Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3g0f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 9.A N ASP 7.A OD2 no hydrogen 2.555 N/A THR 9.A OG1 ASP 7.A OD2 no hydrogen 2.722 N/A THR 9.A OG1 GLN 10.A OE1 no hydrogen 3.003 N/A GLN 10.A N ASP 7.A O no hydrogen 3.061 N/A TYR 13.A OH GLU 18.A OE1 no hydrogen 2.687 N/A LYS 16.A N ASP 14.A OD1 no hydrogen 2.743 N/A TRP 17.A N ASP 14.A O no hydrogen 3.297 N/A TRP 17.A NE1 SER 80.A OG no hydrogen 3.109 N/A GLU 18.A N HIS 15.A O no hydrogen 2.944 N/A PHE 19.A N ALA 94.A O no hydrogen 2.846 N/A ARG 21.A NH1 PRO 100.A O no hydrogen 2.970 N/A ARG 21.A NH2 ILE 97.A O no hydrogen 3.257 N/A ARG 21.A NH2 PRO 100.A O no hydrogen 2.846 N/A ARG 23.A N PRO 20.A O no hydrogen 3.025 N/A ARG 23.A NH2 ASN 22.A OD1 no hydrogen 3.369 N/A LEU 24.A N ARG 21.A O no hydrogen 3.172 N/A SER 25.A N THR 42.A O no hydrogen 2.966 N/A GLY 27.A N GLU 40.A O no hydrogen 2.744 N/A LYS 28.A NZ GLU 40.A OE1 no hydrogen 2.711 N/A LEU 30.A N VAL 38.A O no hydrogen 2.736 N/A GLY 31.A N VAL 38.A O no hydrogen 3.251 N/A GLY 33.A N GLY 36.A O no hydrogen 2.750 N/A LYS 37.A N MET 59.A O no hydrogen 3.064 N/A VAL 38.A N GLY 31.A O no hydrogen 2.781 N/A VAL 39.A N VAL 57.A O no hydrogen 2.843 N/A GLU 40.A N LYS 28.A O no hydrogen 2.951 N/A ALA 41.A N VAL 55.A O no hydrogen 2.942 N/A THR 42.A N SER 25.A O no hydrogen 2.920 N/A ALA 43.A N MET 53.A O no hydrogen 3.067 N/A TYR 44.A N ARG 23.A O no hydrogen 3.069 N/A TYR 44.A OH ASP 50.A O no hydrogen 3.145 N/A GLY 45.A N ALA 51.A O no hydrogen 2.729 N/A ALA 51.A N LYS 48.A O no hydrogen 3.336 N/A MET 53.A N ALA 43.A O no hydrogen 3.096 N/A VAL 55.A N ALA 41.A O no hydrogen 2.855 N/A ALA 56.A N THR 105.A O no hydrogen 2.858 N/A VAL 57.A N VAL 39.A O no hydrogen 2.873 N/A LYS 58.A N VAL 103.A O no hydrogen 2.872 N/A LYS 58.A NZ GLU 75.A OE1 no hydrogen 3.214 N/A LYS 58.A NZ GLU 75.A OE2 no hydrogen 2.858 N/A LYS 58.A NZ ASP 171.A O no hydrogen 3.186 N/A LYS 58.A NZ GLY 173.A O no hydrogen 2.627 N/A MET 59.A N LYS 37.A O no hydrogen 3.107 N/A LYS 61.A N PHE 35.A O no hydrogen 2.771 N/A LYS 61.A NZ GLY 33.A O no hydrogen 2.656 N/A ALA 64.A N LYS 61.A O no hydrogen 3.150 N/A HIS 65.A N GLU 68.A OE1 no hydrogen 3.180 N/A GLU 68.A N HIS 65.A O no hydrogen 2.880 N/A ARG 69.A N HIS 65.A O no hydrogen 3.154 N/A ARG 69.A NH1 ALA 64.A O no hydrogen 2.726 N/A GLU 70.A N LEU 66.A O no hydrogen 2.951 N/A ALA 71.A N THR 67.A O no hydrogen 3.013 N/A LEU 72.A N GLU 68.A O no hydrogen 2.904 N/A MET 73.A N ARG 69.A O no hydrogen 3.009 N/A SER 74.A N GLU 70.A O no hydrogen 2.735 N/A SER 74.A OG GLU 70.A O no hydrogen 3.282 N/A GLU 75.A N ALA 71.A O no hydrogen 2.810 N/A LEU 76.A N LEU 72.A O no hydrogen 3.162 N/A LYS 77.A N MET 73.A O no hydrogen 2.988 N/A LYS 77.A NZ LEU 11.A O no hydrogen 2.976 N/A VAL 78.A N SER 74.A O no hydrogen 2.955 N/A LEU 79.A N GLU 75.A O no hydrogen 3.067 N/A SER 80.A N LEU 76.A O no hydrogen 2.996 N/A TYR 81.A N LYS 77.A O no hydrogen 2.957 N/A TYR 81.A OH LYS 147.A O no hydrogen 2.621 N/A LEU 82.A N VAL 78.A O no hydrogen 2.853 N/A GLY 83.A N LEU 79.A O no hydrogen 3.339 N/A HIS 85.A N ASN 90.A OD1 no hydrogen 3.029 N/A ASN 87.A N HIS 85.A ND1 no hydrogen 2.914 N/A ASN 87.A ND2 GLN 136.A OE1 no hydrogen 3.263 N/A ASN 87.A ND2 THR 167.A O no hydrogen 3.049 N/A ILE 88.A N HIS 85.A O no hydrogen 3.342 N/A VAL 89.A N ILE 169.A O no hydrogen 2.945 N/A ASN 90.A N GLU 106.A OE1 no hydrogen 2.995 N/A ASN 90.A ND2 HIS 85.A O no hydrogen 3.099 N/A ASN 90.A ND2 GLU 106.A OE1 no hydrogen 2.957 N/A LEU 92.A N ILE 104.A O no hydrogen 2.731 N/A GLY 93.A N ILE 104.A O no hydrogen 3.291 N/A ALA 94.A N TRP 17.A O no hydrogen 2.798 N/A CYS 95.A N LEU 102.A O no hydrogen 2.899 N/A CYS 95.A SG PHE 19.A O no hydrogen 3.131 N/A THR 96.A N GLU 18.A OE2 no hydrogen 2.799 N/A THR 96.A OG1 GLU 18.A OE1 no hydrogen 2.781 N/A THR 96.A OG1 GLU 18.A OE2 no hydrogen 3.493 N/A LEU 102.A N CYS 95.A O no hydrogen 2.778 N/A VAL 103.A N LYS 58.A O no hydrogen 2.978 N/A ILE 104.A N GLY 93.A O no hydrogen 2.800 N/A THR 105.A N ALA 56.A O no hydrogen 2.817 N/A THR 105.A OG1 ALA 56.A O no hydrogen 3.566 N/A GLU 106.A N ASN 90.A O no hydrogen 3.226 N/A TYR 110.A N LEU 161.A O no hydrogen 3.019 N/A GLY 111.A N CYS 108.A O no hydrogen 3.098 N/A LEU 113.A N ILE 159.A O no hydrogen 2.723 N/A ASN 115.A N ASP 112.A OD1 no hydrogen 3.145 N/A ASN 115.A ND2 ASP 112.A OD1 no hydrogen 2.557 N/A PHE 116.A N ASP 112.A O no hydrogen 3.301 N/A LEU 117.A N LEU 113.A O no hydrogen 2.897 N/A ARG 118.A N LEU 114.A O no hydrogen 3.085 N/A ARG 119.A N ASN 115.A O no hydrogen 3.112 N/A LYS 120.A N PHE 116.A O no hydrogen 3.135 N/A LYS 120.A N LEU 117.A O no hydrogen 3.253 N/A ARG 121.A N ARG 118.A O no hydrogen 3.032 N/A ARG 121.A NH2 SER 228.A OG no hydrogen 2.785 N/A GLU 128.A N ASP 126.A OD1 no hydrogen 3.148 N/A ASP 129.A N ASP 126.A O no hydrogen 3.055 N/A LEU 131.A N LEU 127.A O no hydrogen 3.257 N/A SER 132.A N GLU 128.A O no hydrogen 3.273 N/A PHE 133.A N ASP 129.A O no hydrogen 2.902 N/A SER 134.A N LEU 130.A O no hydrogen 3.114 N/A SER 134.A OG LEU 130.A O no hydrogen 3.002 N/A TYR 135.A N LEU 131.A O no hydrogen 3.079 N/A TYR 135.A OH GLU 286.A OE1 no hydrogen 2.576 N/A GLN 136.A N SER 132.A O no hydrogen 2.908 N/A GLN 136.A NE2 SER 132.A OG no hydrogen 2.728 N/A GLN 136.A NE2 ARG 165.A O no hydrogen 3.038 N/A VAL 137.A N PHE 133.A O no hydrogen 3.048 N/A ALA 138.A N SER 134.A O no hydrogen 3.117 N/A LYS 139.A N TYR 135.A O no hydrogen 2.773 N/A GLY 140.A N GLN 136.A O no hydrogen 2.894 N/A MET 141.A N VAL 137.A O no hydrogen 2.970 N/A ALA 142.A N ALA 138.A O no hydrogen 2.852 N/A PHE 143.A N LYS 139.A O no hydrogen 3.086 N/A LEU 144.A N GLY 140.A O no hydrogen 3.060 N/A ALA 145.A N MET 141.A O no hydrogen 2.772 N/A SER 146.A N ALA 142.A O no hydrogen 3.087 N/A SER 146.A OG PHE 143.A O no hydrogen 2.564 N/A LYS 147.A N PHE 143.A O no hydrogen 3.265 N/A LYS 147.A N LEU 144.A O no hydrogen 3.071 N/A LYS 147.A NZ TYR 81.A O no hydrogen 3.010 N/A LYS 147.A NZ LEU 82.A O no hydrogen 3.439 N/A ASN 148.A N ALA 145.A O no hydrogen 2.813 N/A CYS 149.A N LEU 144.A O no hydrogen 2.831 N/A CYS 149.A SG LYS 147.A O no hydrogen 3.935 N/A HIS 151.A N ASP 212.A OD2 no hydrogen 2.924 N/A HIS 151.A NE2 CYS 170.A O no hydrogen 3.124 N/A ASP 153.A N HIS 151.A ND1 no hydrogen 2.789 N/A ALA 156.A N GLU 222.A OE2 no hydrogen 3.080 N/A ARG 157.A NE TYR 184.A OH no hydrogen 3.022 N/A ARG 157.A NH2 ASP 153.A OD2 no hydrogen 3.154 N/A ASN 158.A N ALA 155.A O no hydrogen 2.728 N/A ILE 159.A N ALA 156.A O no hydrogen 3.127 N/A LEU 160.A N LYS 168.A O no hydrogen 2.846 N/A LEU 161.A N GLY 111.A O no hydrogen 2.796 N/A THR 162.A N ILE 166.A O no hydrogen 2.998 N/A HIS 163.A N THR 162.A OG1 no hydrogen 2.609 N/A ILE 166.A N HIS 163.A O no hydrogen 3.166 N/A THR 167.A N GLN 136.A OE1 no hydrogen 2.946 N/A LYS 168.A N LEU 160.A O no hydrogen 2.896 N/A LYS 168.A NZ MET 86.A O no hydrogen 2.890 N/A LYS 168.A NZ ILE 88.A O no hydrogen 3.186 N/A LYS 168.A NZ GLU 106.A OE1 no hydrogen 3.241 N/A ILE 169.A N ASN 87.A O no hydrogen 2.825 N/A CYS 170.A N ASN 158.A O no hydrogen 3.043 N/A GLY 173.A N ASP 171.A OD2 no hydrogen 2.755 N/A ALA 175.A N PHE 172.A O no hydrogen 3.006 N/A ARG 176.A NH1 ARG 157.A O no hydrogen 3.104 N/A ASN 180.A ND2 HIS 177.A O no hydrogen 3.586 N/A ASP 181.A N ILE 178.A O no hydrogen 3.026 N/A ASN 183.A N ASP 181.A OD1 no hydrogen 2.696 N/A TYR 184.A N ASP 181.A O no hydrogen 2.883 N/A TYR 184.A OH ASP 153.A OD1 no hydrogen 2.557 N/A VAL 185.A N LEU 192.A O no hydrogen 2.766 N/A LYS 187.A N ALA 190.A O no hydrogen 2.984 N/A LYS 187.A NZ ILE 202.A O no hydrogen 2.670 N/A ALA 190.A N LYS 187.A O no hydrogen 3.230 N/A LEU 192.A N VAL 185.A O no hydrogen 2.913 N/A LYS 195.A NZ PRO 230.A O no hydrogen 3.456 N/A LYS 195.A NZ TYR 231.A O no hydrogen 3.437 N/A LYS 195.A NZ MET 234.A O no hydrogen 2.804 N/A TRP 196.A N PRO 193.A O no hydrogen 3.359 N/A TRP 196.A NE1 GLU 222.A OE2 no hydrogen 2.643 N/A MET 197.A N VAL 194.A O no hydrogen 3.076 N/A GLU 200.A N GLU 200.A OE1 no hydrogen 2.640 N/A SER 201.A N ALA 198.A O no hydrogen 2.910 N/A SER 201.A OG VAL 206.A O no hydrogen 2.980 N/A ILE 202.A N ALA 198.A O no hydrogen 3.277 N/A PHE 203.A N PRO 199.A O no hydrogen 3.100 N/A CYS 205.A SG PHE 203.A O no hydrogen 3.487 N/A VAL 206.A N GLU 200.A O no hydrogen 3.228 N/A THR 208.A N SER 211.A OG no hydrogen 2.815 N/A THR 208.A OG1 GLU 210.A OE2 no hydrogen 2.487 N/A THR 208.A OG1 SER 211.A OG no hydrogen 3.347 N/A GLU 210.A N GLU 210.A OE2 no hydrogen 2.763 N/A SER 211.A N THR 208.A O no hydrogen 3.286 N/A SER 211.A OG VAL 206.A O no hydrogen 3.381 N/A SER 211.A OG THR 208.A O no hydrogen 3.317 N/A SER 211.A OG THR 208.A OG1 no hydrogen 3.347 N/A TRP 214.A N GLU 210.A O no hydrogen 3.446 N/A SER 215.A N SER 211.A O no hydrogen 3.348 N/A SER 215.A OG TRP 196.A O no hydrogen 2.426 N/A TYR 216.A N ASP 212.A O no hydrogen 2.795 N/A TYR 216.A OH SER 134.A O no hydrogen 2.880 N/A GLY 217.A N VAL 213.A O no hydrogen 3.027 N/A ILE 218.A N TRP 214.A O no hydrogen 3.146 N/A PHE 219.A N SER 215.A O no hydrogen 2.888 N/A LEU 220.A N TYR 216.A O no hydrogen 2.793 N/A TRP 221.A N GLY 217.A O no hydrogen 3.034 N/A TRP 221.A NE1 LEU 251.A O no hydrogen 3.133 N/A GLU 222.A N ILE 218.A O no hydrogen 2.930 N/A LEU 223.A N PHE 219.A O no hydrogen 2.810 N/A PHE 224.A N LEU 220.A O no hydrogen 3.017 N/A SER 225.A N TRP 221.A O no hydrogen 3.124 N/A SER 225.A N GLU 222.A O no hydrogen 3.275 N/A SER 225.A OG TRP 221.A O no hydrogen 3.123 N/A LEU 226.A N LEU 223.A O no hydrogen 3.130 N/A GLY 227.A N GLU 222.A O no hydrogen 2.708 N/A SER 228.A OG SER 225.A O no hydrogen 3.563 N/A MET 234.A N TYR 231.A O no hydrogen 3.281 N/A LYS 239.A N ASP 237.A OD2 no hydrogen 2.833 N/A TYR 241.A N ASP 237.A O no hydrogen 3.069 N/A LYS 242.A N SER 238.A O no hydrogen 3.001 N/A MET 243.A N LYS 239.A O no hydrogen 3.051 N/A ILE 244.A N PHE 240.A O no hydrogen 3.062 N/A LYS 245.A N TYR 241.A O no hydrogen 3.051 N/A LYS 245.A NZ GLU 246.A OE2 no hydrogen 3.450 N/A GLU 246.A N LYS 242.A O no hydrogen 3.094 N/A GLY 247.A N ILE 244.A O no hydrogen 3.218 N/A PHE 248.A N MET 243.A O no hydrogen 2.855 N/A ARG 249.A NE TRP 268.A O no hydrogen 2.857 N/A ARG 249.A NH1 TRP 268.A O no hydrogen 2.770 N/A ARG 249.A NH2 ILE 244.A O no hydrogen 3.289 N/A ARG 249.A NH2 PHE 248.A O no hydrogen 2.776 N/A SER 252.A OG PRO 253.A O no hydrogen 3.134 N/A ALA 256.A N PRO 253.A O no hydrogen 3.084 N/A GLU 259.A N GLU 259.A OE1 no hydrogen 2.517 N/A TYR 261.A N PRO 257.A O no hydrogen 3.155 N/A ASP 262.A N ALA 258.A O no hydrogen 2.963 N/A ILE 263.A N GLU 259.A O no hydrogen 3.011 N/A MET 264.A N MET 260.A O no hydrogen 3.041 N/A LYS 265.A N TYR 261.A O no hydrogen 2.894 N/A THR 266.A N ASP 262.A O no hydrogen 2.993 N/A THR 266.A OG1 ASP 262.A O no hydrogen 3.424 N/A THR 266.A OG1 ILE 263.A O no hydrogen 2.810 N/A CYS 267.A N ILE 263.A O no hydrogen 2.902 N/A CYS 267.A N MET 264.A O no hydrogen 2.940 N/A CYS 267.A SG VAL 213.A O no hydrogen 3.510 N/A CYS 267.A SG ILE 263.A O no hydrogen 3.261 N/A TRP 268.A N LYS 265.A O no hydrogen 2.942 N/A ASP 271.A N ASP 269.A OD2 no hydrogen 2.933 N/A LYS 274.A N ASP 271.A O no hydrogen 2.913 N/A LYS 274.A NZ ASP 269.A OD2 no hydrogen 3.555 N/A ARG 275.A NE ASP 269.A O no hydrogen 2.756 N/A ARG 275.A NH1 GLU 200.A OE2 no hydrogen 2.623 N/A ARG 275.A NH1 GLU 210.A O no hydrogen 2.825 N/A ARG 275.A NH2 GLU 200.A OE1 no hydrogen 2.914 N/A ARG 275.A NH2 GLU 200.A OE2 no hydrogen 3.325 N/A ARG 275.A NH2 ASP 269.A O no hydrogen 3.223 N/A GLN 280.A N THR 277.A OG1 no hydrogen 3.325 N/A ILE 281.A N THR 277.A O no hydrogen 3.005 N/A VAL 282.A N PHE 278.A O no hydrogen 2.817 N/A GLN 283.A N LYS 279.A O no hydrogen 3.208 N/A LEU 284.A N GLN 280.A O no hydrogen 2.917 N/A ILE 285.A N ILE 281.A O no hydrogen 3.220 N/A GLU 286.A N VAL 282.A O no hydrogen 2.975 N/A LYS 287.A N LEU 284.A O no hydrogen 2.721 N/A GLN 288.A N LEU 284.A O no hydrogen 3.045 N/A SER 290.A N LYS 287.A O no hydrogen 3.364 N/A SER 290.A OG LYS 287.A O no hydrogen 3.476 N/A