Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tyd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N ASN 16.A OD1 no hydrogen 3.531 N/A TRP 2.A N ASN 16.A OD1 no hydrogen 2.623 N/A LEU 6.A N LEU 13.A O no hydrogen 2.856 N/A ARG 7.A NH2 TYR 11.A O no hydrogen 3.210 N/A CYS 8.A N TYR 11.A O no hydrogen 2.989 N/A CYS 8.A SG LEU 6.A O no hydrogen 3.879 N/A TYR 11.A N CYS 8.A O no hydrogen 2.650 N/A LEU 13.A N LEU 6.A O no hydrogen 2.905 N/A ASN 16.A N ASN 14.A OD1 no hydrogen 2.780 N/A ASN 16.A ND2 TRP 2.A O no hydrogen 2.878 N/A GLU 17.A N ASN 14.A OD1 no hydrogen 3.081 N/A LYS 18.A NZ GLU 17.A OE2 no hydrogen 3.359 N/A THR 19.A N ASP 266.A OD1 no hydrogen 3.001 N/A THR 19.A OG1 ASP 266.A OD1 no hydrogen 3.563 N/A THR 19.A OG1 ASP 266.A OD2 no hydrogen 2.646 N/A LEU 20.A N GLU 248.A O no hydrogen 2.965 N/A ILE 21.A N HIS 55.A ND1 no hydrogen 2.978 N/A MET 22.A N VAL 250.A O no hydrogen 2.774 N/A GLY 23.A N ILE 56.A O no hydrogen 2.658 N/A ILE 24.A N VAL 252.A O no hydrogen 3.034 N/A LEU 25.A N ASP 58.A O no hydrogen 3.003 N/A VAL 27.A N GLY 60.A O no hydrogen 2.792 N/A THR 28.A OG1 ASN 26.A OD1 no hydrogen 2.627 N/A SER 33.A OG SER 31.A O no hydrogen 3.053 N/A SER 33.A OG GLU 38.A OE2 no hydrogen 3.451 N/A SER 35.A OG GLU 38.A OE1 no hydrogen 3.114 N/A GLU 38.A N SER 35.A O no hydrogen 3.126 N/A VAL 39.A N SER 35.A O no hydrogen 3.353 N/A ASP 40.A N TYR 36.A O no hydrogen 2.666 N/A ALA 41.A N ASN 37.A O no hydrogen 3.069 N/A ALA 42.A N GLU 38.A O no hydrogen 2.906 N/A VAL 43.A N VAL 39.A O no hydrogen 2.944 N/A ARG 44.A N ASP 40.A O no hydrogen 3.040 N/A HIS 45.A N ALA 41.A O no hydrogen 3.234 N/A ALA 46.A N ALA 42.A O no hydrogen 2.867 N/A LYS 47.A N VAL 43.A O no hydrogen 2.755 N/A GLU 48.A N ARG 44.A O no hydrogen 2.926 N/A MET 49.A N HIS 45.A O no hydrogen 2.968 N/A ARG 50.A N ALA 46.A O no hydrogen 2.939 N/A ARG 50.A NH1 ASP 51.A OD1 no hydrogen 2.644 N/A ASP 51.A N LYS 47.A O no hydrogen 2.838 N/A GLU 52.A N MET 49.A O no hydrogen 2.903 N/A GLY 53.A N ARG 50.A O no hydrogen 3.289 N/A ALA 54.A N MET 49.A O no hydrogen 2.909 N/A HIS 55.A N ILE 21.A O no hydrogen 2.810 N/A ILE 56.A N ILE 21.A O no hydrogen 2.996 N/A ILE 57.A N PRO 94.A O no hydrogen 2.973 N/A ASP 58.A N GLY 23.A O no hydrogen 2.844 N/A ILE 59.A N SER 96.A O no hydrogen 3.037 N/A GLY 60.A N LEU 25.A O no hydrogen 3.292 N/A SER 63.A N THR 28.A OG1 no hydrogen 3.289 N/A ALA 69.A N PRO 29.A O no hydrogen 2.937 N/A SER 72.A OG GLU 75.A OE1 no hydrogen 3.226 N/A GLU 74.A N GLU 74.A OE2 no hydrogen 2.886 N/A GLU 75.A N SER 72.A O no hydrogen 2.982 N/A GLU 76.A N SER 72.A O no hydrogen 2.953 N/A ILE 77.A N VAL 73.A O no hydrogen 3.097 N/A ARG 79.A N GLU 75.A O no hydrogen 3.105 N/A ARG 79.A NH1 GLU 38.A OE2 no hydrogen 3.452 N/A ARG 79.A NH2 GLU 38.A OE2 no hydrogen 2.951 N/A VAL 80.A N GLU 76.A O no hydrogen 2.705 N/A VAL 81.A N ILE 77.A O no hydrogen 2.899 N/A ILE 84.A N VAL 80.A O no hydrogen 3.086 N/A GLN 85.A N VAL 81.A O no hydrogen 2.933 N/A ALA 86.A N PRO 82.A O no hydrogen 3.121 N/A VAL 87.A N MET 83.A O no hydrogen 3.136 N/A SER 88.A N ILE 84.A O no hydrogen 2.981 N/A SER 88.A OG ILE 84.A O no hydrogen 2.745 N/A SER 88.A OG GLN 85.A O no hydrogen 3.483 N/A LYS 89.A N ALA 86.A O no hydrogen 2.961 N/A GLU 90.A N ALA 86.A O no hydrogen 2.996 N/A GLU 90.A N VAL 87.A O no hydrogen 3.124 N/A VAL 91.A N VAL 87.A O no hydrogen 2.635 N/A ILE 95.A N HIS 114.A ND1 no hydrogen 3.086 N/A SER 96.A N ILE 57.A O no hydrogen 2.784 N/A SER 96.A OG ILE 57.A O no hydrogen 3.352 N/A SER 96.A OG ASP 58.A OD2 no hydrogen 2.479 N/A ILE 97.A N ILE 115.A O no hydrogen 2.906 N/A ASP 98.A N ILE 59.A O no hydrogen 2.919 N/A THR 99.A N ASN 117.A O no hydrogen 3.252 N/A THR 99.A OG1 GLU 62.A OE2 no hydrogen 2.813 N/A THR 99.A OG1 LYS 101.A O no hydrogen 3.416 N/A LYS 101.A N THR 99.A OG1 no hydrogen 2.824 N/A ALA 102.A N GLU 125.A OE1 no hydrogen 2.509 N/A ALA 105.A N LYS 101.A O no hydrogen 3.428 N/A LYS 106.A N ALA 102.A O no hydrogen 3.212 N/A GLN 107.A N GLU 103.A O no hydrogen 3.345 N/A ALA 108.A N VAL 104.A O no hydrogen 2.842 N/A ILE 109.A N ALA 105.A O no hydrogen 2.911 N/A GLU 110.A N LYS 106.A O no hydrogen 3.116 N/A ALA 111.A N GLN 107.A O no hydrogen 2.841 N/A GLY 112.A N ILE 109.A O no hydrogen 2.583 N/A ALA 113.A N ALA 108.A O no hydrogen 2.970 N/A HIS 114.A N ILE 95.A O no hydrogen 2.624 N/A ILE 115.A N ILE 95.A O no hydrogen 3.098 N/A ILE 116.A N PRO 138.A O no hydrogen 2.786 N/A ASN 117.A N ILE 97.A O no hydrogen 2.867 N/A ASN 117.A ND2 ASP 58.A OD1 no hydrogen 3.265 N/A ASN 117.A ND2 ASP 58.A OD2 no hydrogen 3.342 N/A ASP 118.A N ILE 140.A O no hydrogen 2.967 N/A TRP 120.A N ASP 118.A OD2 no hydrogen 2.696 N/A GLY 121.A N ASP 118.A O no hydrogen 3.280 N/A ALA 122.A N ASP 118.A OD1 no hydrogen 2.848 N/A LYS 123.A N TRP 120.A O no hydrogen 3.185 N/A LYS 123.A NZ ASP 160.A O no hydrogen 2.933 N/A ILE 128.A N GLU 125.A O no hydrogen 2.654 N/A ALA 129.A N PRO 126.A O no hydrogen 2.883 N/A GLU 130.A N LYS 127.A O no hydrogen 2.907 N/A VAL 131.A N LYS 127.A O no hydrogen 3.148 N/A ALA 132.A N ILE 128.A O no hydrogen 2.942 N/A ALA 133.A N ALA 129.A O no hydrogen 2.525 N/A HIS 134.A N GLU 130.A O no hydrogen 2.779 N/A TYR 135.A N VAL 131.A O no hydrogen 3.220 N/A TYR 135.A OH GLU 110.A OE2 no hydrogen 2.651 N/A ASP 136.A N ALA 133.A O no hydrogen 3.006 N/A ILE 139.A N ASN 177.A O no hydrogen 2.769 N/A ILE 140.A N ILE 116.A O no hydrogen 2.649 N/A LEU 141.A N ILE 179.A O no hydrogen 2.781 N/A MET 142.A N ASP 118.A O no hydrogen 3.206 N/A HIS 143.A N ASP 181.A O no hydrogen 2.784 N/A HIS 143.A NE2 ASP 160.A OD2 no hydrogen 2.568 N/A ASN 144.A ND2 ILE 119.A O no hydrogen 2.743 N/A ARG 145.A N ASN 144.A OD1 no hydrogen 3.076 N/A ARG 145.A NE ASP 160.A OD2 no hydrogen 3.150 N/A ARG 145.A NH1 ASN 147.A OD1 no hydrogen 3.500 N/A ARG 145.A NH2 ASP 160.A OD1 no hydrogen 3.228 N/A ARG 145.A NH2 ASP 160.A OD2 no hydrogen 2.958 N/A ASN 147.A ND2 ASP 146.A OD1 no hydrogen 2.864 N/A ASN 149.A N ASN 147.A OD1 no hydrogen 2.942 N/A TYR 150.A OH ALA 187.A O no hydrogen 3.033 N/A ASN 152.A N ASP 156.A OD2 no hydrogen 3.300 N/A ALA 155.A N ASN 152.A OD1 no hydrogen 3.396 N/A ASP 156.A N ASN 152.A O no hydrogen 2.713 N/A MET 157.A N LEU 153.A O no hydrogen 2.768 N/A ILE 158.A N MET 154.A O no hydrogen 2.902 N/A ALA 159.A N ALA 155.A O no hydrogen 3.007 N/A ASP 160.A N ASP 156.A O no hydrogen 3.047 N/A LEU 161.A N MET 157.A O no hydrogen 2.913 N/A TYR 162.A N ILE 158.A O no hydrogen 2.914 N/A ASP 163.A N ALA 159.A O no hydrogen 2.908 N/A SER 164.A N ASP 160.A O no hydrogen 2.974 N/A SER 164.A OG GLY 121.A O no hydrogen 2.670 N/A SER 164.A OG ASP 160.A O no hydrogen 3.517 N/A ILE 165.A N LEU 161.A O no hydrogen 2.879 N/A LYS 166.A N TYR 162.A O no hydrogen 2.870 N/A ILE 167.A N ASP 163.A O no hydrogen 3.321 N/A ALA 168.A N SER 164.A O no hydrogen 3.027 N/A LYS 169.A N ILE 165.A O no hydrogen 2.692 N/A LYS 169.A NZ ASP 175.A OD1 no hydrogen 3.024 N/A LYS 169.A NZ ASP 175.A OD2 no hydrogen 3.264 N/A ASP 170.A N LYS 166.A O no hydrogen 2.815 N/A ALA 171.A N ILE 167.A O no hydrogen 3.185 N/A ALA 171.A N ALA 168.A O no hydrogen 3.107 N/A GLY 172.A N ALA 168.A O no hydrogen 3.207 N/A GLY 172.A N LYS 169.A O no hydrogen 3.037 N/A VAL 173.A N ALA 168.A O no hydrogen 3.250 N/A ARG 174.A NH2 ASP 136.A OD1 no hydrogen 3.528 N/A ASN 177.A N ARG 174.A O no hydrogen 2.902 N/A ILE 178.A N ASP 175.A O no hydrogen 3.179 N/A ILE 179.A N ILE 139.A O no hydrogen 3.070 N/A LEU 180.A N PRO 209.A O no hydrogen 2.815 N/A ASP 181.A N LEU 141.A O no hydrogen 3.177 N/A GLY 183.A N ASP 181.A OD2 no hydrogen 2.648 N/A GLY 185.A N ASN 193.A OD1 no hydrogen 2.888 N/A PHE 186.A N GLY 183.A O no hydrogen 2.948 N/A LYS 188.A NZ HIS 143.A ND1 no hydrogen 2.962 N/A LYS 188.A NZ PRO 182.A O no hydrogen 3.172 N/A LYS 188.A NZ GLY 183.A O no hydrogen 2.887 N/A LYS 188.A NZ PHE 186.A O no hydrogen 2.804 N/A THR 189.A N GLN 192.A OE1 no hydrogen 2.796 N/A GLN 192.A N THR 189.A OG1 no hydrogen 3.039 N/A ASN 193.A N THR 189.A O no hydrogen 2.839 N/A LEU 194.A N PRO 190.A O no hydrogen 3.147 N/A GLU 195.A N GLU 191.A O no hydrogen 2.938 N/A ALA 196.A N GLN 192.A O no hydrogen 2.800 N/A MET 197.A N ASN 193.A O no hydrogen 3.118 N/A ARG 198.A N LEU 194.A O no hydrogen 2.850 N/A ARG 198.A NH2 GLU 191.A OE2 no hydrogen 3.491 N/A ASN 199.A N ALA 196.A O no hydrogen 3.269 N/A ASN 199.A ND2 GLU 195.A O no hydrogen 2.815 N/A LEU 200.A N MET 197.A O no hydrogen 3.352 N/A GLU 201.A N GLU 201.A OE2 no hydrogen 2.868 N/A GLN 202.A N ASN 199.A O no hydrogen 2.987 N/A LEU 203.A N LEU 200.A O no hydrogen 2.834 N/A ASN 204.A N GLU 201.A O no hydrogen 3.021 N/A ASN 204.A ND2 LYS 245.A O no hydrogen 3.107 N/A VAL 205.A N GLN 202.A O no hydrogen 3.203 N/A LEU 206.A N LEU 203.A O no hydrogen 3.031 N/A GLY 207.A N ASN 204.A O no hydrogen 2.995 N/A TYR 208.A OH ASP 175.A OD1 no hydrogen 2.593 N/A LEU 211.A N LEU 180.A O no hydrogen 2.659 N/A LEU 212.A N PHE 249.A O no hydrogen 2.934 N/A THR 214.A OG1 THR 238.A OG1 no hydrogen 2.527 N/A SER 215.A OG HIS 253.A ND1 no hydrogen 2.735 N/A ARG 216.A N THR 235.A OG1 no hydrogen 2.860 N/A ARG 216.A NH2 ASP 254.A OD2 no hydrogen 2.783 N/A LYS 217.A N THR 214.A O no hydrogen 3.104 N/A LYS 217.A NZ ILE 184.A O no hydrogen 2.709 N/A LYS 217.A NZ GLY 213.A O no hydrogen 3.020 N/A ILE 220.A N LYS 217.A O no hydrogen 3.138 N/A HIS 222.A N SER 218.A O no hydrogen 2.821 N/A VAL 223.A N PHE 219.A O no hydrogen 3.139 N/A LEU 224.A N ILE 220.A O no hydrogen 2.987 N/A LEU 226.A N GLY 221.A O no hydrogen 3.260 N/A GLU 229.A N GLU 229.A OE1 no hydrogen 2.868 N/A GLU 230.A N PRO 227.A O no hydrogen 2.759 N/A ARG 231.A NE LEU 226.A O no hydrogen 2.930 N/A ARG 231.A NH1 ARG 216.A O no hydrogen 2.734 N/A ARG 231.A NH2 LEU 226.A O no hydrogen 3.105 N/A GLU 233.A N GLU 233.A OE1 no hydrogen 2.716 N/A THR 235.A N ARG 231.A O no hydrogen 2.787 N/A THR 235.A OG1 ARG 231.A O no hydrogen 2.747 N/A GLY 236.A N LEU 232.A O no hydrogen 2.674 N/A ALA 237.A N GLU 233.A O no hydrogen 2.973 N/A THR 238.A N GLY 234.A O no hydrogen 3.096 N/A THR 238.A OG1 THR 214.A OG1 no hydrogen 2.527 N/A THR 238.A OG1 THR 235.A O no hydrogen 2.586 N/A VAL 239.A N THR 235.A O no hydrogen 2.950 N/A CYS 240.A N GLY 236.A O no hydrogen 2.879 N/A CYS 240.A SG GLY 236.A O no hydrogen 3.582 N/A LEU 241.A N ALA 237.A O no hydrogen 3.134 N/A GLY 242.A N THR 238.A O no hydrogen 2.705 N/A ILE 243.A N VAL 239.A O no hydrogen 2.890 N/A GLU 244.A N CYS 240.A O no hydrogen 2.874 N/A LYS 245.A N LEU 241.A O no hydrogen 2.755 N/A LYS 245.A NZ ARG 198.A O no hydrogen 3.131 N/A LYS 245.A NZ GLU 201.A OE2 no hydrogen 2.849 N/A GLY 246.A N ILE 243.A O no hydrogen 2.758 N/A CYS 247.A N GLY 242.A O no hydrogen 2.973 N/A CYS 247.A SG GLY 242.A O no hydrogen 3.207 N/A GLU 248.A N VAL 210.A O no hydrogen 2.915 N/A PHE 249.A N VAL 210.A O no hydrogen 3.231 N/A VAL 250.A N LEU 20.A O no hydrogen 3.072 N/A ARG 251.A N LEU 212.A O no hydrogen 2.796 N/A ARG 251.A NE ASP 58.A OD1 no hydrogen 2.924 N/A ARG 251.A NH2 ASP 58.A OD1 no hydrogen 3.514 N/A VAL 252.A N MET 22.A O no hydrogen 2.933 N/A HIS 253.A N SER 215.A OG no hydrogen 3.021 N/A HIS 253.A ND1 SER 215.A OG no hydrogen 2.735 N/A LYS 256.A N GLU 52.A OE1 no hydrogen 3.361 N/A GLU 257.A N GLU 257.A OE1 no hydrogen 2.579 N/A MET 258.A N ASP 254.A O no hydrogen 2.896 N/A SER 259.A N VAL 255.A O no hydrogen 2.858 N/A SER 259.A OG GLU 52.A O no hydrogen 3.537 N/A SER 259.A OG VAL 255.A O no hydrogen 3.069 N/A ARG 260.A N LYS 256.A O no hydrogen 3.421 N/A MET 261.A N GLU 257.A O no hydrogen 3.135 N/A ALA 262.A N MET 258.A O no hydrogen 2.736 N/A LYS 263.A N SER 259.A O no hydrogen 2.914 N/A MET 264.A N ARG 260.A O no hydrogen 2.871 N/A MET 265.A N MET 261.A O no hydrogen 2.990 N/A ASP 266.A N ALA 262.A O no hydrogen 2.857 N/A ALA 267.A N LYS 263.A O no hydrogen 3.215 N/A MET 268.A N MET 264.A O no hydrogen 3.031 N/A ILE 269.A N MET 265.A O no hydrogen 2.615 N/A GLY 270.A N ASP 266.A O no hydrogen 2.834 N/A LYS 271.A N ASP 266.A O no hydrogen 2.847 N/A LYS 271.A NZ THR 19.A OG1 no hydrogen 2.737 N/A LYS 271.A NZ CYS 247.A O no hydrogen 3.149 N/A LYS 271.A NZ GLU 248.A OE1 no hydrogen 3.022 N/A