Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sdd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N CYS 99.A O no hydrogen 3.358 N/A ARG 6.A N TRP 26.A O no hydrogen 2.833 N/A CYS 7.A N ALA 97.A O no hydrogen 2.642 N/A LEU 8.A N VAL 24.A O no hydrogen 2.740 N/A GLN 9.A N LEU 95.A O no hydrogen 2.790 N/A GLN 9.A NE2 SER 11.A OG no hydrogen 2.812 N/A MET 10.A N ASP 22.A O no hydrogen 2.946 N/A SER 11.A N ILE 93.A O no hydrogen 2.808 N/A SER 11.A OG THR 21.A OG1 no hydrogen 3.120 N/A SER 12.A N ARG 20.A O no hydrogen 2.959 N/A SER 12.A OG GLU 92.A OE1 no hydrogen 2.623 N/A SER 12.A OG GLU 92.A OE2 no hydrogen 3.179 N/A PHE 13.A N ILE 91.A O no hydrogen 2.803 N/A TRP 18.A N ASN 15.A O no hydrogen 2.878 N/A TRP 18.A N ASN 15.A OD1 no hydrogen 2.934 N/A ARG 20.A N SER 12.A O no hydrogen 3.085 N/A ARG 20.A NE ASP 22.A OD1 no hydrogen 2.757 N/A ARG 20.A NH2 ASP 22.A OD2 no hydrogen 3.081 N/A THR 21.A N ASN 37.A OD1 no hydrogen 3.082 N/A THR 21.A OG1 SER 11.A OG no hydrogen 3.120 N/A ASP 22.A N MET 10.A O no hydrogen 3.050 N/A SER 23.A N TRP 35.A O no hydrogen 2.740 N/A VAL 24.A N LEU 8.A O no hydrogen 2.871 N/A VAL 25.A N HIS 33.A O no hydrogen 3.025 N/A TRP 26.A N ARG 6.A O no hydrogen 2.792 N/A LEU 27.A N LEU 30.A O no hydrogen 2.892 N/A GLY 28.A N THR 4.A O no hydrogen 3.364 N/A LEU 30.A N LEU 27.A O no hydrogen 2.862 N/A GLN 31.A NE2 HIS 33.A O no hydrogen 3.330 N/A THR 32.A N VAL 25.A O no hydrogen 2.758 N/A THR 32.A OG1 VAL 25.A O no hydrogen 3.298 N/A THR 32.A OG1 HIS 33.A ND1 no hydrogen 2.962 N/A HIS 33.A NE2 SER 49.A O no hydrogen 2.796 N/A ARG 34.A N SER 43.A O no hydrogen 3.002 N/A TRP 35.A N SER 23.A O no hydrogen 2.944 N/A TRP 35.A NE1 SER 39.A O no hydrogen 2.707 N/A SER 36.A OG ASP 38.A OD1 no hydrogen 2.634 N/A ASN 37.A N ASP 22.A OD2 no hydrogen 3.297 N/A SER 39.A OG THR 41.A O no hydrogen 2.523 N/A SER 43.A N ARG 34.A O no hydrogen 2.874 N/A THR 45.A N THR 32.A O no hydrogen 3.062 N/A THR 45.A OG1 GLN 31.A O no hydrogen 2.651 N/A LYS 46.A N SER 49.A OG no hydrogen 2.920 N/A LYS 46.A NZ GLN 31.A O no hydrogen 3.258 N/A TRP 48.A NE1 ASP 177.A OD2 no hydrogen 3.217 N/A SER 49.A N LYS 46.A O no hydrogen 3.371 N/A SER 49.A OG THR 32.A O no hydrogen 2.847 N/A SER 49.A OG LYS 46.A O no hydrogen 2.924 N/A GLN 50.A NE2 LEU 53.A O no hydrogen 2.886 N/A GLN 50.A NE2 ASN 55.A OD1 no hydrogen 3.427 N/A GLY 51.A N TRP 48.A O no hydrogen 3.088 N/A SER 54.A N GLN 57.A OE1 no hydrogen 2.930 N/A TRP 58.A N SER 54.A O no hydrogen 2.859 N/A GLU 59.A N ASN 55.A O no hydrogen 3.046 N/A LYS 60.A N GLN 56.A O no hydrogen 2.860 N/A GLN 62.A N TRP 58.A O no hydrogen 2.939 N/A HIS 63.A N GLU 59.A O no hydrogen 3.046 N/A MET 64.A N LYS 60.A O no hydrogen 2.972 N/A PHE 65.A N LEU 61.A O no hydrogen 2.758 N/A GLN 66.A N GLN 62.A O no hydrogen 2.836 N/A GLN 66.A NE2 ALA 40.A O no hydrogen 3.010 N/A VAL 67.A N HIS 63.A O no hydrogen 3.090 N/A TYR 68.A N MET 64.A O no hydrogen 3.148 N/A TYR 68.A OH GLN 9.A OE1 no hydrogen 2.739 N/A ARG 69.A N PHE 65.A O no hydrogen 2.866 N/A ARG 69.A NH1 SER 36.A O no hydrogen 3.456 N/A ARG 69.A NH1 SER 39.A O no hydrogen 3.000 N/A ARG 69.A NH2 SER 36.A O no hydrogen 2.853 N/A SER 71.A N VAL 67.A O no hydrogen 3.210 N/A SER 71.A OG VAL 67.A O no hydrogen 2.720 N/A PHE 72.A N TYR 68.A O no hydrogen 2.671 N/A THR 73.A N ARG 69.A O no hydrogen 3.088 N/A THR 73.A OG1 ARG 69.A O no hydrogen 3.168 N/A ARG 74.A N VAL 70.A O no hydrogen 3.379 N/A ASP 75.A N SER 71.A O no hydrogen 3.072 N/A ILE 76.A N PHE 72.A O no hydrogen 3.111 N/A GLN 77.A N THR 73.A O no hydrogen 3.225 N/A GLN 77.A NE2 ARG 16.A O no hydrogen 3.232 N/A GLU 78.A N ARG 74.A O no hydrogen 3.105 N/A LEU 79.A N ASP 75.A O no hydrogen 3.201 N/A VAL 80.A N ILE 76.A O no hydrogen 3.151 N/A LYS 81.A N GLN 77.A O no hydrogen 3.300 N/A MET 82.A N GLU 78.A O no hydrogen 3.028 N/A MET 83.A N LEU 79.A O no hydrogen 2.783 N/A ILE 91.A N PHE 13.A O no hydrogen 2.691 N/A GLU 92.A N GLN 116.A OE1 no hydrogen 2.599 N/A ILE 93.A N SER 11.A O no hydrogen 3.008 N/A GLN 94.A N ALA 114.A O no hydrogen 2.926 N/A LEU 95.A N GLN 9.A O no hydrogen 2.842 N/A SER 96.A N HIS 112.A O no hydrogen 2.811 N/A ALA 97.A N CYS 7.A O no hydrogen 3.226 N/A GLY 98.A N PHE 110.A O no hydrogen 3.091 N/A CYS 99.A N PHE 5.A O no hydrogen 3.249 N/A GLU 100.A N GLU 108.A O no hydrogen 2.800 N/A MET 101.A N TYR 3.A O no hydrogen 2.785 N/A SER 107.A OG ASN 105.A O no hydrogen 2.899 N/A SER 109.A OG LEU 159.A O no hydrogen 2.631 N/A PHE 110.A N GLY 98.A O no hydrogen 2.918 N/A HIS 112.A N SER 96.A O no hydrogen 2.925 N/A VAL 113.A N VAL 121.A O no hydrogen 2.797 N/A ALA 114.A N GLN 94.A O no hydrogen 2.753 N/A PHE 115.A N LYS 118.A O no hydrogen 2.718 N/A GLN 116.A N GLU 92.A O no hydrogen 2.781 N/A GLN 116.A NE2 PRO 90.A O no hydrogen 2.811 N/A LYS 118.A N PHE 115.A O no hydrogen 3.047 N/A LYS 118.A NZ GLY 133.A O no hydrogen 3.522 N/A VAL 120.A N VAL 113.A O no hydrogen 3.031 N/A VAL 121.A N VAL 113.A O no hydrogen 3.231 N/A ARG 122.A N GLN 129.A O no hydrogen 2.759 N/A ARG 122.A NH2 GLN 129.A OE1 no hydrogen 2.728 N/A PHE 123.A N LEU 111.A O no hydrogen 3.047 N/A TRP 124.A N SER 127.A O no hydrogen 2.804 N/A SER 127.A N TRP 124.A O no hydrogen 2.819 N/A TRP 128.A N ASN 146.A OD1 no hydrogen 2.952 N/A GLN 129.A N ARG 122.A O no hydrogen 2.798 N/A VAL 131.A N VAL 120.A O no hydrogen 2.825 N/A ALA 134.A N VAL 131.A O no hydrogen 3.123 N/A LEU 138.A N PRO 135.A O no hydrogen 3.301 N/A ASP 139.A N SER 136.A O no hydrogen 3.280 N/A ILE 142.A N LEU 138.A O no hydrogen 3.176 N/A LYS 143.A N ASP 139.A O no hydrogen 3.367 N/A VAL 144.A N LEU 140.A O no hydrogen 2.924 N/A LEU 145.A N PRO 141.A O no hydrogen 3.017 N/A ASN 146.A N ILE 142.A O no hydrogen 2.824 N/A ASN 146.A ND2 TRP 128.A O no hydrogen 3.202 N/A ALA 147.A N LYS 143.A O no hydrogen 3.269 N/A ASP 148.A N LEU 145.A O no hydrogen 3.433 N/A THR 151.A N ASP 148.A OD1 no hydrogen 3.077 N/A THR 151.A OG1 ASP 148.A OD2 no hydrogen 2.686 N/A SER 152.A OG THR 126.A O no hydrogen 2.597 N/A ALA 153.A N GLN 149.A O no hydrogen 3.006 N/A THR 154.A N GLY 150.A O no hydrogen 3.345 N/A THR 154.A OG1 GLY 150.A O no hydrogen 2.953 N/A VAL 155.A N THR 151.A O no hydrogen 2.968 N/A GLN 156.A N SER 152.A O no hydrogen 2.969 N/A GLN 156.A NE2 SER 152.A O no hydrogen 3.403 N/A GLN 156.A NE2 SER 152.A OG no hydrogen 2.865 N/A MET 157.A N ALA 153.A O no hydrogen 3.289 N/A LEU 158.A N THR 154.A O no hydrogen 3.059 N/A LEU 159.A N VAL 155.A O no hydrogen 2.928 N/A ASN 160.A N GLN 156.A O no hydrogen 3.105 N/A ASP 161.A N MET 157.A O no hydrogen 3.112 N/A THR 162.A N MET 157.A O no hydrogen 2.825 N/A THR 162.A OG1 MET 157.A O no hydrogen 2.879 N/A CYS 163.A N LEU 158.A O no hydrogen 2.755 N/A LEU 165.A N ASP 161.A O no hydrogen 3.273 N/A PHE 166.A N THR 162.A O no hydrogen 3.029 N/A VAL 167.A N CYS 163.A O no hydrogen 3.034 N/A ARG 168.A N PRO 164.A O no hydrogen 3.167 N/A LEU 170.A N PHE 166.A O no hydrogen 3.193 N/A LEU 171.A N VAL 167.A O no hydrogen 2.804 N/A GLU 172.A N ARG 168.A O no hydrogen 3.252 N/A ALA 173.A N GLY 169.A O no hydrogen 2.866 N/A GLY 174.A N LEU 170.A O no hydrogen 2.826 N/A LYS 175.A N GLU 172.A O no hydrogen 3.165 N/A LYS 175.A NZ GLU 179.A OE1 no hydrogen 2.811 N/A LEU 178.A N GLY 174.A O no hydrogen 3.120 N/A GLU 179.A N LYS 175.A O no hydrogen 3.184 N/A GLU 182.A N TYR 209.A O no hydrogen 2.805 N/A VAL 185.A N SER 206.A O no hydrogen 2.790 N/A TRP 187.A N HIS 204.A O no hydrogen 3.181 N/A SER 189.A N VAL 202.A O no hydrogen 2.773 N/A VAL 191.A N GLN 200.A O no hydrogen 2.991 N/A SER 193.A N HIS 198.A O no hydrogen 2.915 N/A SER 193.A OG ASP 247.A OD1 no hydrogen 2.933 N/A SER 193.A OG ASP 247.A OD2 no hydrogen 3.102 N/A ARG 199.A N VAL 248.A O no hydrogen 2.576 N/A ARG 199.A NH2 SER 190.A OG no hydrogen 2.882 N/A GLN 200.A N VAL 191.A O no hydrogen 2.818 N/A LEU 201.A N LEU 246.A O no hydrogen 2.711 N/A VAL 202.A N SER 189.A O no hydrogen 2.789 N/A CYS 203.A N ALA 244.A O no hydrogen 2.884 N/A CYS 203.A SG HIS 204.A O no hydrogen 4.016 N/A HIS 204.A N TRP 187.A O no hydrogen 3.065 N/A HIS 204.A ND1 TRP 187.A O no hydrogen 3.116 N/A VAL 205.A N LEU 242.A O no hydrogen 2.754 N/A SER 206.A N VAL 185.A O no hydrogen 3.056 N/A GLY 207.A N TRP 240.A O no hydrogen 2.926 N/A PHE 208.A N TRP 240.A O no hydrogen 3.418 N/A TYR 209.A N GLU 182.A O no hydrogen 3.177 N/A TYR 209.A OH ASP 29.A OD1 no hydrogen 2.655 N/A TRP 214.A N LYS 261.A O no hydrogen 3.000 N/A MET 216.A N ARG 259.A O no hydrogen 3.142 N/A TRP 217.A NE1 ALA 244.A O no hydrogen 2.919 N/A MET 218.A N ALA 257.A O no hydrogen 2.794 N/A ARG 219.A N GLN 222.A O no hydrogen 3.114 N/A ARG 219.A NH1 ALA 254.A O no hydrogen 2.950 N/A ARG 219.A NH2 GLU 252.A O no hydrogen 2.762 N/A GLN 224.A N TRP 217.A O no hydrogen 2.991 N/A THR 227.A OG1 GLN 224.A O no hydrogen 2.727 N/A HIS 228.A N THR 245.A O no hydrogen 2.754 N/A ARG 229.A NH1 VAL 213.A O no hydrogen 3.305 N/A GLY 230.A N GLN 243.A O no hydrogen 3.033 N/A LEU 233.A N TYR 241.A O no hydrogen 2.744 N/A ASN 235.A N THR 239.A O no hydrogen 2.748 N/A ASN 235.A ND2 THR 239.A OG1 no hydrogen 3.380 N/A THR 239.A OG1 ASP 237.A OD1 no hydrogen 2.836 N/A THR 239.A OG1 ASP 237.A OD2 no hydrogen 3.055 N/A TRP 240.A N PHE 208.A O no hydrogen 3.124 N/A TRP 240.A NE1 ASP 29.A OD2 no hydrogen 3.094 N/A TYR 241.A N LEU 233.A O no hydrogen 2.728 N/A TYR 241.A OH GLN 243.A OE1 no hydrogen 3.045 N/A LEU 242.A N VAL 205.A O no hydrogen 2.769 N/A ALA 244.A N CYS 203.A O no hydrogen 2.938 N/A THR 245.A N HIS 228.A O no hydrogen 3.104 N/A THR 245.A OG1 HIS 228.A O no hydrogen 3.496 N/A LEU 246.A N LEU 201.A O no hydrogen 2.933 N/A VAL 248.A N ARG 199.A O no hydrogen 2.968 N/A ALA 250.A N GLY 197.A O no hydrogen 3.262 N/A GLU 252.A N GLU 249.A O no hydrogen 3.316 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 2.745 N/A LEU 256.A N GLU 253.A O no hydrogen 3.266 N/A ALA 257.A N MET 218.A O no hydrogen 2.836 N/A CYS 258.A N LEU 272.A O no hydrogen 2.878 N/A ARG 259.A N MET 216.A O no hydrogen 3.116 N/A VAL 260.A N ILE 270.A O no hydrogen 2.818 N/A LYS 261.A N TRP 214.A O no hydrogen 2.811 N/A HIS 262.A ND1 SER 264.A OG no hydrogen 2.754 N/A HIS 262.A NE2 PRO 210.A O no hydrogen 2.917 N/A SER 263.A OG GLN 181.A OE1 no hydrogen 2.723 N/A SER 264.A N HIS 262.A ND1 no hydrogen 3.018 N/A SER 264.A OG GLU 182.A O no hydrogen 2.988 N/A SER 264.A OG HIS 262.A ND1 no hydrogen 2.754 N/A LEU 265.A N HIS 262.A O no hydrogen 3.270 N/A GLN 268.A N LEU 265.A O no hydrogen 3.090 N/A ILE 270.A N VAL 260.A O no hydrogen 2.936 N/A LEU 272.A N CYS 258.A O no hydrogen 3.004 N/A TRP 274.A N LEU 256.A O no hydrogen 2.821 N/A SER 276.A OG TYR 273.A O no hydrogen 3.326 N/A HIS 279.A N SER 276.A OG no hydrogen 2.870 N/A ILE 280.A N SER 276.A O no hydrogen 3.002 N/A LEU 281.A N LEU 277.A O no hydrogen 3.343 N/A ASP 282.A N HIS 278.A O no hydrogen 2.758 N/A ALA 283.A N HIS 279.A O no hydrogen 2.935 N/A GLN 284.A N ILE 280.A O no hydrogen 3.334 N/A GLN 284.A N LEU 281.A O no hydrogen 3.221 N/A MET 286.A N ALA 283.A O no hydrogen 3.075 N/A HIS 290.A N TRP 288.A O no hydrogen 3.017 N/A HIS 290.A N HIS 290.A ND1 no hydrogen 3.075 N/A HIS 290.A ND1 TRP 288.A O no hydrogen 3.068 N/A