A N VAL 174.A O no hydrogen 2.919 N/A GLU 164.A N ASP 148.A OD1 no hydrogen 2.818 N/A ALA 165.A N HIS 172.A O no hydrogen 2.783 N/A GLY 167.A N SER 169.A O no hydrogen 3.107 N/A HIS 168.A ND1 LEU 202.A O no hydrogen 2.606 N/A SER 169.A OG ASP 171.A OD1 no hydrogen 2.451 N/A VAL 173.A N THR 77.A O no hydrogen 2.843 N/A VAL 174.A N ILE 163.A O no hydrogen 2.865 N/A PHE 175.A N PHE 184.A O no hydrogen 3.028 N/A TYR 176.A N GLN 161.A O no hydrogen 2.853 N/A ASP 177.A N ARG 182.A O no hydrogen 2.840 N/A ARG 180.A N ASP 177.A O no hydrogen 3.176 N/A ARG 180.A N ASP 177.A OD1 no hydrogen 3.131 N/A ARG 180.A NH1 ARG 157.A O no hydrogen 2.883 N/A ARG 180.A NH1 ASP 177.A OD1 no hydrogen 3.457 N/A ARG 180.A NH1 ASP 177.A OD2 no hydrogen 2.806 N/A ARG 180.A NH2 ARG 157.A O no hydrogen 2.955 N/A ARG 181.A NH1 THR 222.A O no hydrogen 2.928 N/A ARG 182.A N ASP 177.A O no hydrogen 3.288 N/A ARG 182.A NE GLN 225.A OE1 no hydrogen 2.779 N/A ARG 182.A NH1 ASP 22.A OD2 no hydrogen 2.853 N/A ARG 182.A NH2 ASP 20.A OD2 no hydrogen 2.908 N/A ARG 182.A NH2 ASP 22.A OD1 no hydrogen 2.780 N/A ARG 182.A NH2 GLN 225.A OE1 no hydrogen 3.386 N/A LEU 183.A N GLN 225.A O no hydrogen 2.922 N/A PHE 184.A N PHE 175.A O no hydrogen 2.860 N/A CYS 185.A N ILE 227.A O no hydrogen 2.946 N/A CYS 185.A SG GLY 186.A O no hydrogen 3.938 N/A ALA 188.A N CYS 185.A O no hydrogen 3.067 N/A GLY 190.A N ASP 187.A O no hydrogen 3.125 N/A GLU 191.A N ARG 200.A O no hydrogen 2.750 N/A ASP 193.A N VAL 198.A O no hydrogen 2.823 N/A GLU 194.A N GLN 281.A OE1 no hydrogen 2.894 N/A ALA 195.A N ASP 193.A OD1 no hydrogen 3.002 N/A GLU 196.A N ASP 193.A OD1 no hydrogen 2.940 N/A GLY 197.A N ASP 193.A O no hydrogen 2.835 N/A ARG 200.A N GLU 191.A O no hydrogen 2.726 N/A ARG 200.A NE ASP 193.A OD2 no hydrogen 2.859 N/A ARG 200.A NH1 GLU 191.A OE1 no hydrogen 2.827 N/A ARG 200.A NH2 ASP 193.A OD2 no hydrogen 3.224 N/A LEU 202.A N TYR 210.A OH no hydrogen 3.323 N/A ASP 205.A N GLY 167.A O no hydrogen 3.077 N/A ASP 206.A N GLY 167.A O no hydrogen 2.994 N/A ALA 209.A N ASP 206.A OD1 no hydrogen 2.833 N/A TYR 210.A N ASP 206.A O no hydrogen 3.062 N/A LEU 211.A N MET 207.A O no hydrogen 2.997 N/A GLU 212.A N GLU 208.A O no hydrogen 3.105 N/A SER 213.A N ALA 209.A O no hydrogen 2.849 N/A SER 213.A OG HIS 166.A O no hydrogen 2.785 N/A SER 213.A OG ALA 209.A O no hydrogen 2.851 N/A LEU 214.A N TYR 210.A O no hydrogen 3.331 N/A GLU 215.A N LEU 211.A O no hydrogen 2.891 N/A ARG 216.A N GLU 212.A O no hydrogen 2.977 N/A ARG 216.A NE GLU 212.A OE1 no hydrogen 3.098 N/A ARG 216.A NE GLU 212.A OE2 no hydrogen 2.844 N/A ARG 216.A NH1 GLU 164.A O no hydrogen 2.832 N/A ARG 216.A NH2 GLU 164.A O no hydrogen 2.947 N/A ARG 216.A NH2 GLU 212.A OE1 no hydrogen 2.986 N/A LEU 217.A N SER 213.A O no hydrogen 2.860 N/A GLN 218.A N LEU 214.A O no hydrogen 2.814 N/A GLN 218.A NE2 LEU 214.A O no hydrogen 3.554 N/A ARG 219.A N ARG 216.A O no hydrogen 3.237 N/A LEU 220.A N LEU 217.A O no hydrogen 3.104 N/A LEU 224.A N ARG 181.A O no hydrogen 2.747 N/A GLN 225.A N ARG 181.A O no hydrogen 3.120 N/A GLN 225.A NE2 ASP 20.A OD2 no hydrogen 3.052 N/A LEU 226.A N LEU 234.A O no hydrogen 2.942 N/A ILE 227.A N LEU 183.A O no hydrogen 2.784 N/A GLY 229.A N GLY 186.A O no hydrogen 2.818 N/A HIS 230.A ND1 GLN 30.A O no hydrogen 2.805 N/A GLY 231.A N VAL 29.A O no hydrogen 2.867 N/A LEU 233.A N LEU 13.A O no hydrogen 3.002 N/A LEU 234.A N LEU 226.A O no hydrogen 2.835 N/A ARG 235.A N LEU 11.A O no hydrogen 2.933 N/A ARG 235.A NE MET 10.A O no hydrogen 2.785 N/A ARG 235.A NH2 MET 10.A O no hydrogen 2.850 N/A ALA 239.A N GLY 236.A O no hydrogen 3.120 N/A ALA 240.A N GLY 236.A O no hydrogen 3.117 N/A ASP 241.A N ARG 237.A O no hydrogen 2.891 N/A GLY 242.A N ALA 239.A O no hydrogen 3.173 N/A SER 245.A N ASP 241.A O no hydrogen 2.898 N/A SER 245.A OG ASP 241.A O no hydrogen 2.758 N/A SER 245.A OG ASP 241.A OD1 no hydrogen 3.175 N/A ALA 246.A N GLY 242.A O no hydrogen 2.909 N/A TYR 247.A N ALA 243.A O no hydrogen 3.029 N/A THR 248.A N GLU 244.A O no hydrogen 3.115 N/A THR 248.A OG1 SER 245.A O no hydrogen 3.148 N/A GLU 249.A N SER 245.A O no hydrogen 2.924 N/A CYS 250.A N ALA 246.A O no hydrogen 3.168 N/A LEU 251.A N TYR 247.A O no hydrogen 3.104 N/A ARG 252.A N THR 248.A O no hydrogen 2.892 N/A LEU 253.A N GLU 249.A O no hydrogen 3.045 N/A CYS 254.A N CYS 250.A O no hydrogen 3.041 N/A CYS 254.A SG CYS 250.A O no hydrogen 3.399 N/A ARG 255.A N LEU 251.A O no hydrogen 2.929 N/A ARG 256.A N ARG 252.A O no hydrogen 3.098 N/A LEU 257.A N LEU 253.A O no hydrogen 2.951 N/A LEU 258.A N CYS 254.A O no hydrogen 2.916 N/A TRP 259.A N ARG 255.A O no hydrogen 2.768 N/A ARG 260.A N ARG 256.A O no hydrogen 3.025 N/A ARG 260.A NH1 GLU 265.A OE1 no hydrogen 2.727 N/A GLN 261.A N LEU 257.A O no hydrogen 2.914 N/A GLN 261.A NE2 SER 303.A OG no hydrogen 3.394 N/A SER 262.A N LEU 258.A O no hydrogen 3.086 N/A MET 263.A N TRP 259.A O no hydrogen 3.223 N/A GLY 264.A N GLN 261.A O no hydrogen 2.809 N/A GLU 265.A N ARG 260.A O no hydrogen 3.013 N/A SER 266.A N GLU 269.A OE2 no hydrogen 2.897 N/A ASP 268.A N SER 266.A OG no hydrogen 3.090 N/A GLU 269.A N SER 266.A O no hydrogen 2.939 N/A SER 271.A N LEU 267.A O no hydrogen 3.066 N/A SER 271.A OG LEU 267.A O no hydrogen 3.096 N/A GLU 272.A N ASP 268.A O no hydrogen 2.987 N/A GLU 273.A N GLU 269.A O no hydrogen 3.209 N/A LEU 274.A N LEU 270.A O no hydrogen 2.783 N/A HIS 275.A N SER 271.A O no hydrogen 2.884 N/A ARG 276.A N GLU 272.A O no hydrogen 2.905 N/A ARG 276.A NH1 GLU 273.A OE1 no hydrogen 3.035 N/A ALA 277.A N GLU 273.A O no hydrogen 2.949 N/A TRP 278.A N LEU 274.A O no hydrogen 2.789 N/A GLY 279.A N HIS 275.A O no hydrogen 2.839 N/A GLN 281.A NE2 PHE 192.A O no hydrogen 2.856 N/A PHE 285.A N SER 282.A O no hydrogen 2.910 N/A HIS 291.A N PRO 287.A O no hydrogen 2.995 N/A LEU 292.A N GLY 288.A O no hydrogen 3.096 N/A GLY 293.A N GLU 289.A O no hydrogen 3.141 N/A SER 294.A N LEU 290.A O no hydrogen 2.845 N/A SER 294.A OG LEU 290.A O no hydrogen 3.514 N/A SER 294.A OG HIS 291.A O no hydrogen 2.730 N/A MET 295.A N HIS 291.A O no hydrogen 2.781 N/A ARG 296.A N LEU 292.A O no hydrogen 2.869 N/A ARG 296.A NE ASP 268.A OD1 no hydrogen 2.892 N/A ARG 296.A NH2 ASP 268.A OD1 no hydrogen 3.556 N/A ARG 297.A N GLY 293.A O no hydrogen 2.982 N/A MET 298.A N SER 294.A O no hydrogen 2.946 N/A LEU 299.A N MET 295.A O no hydrogen 3.076 N/A GLU 300.A N ARG 296.A O no hydrogen 2.913 N/A ILE 301.A N ARG 297.A O no hydrogen 3.066 N/A LEU 302.A N MET 298.A O no hydrogen 2.999 N/A SER 303.A N LEU 299.A O no hydrogen 2.882 N/A SER 303.A OG GLN 261.A OE1 no hydrogen 3.273 N/A ARG 304.A N GLU 300.A O no hydrogen 3.328 N/A ARG 304.A N ILE 301.A O no hydrogen 3.208 N/A GLN 305.A N ILE 301.A O no hydrogen 2.977 N/A GLN 305.A N LEU 302.A O no hydrogen 3.135 N/A ALA 306.A N LEU 302.A O no hydrogen 2.724 N/A