Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hgq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N TYR 5.A OH no hydrogen 3.004 N/A TYR 5.A N ILE 197.A O no hydrogen 2.851 N/A TRP 6.A NE1 PRO 270.A O no hydrogen 2.813 N/A LEU 7.A N ARG 199.A O no hydrogen 2.683 N/A THR 9.A N VAL 201.A O no hydrogen 2.653 N/A THR 9.A OG1 THR 10.A O no hydrogen 3.339 N/A SER 11.A N GLN 14.A OE1 no hydrogen 2.816 N/A SER 11.A OG GLN 14.A OE1 no hydrogen 3.191 N/A SER 11.A OG ASN 82.A O no hydrogen 3.295 N/A GLN 14.A N SER 11.A OG no hydrogen 2.996 N/A GLN 14.A NE2 VAL 55.A O no hydrogen 2.886 N/A LYS 15.A N SER 11.A O no hydrogen 2.902 N/A GLU 16.A N LEU 12.A O no hydrogen 3.009 N/A LEU 17.A N TYR 13.A O no hydrogen 2.859 N/A THR 18.A N GLN 14.A O no hydrogen 3.147 N/A THR 18.A OG1 GLN 14.A O no hydrogen 3.023 N/A ASP 19.A N LYS 15.A O no hydrogen 2.907 N/A GLN 20.A N GLU 16.A O no hydrogen 2.951 N/A ILE 21.A N LEU 17.A O no hydrogen 2.841 N/A VAL 22.A N THR 18.A O no hydrogen 2.872 N/A SER 23.A N ASP 19.A O no hydrogen 3.100 N/A SER 23.A OG ASP 19.A O no hydrogen 3.549 N/A SER 23.A OG GLU 289.A OE2 no hydrogen 3.228 N/A LEU 24.A N GLN 20.A O no hydrogen 2.864 N/A HIS 25.A N ILE 21.A O no hydrogen 3.329 N/A HIS 25.A ND1 SER 46.A OG no hydrogen 2.930 N/A TYR 26.A N SER 23.A O no hydrogen 3.100 N/A ILE 29.A N HIS 25.A O no hydrogen 2.776 N/A LEU 30.A N TYR 26.A O no hydrogen 3.254 N/A ARG 31.A N SER 27.A O no hydrogen 2.984 N/A TYR 32.A N ASP 28.A O no hydrogen 2.946 N/A PHE 33.A N ILE 29.A O no hydrogen 3.142 N/A PHE 33.A N LEU 30.A O no hydrogen 3.339 N/A GLU 34.A N LEU 30.A O no hydrogen 2.861 N/A THR 35.A OG1 ARG 31.A O no hydrogen 3.506 N/A SER 36.A N GLU 34.A O no hydrogen 2.624 N/A TYR 38.A N SER 36.A O no hydrogen 2.664 N/A LYS 39.A N THR 35.A O no hydrogen 3.405 N/A LEU 44.A N GLU 40.A O no hydrogen 3.038 N/A GLU 45.A N ASP 41.A O no hydrogen 2.970 N/A SER 46.A N VAL 42.A O no hydrogen 3.000 N/A SER 46.A OG HIS 25.A ND1 no hydrogen 2.930 N/A SER 46.A OG ASP 28.A OD2 no hydrogen 2.663 N/A THR 48.A N GLU 45.A O no hydrogen 2.872 N/A THR 48.A OG1 GLU 45.A O no hydrogen 3.390 N/A LEU 50.A N LYS 47.A O no hydrogen 2.948 N/A ASN 51.A N THR 48.A O no hydrogen 2.822 N/A SER 53.A N CYS 49.A O no hydrogen 2.964 N/A SER 53.A OG CYS 49.A O no hydrogen 3.242 N/A LEU 54.A N LEU 50.A O no hydrogen 3.027 N/A VAL 55.A N ASN 51.A O no hydrogen 3.206 N/A ALA 56.A N GLY 52.A O no hydrogen 3.016 N/A THR 57.A N LEU 54.A O no hydrogen 3.006 N/A HIS 58.A N LEU 54.A O no hydrogen 2.768 N/A LEU 61.A N HIS 58.A O no hydrogen 2.920 N/A LEU 62.A N PRO 59.A O no hydrogen 2.919 N/A ILE 63.A N PRO 59.A O no hydrogen 2.883 N/A ILE 71.A N SER 69.A OG no hydrogen 3.351 N/A THR 72.A OG1 ASP 74.A OD1 no hydrogen 2.659 N/A VAL 75.A N THR 72.A O no hydrogen 3.272 N/A HIS 78.A N ASP 74.A O no hydrogen 3.165 N/A LEU 79.A N VAL 75.A O no hydrogen 2.851 N/A ALA 80.A N PRO 76.A O no hydrogen 3.198 N/A GLU 81.A N ALA 77.A O no hydrogen 2.917 N/A ASN 82.A N LEU 79.A O no hydrogen 3.129 N/A SER 83.A N ALA 80.A O no hydrogen 3.400 N/A SER 83.A OG THR 57.A O no hydrogen 2.734 N/A GLY 84.A N GLN 14.A OE1 no hydrogen 3.203 N/A LYS 85.A NZ LEU 173.A O no hydrogen 2.880 N/A LYS 85.A NZ ASP 207.A OD2 no hydrogen 2.689 N/A PHE 86.A N SER 83.A OG no hydrogen 3.139 N/A SER 87.A N SER 83.A O no hydrogen 2.916 N/A VAL 88.A N GLY 84.A O no hydrogen 2.869 N/A LEU 89.A N LYS 85.A O no hydrogen 2.898 N/A ARG 90.A N PHE 86.A O no hydrogen 2.843 N/A ASP 91.A N SER 87.A O no hydrogen 3.003 N/A LEU 92.A N VAL 88.A O no hydrogen 2.757 N/A ILE 93.A N LEU 89.A O no hydrogen 2.757 N/A ASN 94.A N ARG 90.A O no hydrogen 2.879 N/A LEU 95.A N LEU 92.A O no hydrogen 2.804 N/A VAL 96.A N LEU 92.A O no hydrogen 3.124 N/A GLN 97.A N ILE 93.A O no hydrogen 2.891 N/A GLU 98.A N LEU 95.A O no hydrogen 3.068 N/A TYR 99.A N VAL 96.A O no hydrogen 3.171 N/A TYR 99.A OH GLU 261.A OE2 no hydrogen 2.996 N/A THR 101.A N SER 144.A O no hydrogen 3.243 N/A THR 101.A OG1 ASP 169.A OD1 no hydrogen 2.951 N/A THR 103.A N THR 146.A O no hydrogen 2.846 N/A ILE 105.A N HIS 148.A O no hydrogen 2.815 N/A VAL 106.A N ILE 171.A O no hydrogen 2.900 N/A CYS 107.A N PHE 150.A O no hydrogen 3.109 N/A CYS 107.A SG ARG 108.A O no hydrogen 3.519 N/A ARG 108.A N ASP 174.A OD2 no hydrogen 2.733 N/A ARG 108.A NH1 ASP 174.A OD1 no hydrogen 3.508 N/A ARG 111.A NH2 ASP 64.A OD2 no hydrogen 3.185 N/A LEU 114.A N ARG 111.A O no hydrogen 2.870 N/A LEU 115.A N THR 112.A O no hydrogen 2.827 N/A ALA 117.A N ASP 113.A O no hydrogen 2.777 N/A LEU 118.A N LEU 114.A O no hydrogen 2.866 N/A LEU 119.A N LEU 115.A O no hydrogen 3.056 N/A LEU 120.A N GLU 116.A O no hydrogen 3.044 N/A LEU 120.A N ALA 117.A O no hydrogen 3.221 N/A GLY 121.A N LEU 118.A O no hydrogen 3.399 N/A ASN 122.A N LEU 119.A O no hydrogen 2.855 N/A ASN 122.A ND2 LEU 118.A O no hydrogen 3.624 N/A HIS 125.A N CYS 145.A O no hydrogen 2.917 N/A LYS 127.A N VAL 147.A O no hydrogen 2.936 N/A ARG 128.A NE ASP 130.A OD1 no hydrogen 3.378 N/A ARG 128.A NE ASP 130.A OD2 no hydrogen 3.130 N/A ARG 128.A NH1 ASP 113.A OD1 no hydrogen 2.838 N/A ARG 128.A NH1 GLU 116.A OE2 no hydrogen 2.866 N/A ARG 128.A NH2 ASP 113.A OD1 no hydrogen 3.392 N/A ARG 128.A NH2 ASP 130.A OD1 no hydrogen 2.877 N/A HIS 132.A N ASP 130.A OD2 no hydrogen 3.044 N/A SER 133.A OG GLU 116.A OE1 no hydrogen 2.654 N/A ILE 134.A N GLU 116.A OE2 no hydrogen 3.141 N/A LYS 135.A N SER 133.A OG no hydrogen 3.153 N/A ALA 137.A N SER 136.A OG no hydrogen 2.862 N/A PHE 143.A N HIS 125.A NE2 no hydrogen 3.075 N/A SER 144.A OG GLN 97.A O no hydrogen 3.002 N/A SER 144.A OG TYR 99.A O no hydrogen 2.949 N/A CYS 145.A SG THR 101.A O no hydrogen 3.951 N/A THR 146.A N THR 101.A O no hydrogen 2.978 N/A VAL 147.A N HIS 125.A O no hydrogen 2.695 N/A HIS 148.A N THR 103.A O no hydrogen 2.838 N/A LEU 149.A N LYS 127.A O no hydrogen 2.768 N/A PHE 150.A N ILE 105.A O no hydrogen 2.755 N/A SER 152.A N CYS 107.A O no hydrogen 3.017 N/A SER 152.A OG THR 176.A O no hydrogen 3.494 N/A SER 152.A OG THR 176.A OG1 no hydrogen 2.989 N/A GLU 153.A N SER 151.A OG no hydrogen 2.916 N/A THR 158.A OG1 ASN 156.A OD1 no hydrogen 3.078 N/A LYS 159.A N ASN 156.A OD1 no hydrogen 3.085 N/A TYR 160.A N ASN 156.A O no hydrogen 3.261 N/A SER 164.A OG ALA 166.A O no hydrogen 3.048 N/A ARG 167.A NH1 ASP 169.A OD2 no hydrogen 3.525 N/A ASP 169.A N GLU 102.A O no hydrogen 3.048 N/A LEU 170.A N PRO 196.A O no hydrogen 2.896 N/A ILE 171.A N ALA 104.A O no hydrogen 2.800 N/A CYS 172.A N VAL 198.A O no hydrogen 3.029 N/A LEU 173.A N VAL 106.A O no hydrogen 3.067 N/A THR 176.A OG1 SER 152.A OG no hydrogen 2.989 N/A THR 176.A OG1 GLU 153.A OE2 no hydrogen 3.531 N/A SER 180.A N ASP 178.A OD1 no hydrogen 2.825 N/A SER 180.A OG ASP 178.A OD1 no hydrogen 2.740 N/A SER 180.A OG ASP 178.A OD2 no hydrogen 3.383 N/A GLN 181.A N ASP 178.A O no hydrogen 3.208 N/A GLN 181.A NE2 SER 152.A O no hydrogen 3.682 N/A GLN 181.A NE2 ASP 183.A OD2 no hydrogen 3.163 N/A GLN 185.A N GLN 181.A O no hydrogen 3.025 N/A GLN 185.A NE2 THR 179.A O no hydrogen 2.937 N/A TYR 186.A N LYS 182.A O no hydrogen 2.697 N/A LEU 187.A N ASP 183.A O no hydrogen 3.244 N/A LEU 188.A N ILE 184.A O no hydrogen 3.094 N/A GLN 189.A N GLN 185.A O no hydrogen 3.223 N/A ALA 195.A N LEU 188.A O no hydrogen 2.969 N/A ILE 197.A N GLY 3.A O no hydrogen 3.025 N/A VAL 198.A N LEU 170.A O no hydrogen 2.958 N/A ARG 199.A N TYR 5.A O no hydrogen 2.838 N/A ARG 199.A NH1 ASP 4.A OD1 no hydrogen 2.739 N/A LEU 200.A N CYS 172.A O no hydrogen 2.992 N/A VAL 201.A N LEU 7.A O no hydrogen 3.058 N/A ILE 203.A N THR 9.A O no hydrogen 3.291 N/A ASN 204.A N HIS 208.A ND1 no hydrogen 3.012 N/A ASN 204.A ND2 ARG 237.A O no hydrogen 2.920 N/A SER 205.A N ALA 202.A O no hydrogen 3.062 N/A SER 205.A OG ALA 202.A O no hydrogen 2.632 N/A HIS 208.A NE2 TYR 273.A O no hydrogen 2.755 N/A CYS 209.A N SER 205.A O no hydrogen 3.074 N/A CYS 209.A SG SER 205.A O no hydrogen 3.479 N/A CYS 209.A SG VAL 228.A O no hydrogen 3.927 N/A ARG 210.A N ILE 206.A O no hydrogen 2.788 N/A ARG 210.A NH1 THR 175.A OG1 no hydrogen 3.247 N/A LEU 211.A N ASP 207.A O no hydrogen 3.195 N/A LEU 211.A N HIS 208.A O no hydrogen 3.246 N/A PHE 212.A N HIS 208.A O no hydrogen 3.077 N/A PHE 213.A N CYS 209.A O no hydrogen 3.085 N/A LYS 215.A N PHE 212.A O no hydrogen 3.122 N/A LYS 216.A NZ GLN 277.A OE1 no hydrogen 3.131 N/A SER 221.A OG PHE 217.A O no hydrogen 2.892 N/A SER 221.A OG ASP 218.A O no hydrogen 2.816 N/A TYR 224.A N SER 221.A OG no hydrogen 3.370 N/A TYR 224.A OH ARG 210.A O no hydrogen 2.981 N/A LEU 225.A N SER 221.A O no hydrogen 3.473 N/A GLU 226.A N ARG 222.A O no hydrogen 2.924 N/A ASN 227.A N GLU 223.A O no hydrogen 3.001 N/A ASN 227.A ND2 GLU 223.A O no hydrogen 2.942 N/A VAL 228.A N TYR 224.A O no hydrogen 2.807 N/A THR 229.A N LEU 225.A O no hydrogen 2.852 N/A THR 229.A OG1 LEU 225.A O no hydrogen 2.959 N/A THR 229.A OG1 GLU 226.A O no hydrogen 3.211 N/A ALA 230.A N GLU 226.A O no hydrogen 3.035 N/A ALA 231.A N ASN 227.A O no hydrogen 3.048 N/A ILE 233.A N ALA 230.A O no hydrogen 2.953 N/A LEU 234.A N ALA 231.A O no hydrogen 2.712 N/A ARG 235.A NE VAL 232.A O no hydrogen 2.857 N/A ARG 235.A NH2 VAL 232.A O no hydrogen 3.273 N/A ARG 235.A NH2 SER 285.A O no hydrogen 3.435 N/A ARG 237.A N LEU 234.A O no hydrogen 2.728 N/A GLY 239.A N ILE 203.A O no hydrogen 2.830 N/A THR 240.A N ARG 237.A O no hydrogen 3.402 N/A THR 240.A OG1 ARG 237.A O no hydrogen 3.238 N/A LEU 245.A N PRO 242.A O no hydrogen 2.901 N/A ARG 246.A N PRO 242.A O no hydrogen 3.165 N/A ARG 246.A NE LEU 241.A O no hydrogen 3.194 N/A TYR 249.A OH PRO 8.A O no hydrogen 2.630 N/A SER 250.A N ARG 246.A O no hydrogen 2.764 N/A GLN 251.A N PRO 247.A O no hydrogen 2.651 N/A LYS 252.A N TYR 249.A O no hydrogen 2.877 N/A LYS 252.A NZ ASP 91.A OD1 no hydrogen 2.788 N/A LYS 252.A NZ ASN 94.A OD1 no hydrogen 2.757 N/A LEU 253.A N ILE 248.A O no hydrogen 2.897 N/A HIS 254.A N GLN 251.A O no hydrogen 3.438 N/A LEU 256.A N LEU 253.A O no hydrogen 3.069 N/A VAL 257.A N HIS 254.A O no hydrogen 2.871 N/A LEU 260.A N LEU 256.A O no hydrogen 2.971 N/A GLU 261.A N VAL 257.A O no hydrogen 3.063 N/A GLU 261.A N GLU 258.A O no hydrogen 3.039 N/A ASN 262.A N GLU 258.A O no hydrogen 2.964 N/A ASN 262.A ND2 GLU 258.A O no hydrogen 3.166 N/A VAL 265.A N ASN 262.A O no hydrogen 2.892 N/A TRP 267.A NE1 TRP 6.A O no hydrogen 3.029 N/A THR 279.A N ASP 281.A OD2 no hydrogen 2.807 N/A THR 279.A OG1 ASP 281.A OD2 no hydrogen 3.491 N/A SER 280.A OG PHE 33.A O no hydrogen 2.816 N/A VAL 282.A N THR 279.A O no hydrogen 3.166 N/A GLU 283.A N SER 280.A O no hydrogen 3.424 N/A ARG 284.A NH1 ASP 281.A OD1 no hydrogen 2.863 N/A SER 285.A N ASP 281.A O no hydrogen 2.907 N/A LEU 286.A N VAL 282.A O no hydrogen 2.890 N/A LEU 287.A N GLU 283.A O no hydrogen 3.009 N/A THR 288.A OG1 SER 285.A O no hydrogen 3.088 N/A GLU 289.A N LEU 286.A O no hydrogen 3.140 N/A