Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4hdq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N VAL 16.A O no hydrogen 2.901 N/A ARG 5.A NH1 TYR 7.A OH no hydrogen 3.506 N/A ILE 6.A N ARG 14.A O no hydrogen 2.806 N/A TYR 7.A N LEU 88.A O no hydrogen 2.869 N/A ARG 8.A N SER 12.A O no hydrogen 2.962 N/A ARG 8.A NH1 ASP 115.A OD2 no hydrogen 3.555 N/A ARG 8.A NH2 ASP 115.A OD2 no hydrogen 2.750 N/A GLY 11.A N ARG 8.A O no hydrogen 2.853 N/A SER 12.A N ASP 10.A OD1 no hydrogen 2.888 N/A SER 12.A OG ASP 10.A OD1 no hydrogen 2.528 N/A SER 12.A OG ASP 10.A OD2 no hydrogen 3.457 N/A ARG 14.A N ILE 6.A O no hydrogen 2.891 N/A VAL 16.A N VAL 4.A O no hydrogen 2.813 N/A LEU 18.A N GLU 2.A O no hydrogen 3.020 N/A HIS 20.A N THR 24.A OG1 no hydrogen 2.995 N/A HIS 20.A ND1 GLN 28.A OE1 no hydrogen 3.279 N/A GLY 21.A N LEU 18.A O no hydrogen 3.310 N/A ASN 23.A N HIS 20.A O no hydrogen 2.884 N/A THR 24.A N GLY 21.A O no hydrogen 3.014 N/A THR 24.A OG1 GLY 21.A O no hydrogen 2.372 N/A THR 25.A N GLN 28.A OE1 no hydrogen 2.957 N/A VAL 26.A N HIS 60.A O no hydrogen 2.951 N/A GLN 27.A N PRO 58.A O no hydrogen 2.969 N/A GLN 28.A N THR 25.A OG1 no hydrogen 3.003 N/A ILE 29.A N THR 25.A O no hydrogen 2.833 N/A MET 30.A N VAL 26.A O no hydrogen 2.752 N/A GLU 31.A N GLN 27.A O no hydrogen 2.942 N/A GLY 32.A N GLN 28.A O no hydrogen 3.035 N/A MET 33.A N MET 30.A O no hydrogen 3.071 N/A SER 36.A OG THR 39.A OG1 no hydrogen 3.087 N/A THR 39.A N SER 36.A OG no hydrogen 3.057 N/A THR 39.A OG1 SER 36.A OG no hydrogen 3.087 N/A THR 39.A OG1 ASP 106.A OD2 no hydrogen 2.689 N/A GLN 40.A N SER 36.A O no hydrogen 3.126 N/A GLN 40.A NE2 LEU 35.A O no hydrogen 3.105 N/A GLN 40.A NE2 SER 36.A O no hydrogen 3.402 N/A GLN 41.A N GLN 37.A O no hydrogen 3.313 N/A GLN 41.A NE2 GLU 38.A O no hydrogen 3.275 N/A PHE 43.A N GLN 40.A O no hydrogen 3.304 N/A THR 44.A N ARG 91.A O no hydrogen 2.956 N/A ILE 45.A N THR 44.A OG1 no hydrogen 2.764 N/A TRP 46.A N PHE 89.A O no hydrogen 2.772 N/A TRP 46.A NE1 ARG 92.A O no hydrogen 3.120 N/A ILE 47.A N LEU 54.A O no hydrogen 2.873 N/A CYS 48.A N GLN 87.A O no hydrogen 3.095 N/A CYS 48.A SG SER 53.A OG no hydrogen 3.547 N/A SER 49.A N LEU 52.A O no hydrogen 2.761 N/A SER 49.A OG GLU 84.A OE1 no hydrogen 2.607 N/A ASN 51.A N GLU 84.A OE1 no hydrogen 2.825 N/A ASN 51.A ND2 GLU 84.A OE2 no hydrogen 2.718 N/A LEU 54.A N ILE 47.A O no hydrogen 2.869 N/A GLN 55.A NE2 ASP 93.A OD1 no hydrogen 2.972 N/A LEU 56.A N ILE 45.A O no hydrogen 3.041 N/A LYS 57.A N HIS 60.A ND1 no hydrogen 2.906 N/A HIS 60.A N LYS 57.A O no hydrogen 2.956 N/A LYS 61.A NZ ASN 23.A OD1 no hydrogen 3.363 N/A GLN 64.A N LYS 61.A O no hydrogen 3.017 N/A GLN 64.A NE2 ASN 22.A O no hydrogen 3.041 N/A GLN 64.A NE2 ASN 23.A OD1 no hydrogen 3.187 N/A HIS 65.A N PRO 62.A O no hydrogen 3.016 N/A VAL 66.A N PRO 62.A O no hydrogen 2.935 N/A ARG 67.A N LEU 63.A O no hydrogen 2.938 N/A ARG 67.A NE ASP 68.A OD1 no hydrogen 3.221 N/A ARG 67.A NH2 ASP 68.A OD2 no hydrogen 3.210 N/A ASP 68.A N GLN 64.A O no hydrogen 2.941 N/A TRP 69.A N VAL 66.A O no hydrogen 3.226 N/A GLU 71.A N GLU 71.A OE1 no hydrogen 3.138 N/A ILE 72.A N ASP 68.A O no hydrogen 3.057 N/A LEU 73.A N TRP 69.A O no hydrogen 2.785 N/A ALA 74.A N PRO 70.A O no hydrogen 3.257 N/A ALA 74.A N GLU 71.A O no hydrogen 3.178 N/A GLU 75.A N GLU 71.A O no hydrogen 2.893 N/A LEU 76.A N ILE 72.A O no hydrogen 2.933 N/A THR 77.A N LEU 73.A O no hydrogen 2.723 N/A THR 77.A OG1 LEU 73.A O no hydrogen 2.688 N/A LEU 79.A N THR 77.A OG1 no hydrogen 2.931 N/A GLN 82.A N ASP 80.A OD1 no hydrogen 3.343 N/A ARG 83.A N ASP 80.A O no hydrogen 2.890 N/A GLU 84.A N PRO 81.A O no hydrogen 2.879 N/A GLN 87.A N CYS 48.A O no hydrogen 2.991 N/A PHE 89.A N TRP 46.A O no hydrogen 2.894 N/A LEU 90.A N TYR 7.A O no hydrogen 2.916 N/A ARG 91.A N THR 44.A O no hydrogen 3.027 N/A ARG 92.A N GLU 116.A OE1 no hydrogen 2.736 N/A ARG 92.A NE GLU 101.A OE1 no hydrogen 2.714 N/A ARG 92.A NH2 LEU 96.A O no hydrogen 2.883 N/A ARG 92.A NH2 GLU 101.A OE1 no hydrogen 2.730 N/A ASP 93.A N TYR 42.A O no hydrogen 2.928 N/A VAL 94.A N GLN 55.A OE1 no hydrogen 2.893 N/A ARG 95.A N ASP 93.A OD1 no hydrogen 2.871 N/A ARG 95.A NE GLN 310.A OE1 no hydrogen 3.049 N/A ARG 95.A NH1 GLN 310.A OE1 no hydrogen 2.984 N/A LEU 96.A N ASP 93.A O no hydrogen 2.978 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 2.859 N/A VAL 100.A N PRO 97.A O no hydrogen 3.169 N/A GLU 101.A N PRO 97.A O no hydrogen 3.037 N/A LYS 102.A N LEU 98.A O no hydrogen 2.842 N/A LYS 102.A NZ GLU 213.A OE2.A no hydrogen 2.901 N/A GLN 103.A N VAL 100.A O no hydrogen 3.321 N/A ILE 104.A N GLU 101.A O no hydrogen 3.036 N/A ALA 109.A N ASP 106.A OD2 no hydrogen 2.936 N/A ILE 110.A N ASP 106.A O no hydrogen 2.945 N/A LEU 111.A N PRO 107.A O no hydrogen 3.010 N/A ILE 112.A N LEU 108.A O no hydrogen 3.068 N/A LEU 113.A N ALA 109.A O no hydrogen 3.052 N/A PHE 114.A N ILE 110.A O no hydrogen 2.834 N/A ASP 115.A N LEU 111.A O no hydrogen 2.987 N/A GLU 116.A N ILE 112.A O no hydrogen 3.076 N/A ALA 117.A N LEU 113.A O no hydrogen 2.926 N/A ARG 118.A N PHE 114.A O no hydrogen 2.785 N/A TYR 119.A N ASP 115.A O no hydrogen 3.060 N/A ASN 120.A N GLU 116.A O no hydrogen 3.079 N/A ASN 120.A ND2 GLU 116.A O no hydrogen 2.978 N/A LEU 121.A N ALA 117.A O no hydrogen 2.994 N/A LEU 122.A N ARG 118.A O no hydrogen 3.016 N/A LYS 123.A N TYR 119.A O no hydrogen 3.140 N/A LYS 123.A NZ TYR 119.A OH no hydrogen 3.313 N/A GLY 124.A N LEU 121.A O no hydrogen 3.039 N/A PHE 125.A N ASN 120.A O no hydrogen 2.910 N/A LYS 132.A NZ ASN 210.A O no hydrogen 2.737 N/A LYS 132.A NZ GLU 213.A OE1.B no hydrogen 2.596 N/A LEU 133.A N PRO 129.A O no hydrogen 3.095 N/A ILE 134.A N ASP 130.A O no hydrogen 2.797 N/A THR 135.A N ALA 131.A O no hydrogen 3.042 N/A THR 135.A OG1 ALA 131.A O no hydrogen 3.032 N/A THR 135.A OG1 GLU 186.A OE1 no hydrogen 2.785 N/A THR 135.A OG1 GLU 186.A OE2 no hydrogen 3.322 N/A LEU 136.A N LYS 132.A O no hydrogen 2.883 N/A ALA 137.A N LEU 133.A O no hydrogen 2.889 N/A SER 138.A N ILE 134.A O no hydrogen 2.951 N/A SER 138.A OG THR 135.A O no hydrogen 2.870 N/A LEU 139.A N THR 135.A O no hydrogen 3.032 N/A LEU 140.A N LEU 136.A O no hydrogen 3.017 N/A LEU 141.A N ALA 137.A O no hydrogen 3.052 N/A GLN 142.A N SER 138.A O no hydrogen 3.233 N/A GLN 142.A NE2 SER 191.A OG no hydrogen 2.629 N/A ILE 143.A N LEU 139.A O no hydrogen 2.874 N/A VAL 144.A N LEU 140.A O no hydrogen 2.834 N/A TYR 145.A N LEU 141.A O no hydrogen 2.658 N/A GLY 146.A N GLN 142.A O no hydrogen 3.120 N/A TYR 148.A N SER 191.A OG no hydrogen 2.849 N/A LYS 152.A N GLU 149.A O no hydrogen 3.118 N/A HIS 153.A N GLU 149.A O no hydrogen 2.868 N/A LYS 154.A N SER 150.A O no hydrogen 3.305 N/A ASN 159.A N PHE 157.A O no hydrogen 2.819 N/A ASN 162.A N ASN 159.A OD1 no hydrogen 2.930 N/A LEU 163.A N ASN 159.A O no hydrogen 2.997 N/A LYS 164.A N GLU 160.A O no hydrogen 2.884 N/A SER 165.A N ASN 162.A O no hydrogen 3.331 N/A SER 165.A OG ASN 162.A O no hydrogen 2.770 N/A ILE 166.A N LEU 163.A O no hydrogen 2.876 N/A VAL 167.A N LEU 163.A O no hydrogen 3.056 N/A VAL 169.A N LEU 122.A O no hydrogen 2.861 N/A LYS 171.A N PRO 168.A O no hydrogen 2.939 N/A LEU 172.A N VAL 169.A O no hydrogen 3.259 N/A LYS 173.A NZ GLU 160.A OE1 no hydrogen 3.200 N/A LYS 175.A N LYS 171.A O no hydrogen 3.095 N/A ALA 176.A N LYS 171.A O no hydrogen 2.520 N/A HIS 178.A N LYS 175.A O no hydrogen 3.256 N/A TRP 179.A N ALA 176.A O no hydrogen 2.656 N/A THR 180.A OG1 PRO 177.A O no hydrogen 3.257 N/A ILE 183.A N TRP 179.A O no hydrogen 2.903 N/A LEU 184.A N THR 180.A O no hydrogen 3.057 N/A HIS 185.A N ASN 181.A O no hydrogen 2.890 N/A GLU 186.A N ARG 182.A O no hydrogen 2.868 N/A TYR 187.A N ILE 183.A O no hydrogen 2.665 N/A TYR 187.A OH GLY 146.A O no hydrogen 2.280 N/A TYR 187.A OH HIS 153.A NE2 no hydrogen 3.396 N/A LYS 188.A N LEU 184.A O no hydrogen 2.687 N/A ASN 189.A N HIS 185.A O no hydrogen 2.937 N/A LEU 190.A N GLU 186.A O no hydrogen 3.020 N/A SER 191.A N TYR 187.A O no hydrogen 3.076 N/A SER 191.A OG TYR 187.A O no hydrogen 3.287 N/A THR 192.A N LYS 188.A O no hydrogen 2.759 N/A THR 192.A OG1 LYS 188.A O no hydrogen 3.408 N/A THR 192.A OG1 ASN 189.A O no hydrogen 3.351 N/A SER 193.A N ASN 189.A O no hydrogen 2.977 N/A VAL 196.A N SER 193.A O no hydrogen 3.233 N/A SER 197.A OG HIS 202.A ND1 no hydrogen 2.626 N/A LYS 198.A NZ LEU 190.A O no hydrogen 2.823 N/A LYS 198.A NZ SER 193.A O no hydrogen 3.171 N/A LYS 198.A NZ VAL 196.A O no hydrogen 2.816 N/A GLU 199.A N SER 197.A OG no hydrogen 3.186 N/A HIS 202.A ND1 SER 197.A OG no hydrogen 2.626 N/A LEU 203.A N GLU 199.A O no hydrogen 3.034 N/A GLN 204.A N MET 200.A O no hydrogen 2.942 N/A ARG 205.A N HIS 201.A O no hydrogen 2.865 N/A ARG 205.A NH2 ILE 104.A O no hydrogen 2.722 N/A MET 206.A N HIS 202.A O no hydrogen 3.081 N/A PHE 207.A N LEU 203.A O no hydrogen 2.986 N/A LEU 208.A N GLN 204.A O no hydrogen 2.994 N/A GLN 209.A N ARG 205.A O no hydrogen 2.800 N/A ASN 210.A N MET 206.A O no hydrogen 3.265 N/A ASN 210.A ND2 MET 206.A O no hydrogen 3.007 N/A CYS 211.A N PHE 207.A O no hydrogen 2.974 N/A CYS 211.A SG PHE 207.A O no hydrogen 3.400 N/A TRP 212.A N LEU 208.A O no hydrogen 2.863 N/A TRP 212.A NE1 GLU 101.A OE2 no hydrogen 2.845 N/A ILE 214.A N CYS 211.A O no hydrogen 2.835 N/A THR 216.A OG1 PHE 125.A O no hydrogen 2.752 N/A TYR 217.A N ILE 214.A O no hydrogen 3.000 N/A TYR 217.A OH GLU 101.A OE2 no hydrogen 2.471 N/A ALA 219.A N THR 216.A O no hydrogen 3.039 N/A ALA 220.A N VAL 244.A O no hydrogen 2.835 N/A PHE 222.A N VAL 242.A O no hydrogen 2.815 N/A THR 223.A N GLN 296.A OE1 no hydrogen 3.028 N/A GLY 224.A N VAL 240.A O no hydrogen 3.062 N/A GLN 225.A N HIS 293.A O no hydrogen 2.995 N/A ILE 226.A N ILE 238.A O no hydrogen 2.915 N/A THR 228.A N LYS 236.A O no hydrogen 2.923 N/A THR 228.A OG1 LYS 236.A O no hydrogen 3.366 N/A LYS 229.A NZ SER 289.A O no hydrogen 3.160 N/A LYS 236.A N THR 228.A OG1 no hydrogen 2.544 N/A ILE 238.A N ILE 226.A O no hydrogen 2.667 N/A VAL 240.A N GLY 224.A O no hydrogen 2.996 N/A TYR 241.A N LEU 252.A O no hydrogen 2.767 N/A VAL 242.A N PHE 222.A O no hydrogen 2.617 N/A GLY 243.A N HIS 250.A O no hydrogen 2.612 N/A VAL 244.A N ALA 220.A O no hydrogen 2.865 N/A ASN 245.A N GLY 248.A O no hydrogen 3.028 N/A ASN 245.A ND2 PRO 215.A O no hydrogen 2.756 N/A ASN 245.A ND2 TYR 217.A O no hydrogen 2.803 N/A LYS 247.A N ASN 245.A OD1 no hydrogen 2.941 N/A LYS 247.A NZ TRP 212.A O no hydrogen 2.690 N/A LYS 247.A NZ ILE 214.A O no hydrogen 2.562 N/A GLY 248.A N ASN 245.A O no hydrogen 3.297 N/A GLY 248.A N ASN 245.A OD1 no hydrogen 2.970 N/A LEU 249.A N LEU 263.A O no hydrogen 2.978 N/A HIS 250.A N GLY 243.A O no hydrogen 2.875 N/A HIS 250.A ND1 SER 262.A OG no hydrogen 2.864 N/A HIS 250.A NE2 ASN 245.A OD1 no hydrogen 2.966 N/A LEU 251.A N ILE 261.A O no hydrogen 2.735 N/A LEU 252.A N TYR 241.A O no hydrogen 2.885 N/A ASN 253.A N ALA 258.A O no hydrogen 2.845 N/A MET 254.A N PRO 239.A O no hydrogen 3.058 N/A GLU 255.A N ASN 253.A OD1 no hydrogen 2.716 N/A THR 256.A N ASN 253.A OD1 no hydrogen 3.082 N/A ALA 258.A N THR 256.A OG1 no hydrogen 2.997 N/A LEU 260.A N LEU 251.A O no hydrogen 2.787 N/A SER 262.A OG HIS 250.A ND1 no hydrogen 2.864 N/A LEU 263.A N LEU 249.A O no hydrogen 2.801 N/A TYR 265.A N LYS 247.A O no hydrogen 3.154 N/A TYR 265.A OH ASN 245.A O no hydrogen 2.769 N/A CYS 267.A N LYS 264.A O no hydrogen 2.854 N/A MET 269.A N HIS 282.A O no hydrogen 2.980 N/A GLN 271.A N GLN 280.A O no hydrogen 2.880 N/A GLY 273.A N CYS 278.A O no hydrogen 2.852 N/A ASP 276.A N GLY 273.A O no hydrogen 3.235 N/A PHE 279.A N VAL 292.A O no hydrogen 2.965 N/A GLN 280.A N GLN 271.A O no hydrogen 2.840 N/A ILE 281.A N PHE 290.A O no hydrogen 2.827 N/A HIS 282.A N MET 269.A O no hydrogen 2.883 N/A HIS 282.A NE2 GLN 280.A OE1 no hydrogen 3.006 N/A SER 283.A N MET 288.A O no hydrogen 2.741 N/A ASN 286.A ND2 ASN 286.A O no hydrogen 2.813 N/A MET 288.A N SER 283.A O no hydrogen 3.381 N/A PHE 290.A N ILE 281.A O no hydrogen 2.958 N/A VAL 292.A N PHE 279.A O no hydrogen 2.930 N/A HIS 293.A N GLN 225.A O no hydrogen 2.835 N/A THR 294.A N THR 277.A O no hydrogen 2.871 N/A THR 294.A OG1 THR 223.A O no hydrogen 2.666 N/A LYS 295.A NZ ALA 74.A O no hydrogen 2.806 N/A LYS 295.A NZ THR 77.A O no hydrogen 2.613 N/A LYS 295.A NZ ASN 78.A OD1 no hydrogen 3.191 N/A GLN 296.A N THR 294.A OG1 no hydrogen 2.898 N/A GLN 296.A NE2 LEU 76.A O no hydrogen 2.905 N/A GLN 296.A NE2 THR 223.A OG1 no hydrogen 3.162 N/A ALA 297.A N THR 294.A O no hydrogen 3.146 N/A VAL 300.A N GLN 296.A O no hydrogen 2.916 N/A VAL 301.A N ALA 297.A O no hydrogen 2.836 N/A LYS 302.A N GLY 298.A O no hydrogen 3.019 N/A LEU 303.A N LEU 299.A O no hydrogen 2.954 N/A LEU 304.A N VAL 300.A O no hydrogen 2.898 N/A MET 305.A N VAL 301.A O no hydrogen 3.029 N/A LYS 306.A N LYS 302.A O no hydrogen 3.025 N/A LEU 307.A N LEU 303.A O no hydrogen 2.850 N/A ASN 308.A N LEU 304.A O no hydrogen 2.878 N/A GLY 309.A N MET 305.A O no hydrogen 2.811 N/A GLN 310.A N LYS 306.A O no hydrogen 3.070 N/A GLN 310.A NE2 ARG 95.A O no hydrogen 2.787 N/A LEU 311.A N ASN 308.A O no hydrogen 3.151 N/A