Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8hqg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N SER 111.A OG no hydrogen 2.794 N/A SER 8.A OG GLU 12.A OE1 no hydrogen 2.509 N/A LYS 10.A NZ ASP 153.A OD1 no hydrogen 3.102 N/A VAL 11.A N SER 8.A O no hydrogen 2.991 N/A GLU 12.A N SER 8.A O no hydrogen 2.868 N/A GLY 13.A N GLY 9.A O no hydrogen 3.189 N/A CYS 14.A N VAL 11.A O no hydrogen 2.824 N/A CYS 14.A SG LYS 10.A O no hydrogen 3.426 N/A MET 15.A N GLU 12.A O no hydrogen 3.192 N/A VAL 16.A N GLY 27.A O no hydrogen 2.947 N/A GLN 17.A N GLN 67.A O no hydrogen 2.999 N/A GLN 17.A NE2 GLY 69.A O no hydrogen 3.120 N/A VAL 18.A N LEU 25.A O no hydrogen 2.950 N/A THR 19.A N LEU 65.A O no hydrogen 2.820 N/A THR 19.A OG1 THR 24.A OG1 no hydrogen 2.473 N/A CYS 20.A N THR 23.A O no hydrogen 2.946 N/A CYS 20.A SG ASN 63.A O no hydrogen 4.030 N/A THR 23.A N CYS 20.A O no hydrogen 3.064 N/A THR 24.A OG1 THR 19.A OG1 no hydrogen 2.473 N/A LEU 25.A N VAL 18.A O no hydrogen 2.958 N/A ASN 26.A N CYS 143.A O no hydrogen 3.051 N/A ASN 26.A ND2 CYS 115.A O no hydrogen 2.787 N/A ASN 26.A ND2 GLY 141.A O no hydrogen 3.476 N/A ASN 26.A ND2 SER 142.A O no hydrogen 3.271 N/A ASN 26.A ND2 CYS 143.A O no hydrogen 3.177 N/A GLY 27.A N VAL 16.A O no hydrogen 2.827 N/A LEU 28.A N TYR 35.A O no hydrogen 2.823 N/A TRP 29.A N CYS 14.A O no hydrogen 2.765 N/A TRP 29.A NE1 THR 91.A O no hydrogen 3.150 N/A LEU 30.A N VAL 33.A O no hydrogen 2.946 N/A ASP 31.A N THR 96.A OG1 no hydrogen 2.833 N/A VAL 33.A N LEU 30.A O no hydrogen 3.053 N/A VAL 34.A N LEU 87.A O no hydrogen 2.750 N/A TYR 35.A N LEU 28.A O no hydrogen 2.806 N/A CYS 36.A N LEU 85.A O no hydrogen 3.059 N/A CYS 36.A SG PRO 37.A O no hydrogen 3.557 N/A ARG 38.A N CYS 83.A O no hydrogen 2.970 N/A ARG 38.A NE ASP 185.A OD2 no hydrogen 2.716 N/A ARG 38.A NH2 ASP 185.A OD1 no hydrogen 3.064 N/A ARG 38.A NH2 ASP 185.A OD2 no hydrogen 3.442 N/A HIS 39.A NE2 HIS 162.A ND1 no hydrogen 3.197 N/A VAL 40.A N PRO 37.A O no hydrogen 3.329 N/A ILE 41.A N ARG 38.A O no hydrogen 3.168 N/A CYS 42.A N HIS 39.A O no hydrogen 2.961 N/A ASP 46.A N THR 43.A O no hydrogen 2.849 N/A TYR 52.A OH ASP 185.A O no hydrogen 2.663 N/A ASP 54.A N ASN 51.A OD1 no hydrogen 3.204 N/A LEU 55.A N ASN 51.A O no hydrogen 2.870 N/A LEU 56.A N TYR 52.A O no hydrogen 2.845 N/A ILE 57.A N GLU 53.A O no hydrogen 3.163 N/A LYS 59.A N LEU 56.A O no hydrogen 3.084 N/A SER 60.A N ASN 63.A OD1 no hydrogen 2.748 N/A ASN 63.A N SER 60.A O no hydrogen 2.910 N/A PHE 64.A N ASN 61.A O no hydrogen 3.377 N/A LEU 65.A N THR 19.A O no hydrogen 2.887 N/A GLN 67.A N GLN 17.A O no hydrogen 2.992 N/A ALA 68.A N VAL 71.A O no hydrogen 2.805 N/A VAL 71.A N ALA 68.A O no hydrogen 3.079 N/A LEU 73.A N VAL 66.A O no hydrogen 2.855 N/A ILE 76.A N ARG 88.A O no hydrogen 2.694 N/A HIS 78.A ND1 ASN 61.A OD1 no hydrogen 2.910 N/A SER 79.A N LYS 86.A O no hydrogen 2.877 N/A GLN 81.A N VAL 84.A O no hydrogen 2.831 N/A ASN 82.A ND2 GLU 176.A O no hydrogen 3.041 N/A CYS 83.A N GLY 177.A O no hydrogen 2.907 N/A CYS 83.A SG ASP 185.A OD2 no hydrogen 3.422 N/A VAL 84.A N GLN 81.A O no hydrogen 3.043 N/A LEU 85.A N CYS 36.A O no hydrogen 2.728 N/A LYS 86.A N SER 79.A O no hydrogen 2.711 N/A LYS 86.A NZ GLN 81.A OE1 no hydrogen 3.477 N/A LEU 87.A N VAL 34.A O no hydrogen 2.879 N/A ARG 88.A N GLY 77.A O no hydrogen 2.861 N/A VAL 89.A N ASP 32.A O no hydrogen 2.881 N/A ASP 90.A N ARG 74.A O no hydrogen 3.121 N/A THR 91.A OG1 ASP 90.A OD1 no hydrogen 2.901 N/A ASN 93.A N ASP 31.A O no hydrogen 2.751 N/A ASN 93.A ND2 GLY 13.A O no hydrogen 3.014 N/A ASN 93.A ND2 TRP 29.A O no hydrogen 2.890 N/A LYS 95.A N ASN 93.A OD1 no hydrogen 2.874 N/A THR 96.A N ASN 93.A O no hydrogen 2.982 N/A THR 96.A OG1 ASN 93.A O no hydrogen 2.620 N/A LYS 100.A N VAL 155.A O no hydrogen 2.873 N/A VAL 102.A N PHE 157.A O no hydrogen 3.009 N/A ARG 103.A NH1 ASP 174.A OD2 no hydrogen 2.953 N/A ARG 103.A NH1 ASN 178.A O no hydrogen 2.996 N/A ARG 103.A NH1 PHE 179.A O no hydrogen 3.506 N/A ARG 103.A NH2 PHE 179.A O no hydrogen 2.719 N/A ILE 104.A N TYR 180.A OH no hydrogen 3.120 N/A GLN 105.A N GLN 108.A OE1 no hydrogen 2.867 N/A GLY 107.A N MET 128.A O no hydrogen 2.809 N/A GLN 108.A N GLN 105.A O no hydrogen 3.163 N/A THR 109.A OG1 ASP 293.A OD1 no hydrogen 3.527 N/A THR 109.A OG1 ASP 293.A OD2 no hydrogen 2.897 N/A PHE 110.A N CYS 126.A O no hydrogen 2.928 N/A SER 111.A N PHE 148.A O no hydrogen 2.932 N/A VAL 112.A N TYR 124.A O no hydrogen 2.810 N/A LEU 113.A N VAL 146.A O no hydrogen 3.196 N/A ALA 114.A N GLY 122.A O no hydrogen 2.869 N/A CYS 115.A N SER 145.A OG no hydrogen 3.042 N/A CYS 115.A SG LEU 113.A O no hydrogen 3.605 N/A TYR 116.A N SER 119.A O no hydrogen 3.032 N/A GLY 118.A N ASN 26.A OD1 no hydrogen 2.875 N/A SER 119.A N TYR 116.A O no hydrogen 2.931 N/A SER 121.A N ALA 114.A O no hydrogen 2.697 N/A TYR 124.A N VAL 112.A O no hydrogen 3.158 N/A TYR 124.A OH SER 137.A O no hydrogen 3.012 N/A CYS 126.A N PHE 110.A O no hydrogen 2.720 N/A CYS 126.A SG LYS 135.A O no hydrogen 3.975 N/A MET 128.A N GLN 108.A O no hydrogen 3.074 N/A ARG 129.A N THR 133.A O no hydrogen 2.739 N/A ARG 129.A NE ASP 195.A OD2 no hydrogen 2.763 N/A ARG 129.A NH1 ASP 287.A OD1 no hydrogen 3.028 N/A ARG 129.A NH1 ASP 287.A OD2 no hydrogen 3.323 N/A ARG 129.A NH1 GLU 288.A OE2 no hydrogen 2.836 N/A ARG 129.A NH2 ASP 195.A OD2 no hydrogen 3.399 N/A ARG 129.A NH2 THR 196.A O no hydrogen 3.150 N/A ARG 129.A NH2 ASP 287.A OD2 no hydrogen 2.732 N/A ASN 131.A N ASP 195.A OD1 no hydrogen 3.327 N/A ASN 131.A ND2 GLY 193.A O no hydrogen 2.871 N/A PHE 132.A N ARG 129.A O no hydrogen 2.843 N/A THR 133.A N ASN 131.A OD1 no hydrogen 3.337 N/A THR 133.A OG1 ASN 131.A OD1 no hydrogen 2.598 N/A ILE 134.A N HIS 170.A O no hydrogen 2.960 N/A GLY 136.A N HIS 170.A ND1 no hydrogen 3.264 N/A SER 137.A N TYR 124.A OH no hydrogen 3.065 N/A LEU 139.A N TYR 116.A OH no hydrogen 2.879 N/A SER 142.A N LEU 139.A O no hydrogen 3.195 N/A SER 142.A OG LEU 139.A O no hydrogen 2.607 N/A CYS 143.A SG HIS 162.A O no hydrogen 3.300 N/A GLY 144.A N HIS 161.A O no hydrogen 2.989 N/A SER 145.A N SER 142.A O no hydrogen 3.084 N/A SER 145.A OG SER 142.A O no hydrogen 2.744 N/A GLY 147.A N TYR 159.A O no hydrogen 2.850 N/A PHE 148.A N SER 111.A O no hydrogen 2.709 N/A ASN 149.A N SER 156.A O no hydrogen 2.975 N/A ASN 149.A ND2 THR 109.A O no hydrogen 3.002 N/A ASP 151.A N CYS 154.A O no hydrogen 2.996 N/A CYS 154.A N ASP 151.A O no hydrogen 3.032 N/A VAL 155.A N LYS 98.A O no hydrogen 2.958 N/A SER 156.A N ASN 149.A O no hydrogen 2.715 N/A PHE 157.A N LYS 100.A O no hydrogen 2.823 N/A CYS 158.A N GLY 147.A O no hydrogen 2.952 N/A CYS 158.A SG GLY 147.A O no hydrogen 3.532 N/A TYR 159.A N GLY 147.A O no hydrogen 3.312 N/A TYR 159.A OH HIS 161.A ND1 no hydrogen 2.820 N/A MET 160.A N THR 173.A O no hydrogen 2.822 N/A HIS 161.A N SER 145.A O no hydrogen 2.873 N/A HIS 161.A ND1 TYR 159.A OH no hydrogen 2.820 N/A HIS 162.A N ALA 171.A O no hydrogen 3.250 N/A MET 163.A N ALA 171.A O no hydrogen 2.958 N/A LEU 165.A N VAL 169.A O no hydrogen 2.975 N/A GLY 168.A N LEU 165.A O no hydrogen 2.958 N/A HIS 170.A N ILE 134.A O no hydrogen 2.892 N/A HIS 170.A NE2 GLU 164.A OE2 no hydrogen 2.967 N/A ALA 171.A N MET 163.A O no hydrogen 2.936 N/A THR 173.A N MET 160.A O no hydrogen 3.061 N/A THR 173.A OG1 HIS 162.A NE2 no hydrogen 3.041 N/A THR 173.A OG1 ASP 174.A O no hydrogen 3.012 N/A ASP 174.A N ASN 178.A O no hydrogen 3.002 N/A GLU 176.A N ASP 174.A OD1 no hydrogen 3.163 N/A GLY 177.A N ASP 174.A O no hydrogen 3.114 N/A ASN 178.A N ASP 174.A OD1 no hydrogen 2.895 N/A TYR 180.A N GLY 172.A O no hydrogen 2.886 N/A TYR 180.A OH CYS 158.A O no hydrogen 2.601 N/A VAL 184.A N GLN 190.A OE1 no hydrogen 2.942 N/A ARG 186.A N VAL 184.A O no hydrogen 3.022 N/A ARG 186.A NE LEU 48.A O no hydrogen 3.369 N/A GLN 187.A N MET 47.A O no hydrogen 2.946 N/A THR 188.A N ARG 186.A O no hydrogen 2.735 N/A GLN 190.A NE2 VAL 184.A O no hydrogen 3.091 N/A GLN 190.A NE2 THR 188.A O no hydrogen 3.549 N/A THR 194.A OG1 ASP 195.A O no hydrogen 3.437 N/A THR 196.A OG1 GLU 238.A OE1 no hydrogen 2.255 N/A THR 197.A N ASN 236.A O no hydrogen 2.865 N/A ILE 198.A N ASP 287.A OD2 no hydrogen 3.062 N/A THR 199.A OG1 GLU 238.A O no hydrogen 2.449 N/A ASN 201.A ND2 GLY 107.A O no hydrogen 2.906 N/A ASN 201.A ND2 ASP 287.A O no hydrogen 3.017 N/A VAL 202.A N ILE 198.A O no hydrogen 3.075 N/A LEU 203.A N THR 199.A O no hydrogen 3.014 N/A ALA 204.A N VAL 200.A O no hydrogen 3.058 N/A TRP 205.A N ASN 201.A O no hydrogen 2.914 N/A LEU 206.A N VAL 202.A O no hydrogen 2.847 N/A TYR 207.A N LEU 203.A O no hydrogen 2.876 N/A TYR 207.A OH ILE 257.A O no hydrogen 2.798 N/A ALA 208.A N ALA 204.A O no hydrogen 2.856 N/A ALA 209.A N TRP 205.A O no hydrogen 2.957 N/A VAL 210.A N LEU 206.A O no hydrogen 3.010 N/A ILE 211.A N TYR 207.A O no hydrogen 2.848 N/A ASN 212.A N ALA 208.A O no hydrogen 3.124 N/A ASN 212.A ND2 ALA 208.A O no hydrogen 2.962 N/A GLY 213.A N VAL 210.A O no hydrogen 2.888 N/A ASP 214.A N ALA 209.A O no hydrogen 2.930 N/A TRP 216.A NE1 THR 278.A O no hydrogen 2.954 N/A LEU 218.A N ARG 215.A O no hydrogen 3.202 N/A ASN 219.A N SER 265.A OG no hydrogen 3.185 N/A ASN 219.A ND2 ALA 264.A O no hydrogen 3.253 N/A PHE 221.A N ASN 219.A OD1 no hydrogen 2.979 N/A THR 222.A OG1 ASP 261.A OD1 no hydrogen 2.912 N/A THR 223.A OG1 THR 224.A O no hydrogen 2.840 N/A ASP 227.A N THR 224.A OG1 no hydrogen 3.043 N/A PHE 228.A N THR 224.A O no hydrogen 3.013 N/A ASN 229.A N LEU 225.A O no hydrogen 2.911 N/A ASN 229.A ND2 LEU 240.A O no hydrogen 3.054 N/A LEU 230.A N ASN 226.A O no hydrogen 3.003 N/A VAL 231.A N ASP 227.A O no hydrogen 3.220 N/A ALA 232.A N PHE 228.A O no hydrogen 2.774 N/A MET 233.A N ASN 229.A O no hydrogen 3.074 N/A LYS 234.A N VAL 231.A O no hydrogen 3.051 N/A TYR 235.A N ALA 232.A O no hydrogen 2.897 N/A ASN 236.A N MET 233.A O no hydrogen 3.099 N/A TYR 237.A N ALA 232.A O no hydrogen 2.991 N/A GLU 238.A N THR 197.A O no hydrogen 2.789 N/A LEU 240.A N ASN 229.A OD1 no hydrogen 2.810 N/A THR 241.A N HIS 244.A ND1 no hydrogen 3.145 N/A HIS 244.A N THR 241.A OG1 no hydrogen 3.085 N/A VAL 245.A N THR 241.A O no hydrogen 3.019 N/A ASP 246.A N GLN 242.A O no hydrogen 2.928 N/A ILE 247.A N ASP 243.A O no hydrogen 2.904 N/A LEU 248.A N HIS 244.A O no hydrogen 3.162 N/A GLY 249.A N ASP 246.A O no hydrogen 2.996 N/A SER 252.A N LEU 248.A O no hydrogen 2.961 N/A SER 252.A OG ILE 257.A O no hydrogen 2.555 N/A ALA 253.A N GLY 249.A O no hydrogen 2.834 N/A GLN 254.A N PRO 250.A O no hydrogen 2.879 N/A THR 255.A N LEU 251.A O no hydrogen 3.039 N/A THR 255.A OG1 LEU 251.A O no hydrogen 3.051 N/A GLY 256.A N SER 252.A O no hydrogen 2.846 N/A GLY 256.A N ALA 253.A O no hydrogen 3.354 N/A ILE 257.A N THR 255.A OG1 no hydrogen 3.401 N/A MET 262.A N ALA 258.A O no hydrogen 2.945 N/A CYS 263.A N VAL 259.A O no hydrogen 2.874 N/A CYS 263.A SG VAL 259.A O no hydrogen 3.336 N/A ALA 264.A N LEU 260.A O no hydrogen 2.991 N/A SER 265.A N ASP 261.A O no hydrogen 2.966 N/A SER 265.A OG PHE 217.A O no hydrogen 3.209 N/A LEU 266.A N MET 262.A O no hydrogen 2.892 N/A LYS 267.A N CYS 263.A O no hydrogen 2.828 N/A GLU 268.A N ALA 264.A O no hydrogen 3.113 N/A LEU 269.A N SER 265.A O no hydrogen 3.159 N/A LEU 270.A N LEU 266.A O no hydrogen 2.908 N/A GLN 271.A N LYS 267.A O no hydrogen 3.035 N/A ASN 272.A N GLU 268.A O no hydrogen 2.958 N/A GLY 273.A N LEU 269.A O no hydrogen 2.821 N/A ARG 277.A N MET 274.A O no hydrogen 2.953 N/A ILE 279.A N SER 282.A O no hydrogen 2.857 N/A LEU 280.A N ASP 214.A OD2 no hydrogen 3.057 N/A SER 282.A N ILE 279.A O no hydrogen 3.033 N/A SER 282.A OG LEU 284.A O no hydrogen 3.104 N/A LEU 284.A N SER 282.A OG no hydrogen 3.198 N/A GLU 288.A N GLU 286.A OE1 no hydrogen 3.125 N/A THR 290.A N ASP 293.A OD2 no hydrogen 2.924 N/A ASP 293.A N THR 290.A OG1 no hydrogen 2.959 N/A VAL 294.A N THR 290.A O no hydrogen 2.899 N/A VAL 295.A N PRO 291.A O no hydrogen 2.971 N/A ARG 296.A N PHE 292.A O no hydrogen 2.639 N/A ARG 296.A NH1 ALA 5.A O no hydrogen 3.504 N/A GLN 297.A N ASP 293.A O no hydrogen 2.961 N/A CYS 298.A N VAL 295.A O no hydrogen 3.061 N/A CYS 298.A SG VAL 294.A O no hydrogen 3.168 N/A