Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q8h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N VAL 2.A O no hydrogen 3.108 N/A ASP 7.A N PRO 3.A O no hydrogen 2.797 N/A PHE 8.A N GLY 4.A O no hydrogen 2.961 N/A TYR 9.A N GLN 5.A O no hydrogen 3.174 N/A ALA 10.A N VAL 6.A O no hydrogen 2.911 N/A PHE 12.A N TYR 9.A O no hydrogen 3.187 N/A SER 13.A OG PRO 14.A O no hydrogen 2.821 N/A SER 15.A N GLU 39.A OE2 no hydrogen 2.734 N/A LEU 17.A N GLU 342.A OE1 no hydrogen 2.759 N/A SER 18.A N GLN 21.A OE1 no hydrogen 2.841 N/A MET 19.A N SER 340.A O no hydrogen 2.727 N/A GLN 21.A N SER 18.A OG no hydrogen 2.884 N/A PHE 22.A N SER 18.A O no hydrogen 3.051 N/A LEU 23.A N MET 19.A O no hydrogen 3.056 N/A ASP 24.A N LYS 20.A O no hydrogen 3.058 N/A PHE 25.A N GLN 21.A O no hydrogen 3.120 N/A SER 27.A N PHE 25.A O no hydrogen 3.026 N/A CYS 28.A SG PHE 25.A O no hydrogen 3.856 N/A LYS 30.A NZ GLU 87.A OE2 no hydrogen 3.534 N/A THR 31.A N CYS 28.A O no hydrogen 3.075 N/A SER 32.A OG HIS 153.A ND1 no hydrogen 2.807 N/A PHE 33.A N GLU 29.A O no hydrogen 3.125 N/A MET 34.A N LYS 30.A O no hydrogen 3.363 N/A LEU 36.A N SER 32.A O no hydrogen 2.773 N/A ARG 37.A N PHE 33.A O no hydrogen 2.890 N/A GLU 39.A N PHE 35.A O no hydrogen 2.853 N/A LEU 40.A N LEU 36.A O no hydrogen 2.876 N/A VAL 42.A N GLN 38.A O no hydrogen 3.085 N/A ARG 43.A N GLU 39.A O no hydrogen 2.888 N/A ARG 43.A NE GLU 39.A OE2 no hydrogen 2.765 N/A ARG 43.A NH1 GLU 342.A OE2 no hydrogen 2.892 N/A ARG 43.A NH2 SER 15.A O no hydrogen 3.093 N/A ARG 43.A NH2 GLU 39.A OE2 no hydrogen 3.366 N/A ARG 43.A NH2 GLU 342.A OE1 no hydrogen 2.937 N/A LEU 44.A N LEU 40.A O no hydrogen 2.853 N/A ALA 45.A N PRO 41.A O no hydrogen 2.847 N/A ASN 46.A N VAL 42.A O no hydrogen 2.990 N/A ASN 46.A ND2 PHE 12.A O no hydrogen 2.950 N/A ASN 46.A ND2 VAL 42.A O no hydrogen 2.727 N/A ILE 47.A N ARG 43.A O no hydrogen 3.364 N/A MET 48.A N LEU 44.A O no hydrogen 2.965 N/A LYS 49.A N ALA 45.A O no hydrogen 3.206 N/A LYS 49.A NZ ASP 7.A OD1 no hydrogen 2.942 N/A GLU 50.A N ILE 47.A O no hydrogen 2.969 N/A ILE 51.A N ILE 47.A O no hydrogen 3.123 N/A SER 52.A N MET 48.A O no hydrogen 3.348 N/A SER 52.A OG MET 48.A O no hydrogen 3.172 N/A LEU 53.A N GLU 50.A O no hydrogen 2.888 N/A LEU 54.A N ILE 51.A O no hydrogen 3.098 N/A LEU 58.A N PRO 55.A O no hydrogen 2.842 N/A LEU 59.A N PRO 55.A O no hydrogen 2.813 N/A ARG 60.A N ASP 56.A O no hydrogen 2.802 N/A ARG 60.A NE ASP 56.A OD1 no hydrogen 3.135 N/A ARG 60.A NH2 ASP 56.A OD1 no hydrogen 3.416 N/A THR 61.A N LEU 58.A O no hydrogen 3.136 N/A THR 61.A OG1 LEU 58.A O no hydrogen 2.732 N/A SER 63.A N GLU 119.A OE2 no hydrogen 3.003 N/A SER 63.A OG GLU 119.A OE1 no hydrogen 2.521 N/A SER 63.A OG GLU 119.A OE2 no hydrogen 3.026 N/A GLN 65.A N THR 61.A O no hydrogen 3.006 N/A GLN 65.A NE2 LEU 59.A O no hydrogen 2.911 N/A GLN 65.A NE2 GLN 68.A OE1 no hydrogen 3.531 N/A LEU 66.A N PRO 62.A O no hydrogen 2.870 N/A VAL 67.A N SER 63.A O no hydrogen 2.971 N/A GLN 68.A N VAL 64.A O no hydrogen 2.820 N/A SER 69.A N GLN 65.A O no hydrogen 3.017 N/A SER 69.A OG LEU 66.A O no hydrogen 2.702 N/A TRP 70.A N LEU 66.A O no hydrogen 3.087 N/A TRP 70.A N VAL 67.A O no hydrogen 3.143 N/A TYR 71.A N VAL 67.A O no hydrogen 3.089 N/A ILE 72.A N GLN 68.A O no hydrogen 2.949 N/A GLN 73.A N SER 69.A O no hydrogen 2.981 N/A SER 74.A N TRP 70.A O no hydrogen 2.892 N/A SER 74.A OG TRP 70.A O no hydrogen 2.885 N/A LEU 75.A N TYR 71.A O no hydrogen 2.938 N/A GLN 76.A N ILE 72.A O no hydrogen 3.139 N/A GLU 77.A N GLN 73.A O no hydrogen 3.169 N/A GLU 77.A N SER 74.A O no hydrogen 3.193 N/A LEU 78.A N SER 74.A O no hydrogen 3.098 N/A LEU 79.A N LEU 75.A O no hydrogen 2.919 N/A ASP 80.A N GLU 77.A O no hydrogen 3.437 N/A PHE 81.A N LEU 78.A O no hydrogen 3.128 N/A GLU 87.A N SER 85.A OG no hydrogen 3.154 N/A ASP 88.A N SER 85.A O no hydrogen 3.074 N/A ALA 91.A N ASP 88.A OD2 no hydrogen 2.922 N/A TYR 93.A N ALA 89.A O no hydrogen 3.140 N/A ASP 94.A N LYS 90.A O no hydrogen 2.749 N/A PHE 95.A N ALA 91.A O no hydrogen 2.752 N/A THR 96.A N ILE 92.A O no hydrogen 2.912 N/A THR 96.A OG1 GLU 29.A OE2 no hydrogen 2.512 N/A THR 96.A OG1 ILE 92.A O no hydrogen 3.112 N/A THR 96.A OG1 HIS 153.A NE2 no hydrogen 2.958 N/A ASP 97.A N TYR 93.A O no hydrogen 2.912 N/A THR 98.A N ASP 94.A O no hydrogen 2.849 N/A THR 98.A OG1 ASP 94.A O no hydrogen 2.647 N/A VAL 99.A N PHE 95.A O no hydrogen 2.769 N/A ILE 100.A N THR 96.A O no hydrogen 3.028 N/A ARG 101.A N ASP 97.A O no hydrogen 2.716 N/A ARG 101.A NH1 GLU 77.A OE1 no hydrogen 3.089 N/A ILE 102.A N THR 98.A O no hydrogen 2.857 N/A ARG 103.A N VAL 99.A O no hydrogen 2.899 N/A ARG 103.A NE ASN 104.A OD1 no hydrogen 2.764 N/A ARG 103.A NH1 ASN 151.A OD1 no hydrogen 3.170 N/A ASN 104.A N ILE 100.A O no hydrogen 3.106 N/A ARG 105.A NH1 GLU 77.A OE2 no hydrogen 2.697 N/A ARG 105.A NH2 GLU 77.A OE2 no hydrogen 3.535 N/A THR 112.A N ASP 108.A O no hydrogen 3.073 N/A THR 112.A OG1 ASP 108.A O no hydrogen 2.721 N/A MET 113.A N VAL 109.A O no hydrogen 2.795 N/A ALA 114.A N ILE 110.A O no hydrogen 3.172 N/A GLN 115.A N PRO 111.A O no hydrogen 2.897 N/A GLY 116.A N THR 112.A O no hydrogen 3.061 N/A VAL 117.A N MET 113.A O no hydrogen 3.113 N/A ILE 118.A N ALA 114.A O no hydrogen 3.257 N/A GLU 119.A N GLN 115.A O no hydrogen 2.782 N/A TYR 120.A N GLY 116.A O no hydrogen 2.840 N/A LYS 121.A N VAL 117.A O no hydrogen 2.961 N/A LYS 121.A NZ MET 279.A O no hydrogen 2.655 N/A GLU 122.A N ILE 118.A O no hydrogen 2.900 N/A SER 123.A N GLU 119.A O no hydrogen 3.349 N/A THR 128.A OG1 ASP 125.A OD2 no hydrogen 2.605 N/A SER 129.A N ASP 125.A O no hydrogen 3.254 N/A SER 129.A OG ASP 125.A O no hydrogen 2.622 N/A ASN 131.A ND2 TYR 355.A O no hydrogen 2.861 N/A VAL 132.A N THR 128.A O no hydrogen 2.970 N/A GLN 133.A N SER 129.A O no hydrogen 3.176 N/A GLN 133.A NE2 PHE 276.A O no hydrogen 3.000 N/A TYR 134.A N GLN 130.A O no hydrogen 3.149 N/A PHE 135.A N ASN 131.A O no hydrogen 2.844 N/A LEU 136.A N VAL 132.A O no hydrogen 2.926 N/A ASP 137.A N GLN 133.A O no hydrogen 3.247 N/A ARG 138.A N TYR 134.A O no hydrogen 3.297 N/A ARG 138.A NE GLU 50.A OE1 no hydrogen 3.312 N/A ARG 138.A NE GLU 50.A OE2 no hydrogen 2.789 N/A ARG 138.A NH2 GLU 50.A OE1 no hydrogen 2.827 N/A ARG 138.A NH2 VAL 346.A O no hydrogen 2.863 N/A PHE 139.A N PHE 135.A O no hydrogen 2.682 N/A TYR 140.A N LEU 136.A O no hydrogen 2.983 N/A TYR 140.A OH ILE 110.A O no hydrogen 2.944 N/A MET 141.A N ASP 137.A O no hydrogen 2.941 N/A SER 142.A N ARG 138.A O no hydrogen 2.775 N/A ARG 143.A N PHE 139.A O no hydrogen 2.869 N/A ARG 143.A NH2 HIS 106.A O no hydrogen 3.300 N/A ILE 144.A N TYR 140.A O no hydrogen 2.974 N/A SER 145.A N MET 141.A O no hydrogen 3.037 N/A SER 145.A OG SER 142.A O no hydrogen 2.692 N/A ILE 146.A N SER 142.A O no hydrogen 2.875 N/A ARG 147.A N ARG 143.A O no hydrogen 2.899 N/A ARG 147.A NH1 ARG 103.A O no hydrogen 2.786 N/A ARG 147.A NH2 ARG 103.A O no hydrogen 2.948 N/A MET 148.A N ILE 144.A O no hydrogen 2.899 N/A LEU 149.A N SER 145.A O no hydrogen 3.282 N/A LEU 150.A N ILE 146.A O no hydrogen 3.035 N/A ASN 151.A N ARG 147.A O no hydrogen 2.704 N/A GLN 152.A N MET 148.A O no hydrogen 2.890 N/A GLN 152.A NE2 ILE 160.A O no hydrogen 3.184 N/A HIS 153.A N LEU 149.A O no hydrogen 3.144 N/A HIS 153.A ND1 SER 32.A OG no hydrogen 2.807 N/A HIS 153.A NE2 THR 96.A OG1 no hydrogen 2.958 N/A SER 154.A N LEU 150.A O no hydrogen 2.967 N/A SER 154.A OG LEU 150.A O no hydrogen 2.874 N/A LEU 155.A N ASN 151.A O no hydrogen 3.017 N/A LEU 156.A N GLN 152.A O no hydrogen 2.999 N/A PHE 157.A N HIS 153.A O no hydrogen 3.198 N/A ILE 160.A N ILE 163.A O no hydrogen 2.717 N/A SER 162.A N GLN 152.A OE1 no hydrogen 2.717 N/A SER 162.A OG GLN 152.A OE1 no hydrogen 3.015 N/A ILE 163.A N ILE 160.A O no hydrogen 3.090 N/A ASN 164.A N TYR 212.A O no hydrogen 2.890 N/A ASN 166.A N ASN 164.A OD1 no hydrogen 2.863 N/A CYS 167.A N VAL 210.A O no hydrogen 2.844 N/A VAL 169.A N ILE 208.A O no hydrogen 3.455 N/A GLU 171.A N ASN 168.A OD1 no hydrogen 3.203 N/A VAL 172.A N ASN 168.A O no hydrogen 3.168 N/A ILE 173.A N VAL 169.A O no hydrogen 3.014 N/A LYS 174.A N LEU 170.A O no hydrogen 2.842 N/A ASP 175.A N GLU 171.A O no hydrogen 3.094 N/A GLY 176.A N VAL 172.A O no hydrogen 2.906 N/A TYR 177.A N ILE 173.A O no hydrogen 2.815 N/A TYR 177.A OH PRO 192.A O no hydrogen 2.615 N/A GLU 178.A N LYS 174.A O no hydrogen 2.951 N/A ASN 179.A N ASP 175.A O no hydrogen 3.078 N/A ASN 179.A ND2 TYR 218.A OH no hydrogen 2.736 N/A ALA 180.A N GLY 176.A O no hydrogen 3.040 N/A ARG 181.A N TYR 177.A O no hydrogen 2.821 N/A ARG 181.A NE SER 191.A OG no hydrogen 2.930 N/A ARG 181.A NH1 GLU 193.A OE1 no hydrogen 2.947 N/A ARG 181.A NH2 GLU 193.A OE2 no hydrogen 2.965 N/A ARG 182.A N GLU 178.A O no hydrogen 3.109 N/A LEU 183.A N ASN 179.A O no hydrogen 3.478 N/A CYS 184.A N ALA 180.A O no hydrogen 2.903 N/A CYS 184.A SG ASN 190.A O no hydrogen 3.460 N/A ASP 185.A N ARG 181.A O no hydrogen 2.812 N/A LEU 186.A N ARG 182.A O no hydrogen 2.997 N/A TYR 187.A N LEU 183.A O no hydrogen 3.091 N/A TYR 187.A N CYS 184.A O no hydrogen 3.211 N/A TYR 188.A N CYS 184.A O no hydrogen 2.813 N/A TYR 188.A OH GLU 234.A OE2 no hydrogen 2.909 N/A ILE 189.A N ASP 185.A O no hydrogen 2.933 N/A SER 191.A N ASN 190.A OD1 no hydrogen 2.679 N/A SER 191.A OG ASP 185.A OD1 no hydrogen 2.567 N/A GLU 195.A N ILE 245.A O no hydrogen 2.948 N/A GLU 197.A N VAL 247.A O no hydrogen 2.908 N/A LEU 199.A N VAL 249.A O no hydrogen 2.748 N/A ASN 200.A ND2 GLN 206.A O no hydrogen 3.142 N/A ASN 200.A ND2 PRO 207.A O no hydrogen 3.445 N/A ALA 201.A N LEU 251.A O no hydrogen 3.016 N/A LYS 202.A N LEU 251.A O no hydrogen 3.224 N/A SER 203.A N ASN 200.A OD1 no hydrogen 2.676 N/A GLN 206.A N SER 203.A O no hydrogen 3.164 N/A VAL 210.A N CYS 167.A O no hydrogen 3.385 N/A TYR 212.A N ASN 164.A O no hydrogen 3.116 N/A HIS 216.A N VAL 213.A O no hydrogen 3.041 N/A LEU 217.A N VAL 213.A O no hydrogen 3.240 N/A TYR 218.A N PRO 214.A O no hydrogen 2.774 N/A HIS 219.A N SER 215.A O no hydrogen 2.929 N/A MET 220.A N HIS 216.A O no hydrogen 3.210 N/A VAL 221.A N LEU 217.A O no hydrogen 3.098 N/A PHE 222.A N TYR 218.A O no hydrogen 2.855 N/A GLU 223.A N HIS 219.A O no hydrogen 2.994 N/A LEU 224.A N MET 220.A O no hydrogen 3.035 N/A PHE 225.A N VAL 221.A O no hydrogen 2.871 N/A LYS 226.A N PHE 222.A O no hydrogen 3.095 N/A LYS 226.A NZ GLU 223.A OE1 no hydrogen 3.227 N/A LYS 226.A NZ GLU 223.A OE2 no hydrogen 2.891 N/A ASN 227.A N GLU 223.A O no hydrogen 3.166 N/A ALA 228.A N LEU 224.A O no hydrogen 2.853 N/A MET 229.A N PHE 225.A O no hydrogen 2.730 N/A ARG 230.A N LYS 226.A O no hydrogen 2.920 N/A ARG 230.A NH2 ASN 227.A OD1 no hydrogen 3.027 N/A ALA 231.A N ASN 227.A O no hydrogen 3.165 N/A THR 232.A N ALA 228.A O no hydrogen 2.985 N/A THR 232.A OG1 ALA 228.A O no hydrogen 2.740 N/A MET 233.A N MET 229.A O no hydrogen 2.825 N/A GLU 234.A N ARG 230.A O no hydrogen 2.995 N/A HIS 235.A N ALA 231.A O no hydrogen 3.073 N/A HIS 236.A N THR 232.A O no hydrogen 3.175 N/A HIS 236.A NE2 ARG 263.A O no hydrogen 2.641 N/A ARG 239.A NH1 HIS 235.A O no hydrogen 2.886 N/A GLY 240.A N HIS 236.A O no hydrogen 3.125 N/A ILE 245.A N GLU 193.A O no hydrogen 2.879 N/A GLN 246.A N SER 261.A O no hydrogen 2.973 N/A GLN 246.A NE2 GLU 195.A OE1 no hydrogen 2.846 N/A VAL 247.A N GLU 195.A O no hydrogen 2.811 N/A HIS 248.A N LYS 259.A O no hydrogen 2.888 N/A VAL 249.A N GLU 197.A O no hydrogen 2.992 N/A THR 250.A N THR 257.A O no hydrogen 2.966 N/A LEU 251.A N LEU 199.A O no hydrogen 2.949 N/A GLY 252.A N ASP 255.A O no hydrogen 2.813 N/A LEU 256.A N ILE 333.A O no hydrogen 2.782 N/A THR 257.A N THR 250.A O no hydrogen 2.796 N/A THR 257.A OG1 THR 250.A O no hydrogen 3.548 N/A VAL 258.A N ILE 331.A O no hydrogen 2.956 N/A LYS 259.A N HIS 248.A O no hydrogen 2.870 N/A MET 260.A N ALA 329.A O no hydrogen 2.718 N/A SER 261.A N GLN 246.A O no hydrogen 2.752 N/A SER 261.A OG ASP 328.A OD1 no hydrogen 2.512 N/A ASP 262.A N THR 327.A O no hydrogen 2.940 N/A GLY 264.A N ASP 262.A OD1 no hydrogen 2.840 N/A GLY 265.A N TYR 325.A O no hydrogen 3.142 N/A VAL 267.A N SER 321.A OG no hydrogen 2.883 N/A LYS 271.A N PRO 268.A O no hydrogen 2.928 N/A ILE 272.A N PRO 268.A O no hydrogen 3.199 N/A ARG 274.A N LYS 271.A O no hydrogen 2.968 N/A LEU 275.A N ILE 272.A O no hydrogen 3.175 N/A PHE 276.A N ASP 273.A O no hydrogen 2.864 N/A ASN 277.A N ARG 274.A O no hydrogen 3.124 N/A TYR 278.A N GLN 133.A OE1 no hydrogen 2.981 N/A TYR 278.A OH ASP 137.A OD1 no hydrogen 2.713 N/A TYR 280.A N ASN 277.A OD1 no hydrogen 2.902 N/A SER 281.A N ASN 277.A O no hydrogen 2.778 N/A SER 281.A OG ARG 274.A O no hydrogen 3.177 N/A SER 281.A OG ASN 277.A O no hydrogen 2.730 N/A THR 282.A OG1 TYR 278.A O no hydrogen 2.669 N/A THR 282.A OG1 TYR 301.A OH no hydrogen 2.578 N/A ARG 285.A NH1 GLN 115.A OE1 no hydrogen 3.237 N/A THR 290.A N VAL 288.A O no hydrogen 2.825 N/A ARG 292.A N THR 290.A OG1 no hydrogen 3.057 N/A TYR 301.A OH THR 282.A OG1 no hydrogen 2.578 N/A ILE 305.A N TYR 301.A O no hydrogen 2.931 N/A SER 306.A N GLY 302.A O no hydrogen 2.912 N/A SER 306.A OG HIS 219.A ND1.A no hydrogen 3.158 N/A SER 306.A OG GLY 302.A O no hydrogen 2.808 N/A ARG 307.A N LEU 303.A O no hydrogen 3.016 N/A LEU 308.A N PRO 304.A O no hydrogen 3.152 N/A TYR 309.A N ILE 305.A O no hydrogen 2.938 N/A ALA 310.A N SER 306.A O no hydrogen 3.047 N/A GLN 311.A N ARG 307.A O no hydrogen 2.912 N/A GLN 311.A NE2 ASP 316.A OD1 no hydrogen 2.831 N/A TYR 312.A N LEU 308.A O no hydrogen 2.811 N/A TYR 312.A OH GLU 342.A OE2 no hydrogen 2.570 N/A GLN 314.A N GLN 311.A O no hydrogen 2.998 N/A GLN 314.A NE2 ILE 341.A O no hydrogen 3.213 N/A GLY 315.A N ALA 310.A O no hydrogen 2.896 N/A ASP 316.A N TYR 332.A O no hydrogen 2.924 N/A LEU 317.A N ASP 316.A OD1 no hydrogen 2.862 N/A LYS 318.A N VAL 330.A O no hydrogen 2.953 N/A TYR 320.A N.A ASP 328.A O no hydrogen 2.771 N/A TYR 320.A N.B ASP 328.A O no hydrogen 2.740 N/A LEU 322.A N GLY 326.A O no hydrogen 2.772 N/A GLY 324.A N GLY 265.A O no hydrogen 2.680 N/A TYR 325.A N LEU 322.A O no hydrogen 2.909 N/A GLY 326.A N LEU 322.A O no hydrogen 3.209 N/A THR 327.A N ASP 262.A O no hydrogen 3.097 N/A ASP 328.A N TYR 320.A O.A no hydrogen 2.884 N/A ASP 328.A N TYR 320.A O.B no hydrogen 2.838 N/A ALA 329.A N MET 260.A O no hydrogen 2.845 N/A VAL 330.A N LYS 318.A O no hydrogen 2.759 N/A ILE 331.A N VAL 258.A O no hydrogen 2.756 N/A TYR 332.A N ASP 316.A O no hydrogen 2.772 N/A ILE 333.A N LEU 256.A O no hydrogen 2.873 N/A ALA 335.A N GLU 254.A O no hydrogen 2.781 N/A ASP 339.A N LEU 336.A O no hydrogen 3.048 N/A SER 340.A N SER 337.A O no hydrogen 3.104 N/A SER 340.A OG LEU 336.A O no hydrogen 3.148 N/A GLU 342.A N LEU 17.A O no hydrogen 2.973 N/A ARG 343.A N TYR 312.A O no hydrogen 2.713 N/A TYR 347.A N ASN 46.A OD1 no hydrogen 2.948 N/A ALA 351.A N ASN 348.A OD1 no hydrogen 3.143 N/A TRP 352.A N ASN 348.A O no hydrogen 2.974 N/A LYS 353.A N LYS 349.A O no hydrogen 2.945 N/A HIS 354.A N ALA 350.A O no hydrogen 3.263 N/A TYR 355.A N TRP 352.A O no hydrogen 3.197 N/A TYR 355.A OH GLU 50.A OE2 no hydrogen 2.701 N/A ASN 356.A N LYS 353.A O no hydrogen 3.128 N/A TRP 362.A N ALA 359.A O no hydrogen 3.408 N/A