Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6tnd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A SG GLU 1.A O no hydrogen 3.666 N/A CYS 2.A SG GLU 1.A OE2 no hydrogen 3.865 N/A CYS 2.A SG TYR 10.A O no hydrogen 3.651 N/A ILE 3.A N TYR 10.A O no hydrogen 2.799 N/A SER 4.A OG GLY 7.A O no hydrogen 3.071 N/A SER 4.A OG ARG 8.A O no hydrogen 3.474 N/A VAL 5.A N ARG 8.A O no hydrogen 2.874 N/A LYS 6.A N GLU 77.A OE1 no hydrogen 2.613 N/A LYS 6.A NZ TYR 76.A O no hydrogen 2.948 N/A ARG 8.A N VAL 5.A O no hydrogen 3.109 N/A TYR 10.A N ILE 3.A O no hydrogen 2.775 N/A SER 11.A N LEU 28.A O no hydrogen 2.700 N/A ILE 12.A N GLU 1.A O no hydrogen 3.371 N/A LEU 13.A N GLN 26.A O no hydrogen 3.024 N/A LYS 14.A N GLN 26.A O no hydrogen 3.297 N/A LYS 14.A NZ GLN 26.A OE1 no hydrogen 3.440 N/A ILE 16.A N VAL 24.A O no hydrogen 2.753 N/A GLY 17.A N VAL 24.A O no hydrogen 3.321 N/A SER 18.A N GLN 157.A O no hydrogen 3.021 N/A GLY 19.A N SER 22.A O no hydrogen 3.216 N/A SER 21.A N GLN 155.A OE1 no hydrogen 3.311 N/A SER 21.A OG GLN 155.A OE1 no hydrogen 3.456 N/A SER 22.A N GLY 19.A O no hydrogen 2.793 N/A SER 22.A OG GLY 19.A O no hydrogen 3.100 N/A SER 22.A OG TYR 53.A OH no hydrogen 3.077 N/A LYS 23.A N TYR 39.A O no hydrogen 2.991 N/A VAL 24.A N GLY 17.A O no hydrogen 2.984 N/A PHE 25.A N ILE 37.A O no hydrogen 2.856 N/A LEU 28.A N SER 11.A O no hydrogen 2.869 N/A ASN 29.A N GLN 33.A O no hydrogen 2.981 N/A LYS 32.A N ASN 29.A O no hydrogen 3.101 N/A GLN 33.A N ASN 29.A OD1 no hydrogen 2.832 N/A TYR 35.A N VAL 27.A O no hydrogen 2.950 N/A ALA 36.A N MET 87.A O no hydrogen 2.760 N/A ILE 37.A N PHE 25.A O no hydrogen 2.759 N/A LYS 38.A N MET 85.A O no hydrogen 2.941 N/A LYS 38.A NZ GLU 56.A OE1 no hydrogen 2.725 N/A LYS 38.A NZ GLU 56.A OE2 no hydrogen 3.472 N/A TYR 39.A N LYS 23.A O no hydrogen 2.789 N/A VAL 40.A N ILE 83.A O no hydrogen 2.736 N/A ASN 41.A N SER 21.A O no hydrogen 2.954 N/A LEU 42.A N GLN 81.A O no hydrogen 2.681 N/A GLU 43.A N ASN 41.A OD1 no hydrogen 3.405 N/A ASP 46.A N ASP 46.A OD1 no hydrogen 2.272 N/A THR 49.A OG1 ASP 46.A OD2 no hydrogen 2.893 N/A LEU 50.A N ASP 46.A O no hydrogen 3.078 N/A ASP 51.A N ASN 47.A O no hydrogen 3.046 N/A SER 52.A N GLN 48.A O no hydrogen 3.236 N/A SER 52.A OG THR 49.A O no hydrogen 2.627 N/A TYR 53.A N THR 49.A O no hydrogen 2.949 N/A TYR 53.A OH GLN 155.A OE1 no hydrogen 3.046 N/A ARG 54.A N LEU 50.A O no hydrogen 2.885 N/A ASN 55.A N ASP 51.A O no hydrogen 2.942 N/A GLU 56.A N SER 52.A O no hydrogen 2.908 N/A ILE 57.A N TYR 53.A O no hydrogen 3.177 N/A ALA 58.A N ARG 54.A O no hydrogen 3.153 N/A TYR 59.A N ASN 55.A O no hydrogen 2.933 N/A LEU 60.A N GLU 56.A O no hydrogen 2.817 N/A ASN 61.A N ILE 57.A O no hydrogen 2.820 N/A LYS 62.A N ALA 58.A O no hydrogen 3.005 N/A LEU 63.A N TYR 59.A O no hydrogen 2.973 N/A GLN 65.A NE2 ASN 61.A O no hydrogen 2.779 N/A SER 67.A N LEU 63.A O no hydrogen 3.401 N/A SER 67.A OG GLU 118.A OE2 no hydrogen 2.574 N/A LYS 69.A N SER 67.A OG no hydrogen 3.263 N/A LYS 69.A NZ ASP 68.A OD1 no hydrogen 2.819 N/A LYS 69.A NZ GLU 118.A OE1 no hydrogen 2.673 N/A ILE 71.A N LEU 147.A O no hydrogen 3.056 N/A ARG 72.A N GLU 88.A OE2 no hydrogen 3.069 N/A ARG 72.A NH1 SER 67.A O no hydrogen 3.548 N/A ARG 72.A NH2 GLN 64.A O no hydrogen 2.568 N/A ARG 72.A NH2 SER 67.A O no hydrogen 2.567 N/A LEU 73.A N GLN 64.A OE1 no hydrogen 2.954 N/A TYR 74.A N VAL 86.A O no hydrogen 2.816 N/A ASP 75.A N VAL 86.A O no hydrogen 3.398 N/A GLU 77.A N TYR 84.A O no hydrogen 2.892 N/A THR 79.A N TYR 82.A O no hydrogen 2.856 N/A TYR 82.A OH GLU 77.A OE2 no hydrogen 2.314 N/A ILE 83.A N VAL 40.A O no hydrogen 2.731 N/A TYR 84.A N GLU 77.A O no hydrogen 2.855 N/A MET 85.A N LYS 38.A O no hydrogen 2.846 N/A VAL 86.A N ASP 75.A O no hydrogen 2.699 N/A MET 87.A N ALA 36.A O no hydrogen 2.754 N/A GLU 88.A N ARG 72.A O no hydrogen 3.109 N/A CYS 89.A SG GLY 90.A O no hydrogen 3.605 N/A ASN 91.A N ILE 140.A O no hydrogen 3.009 N/A LEU 94.A N PHE 138.A O no hydrogen 2.885 N/A SER 96.A N ASP 93.A OD2 no hydrogen 2.995 N/A SER 96.A OG ASP 93.A OD1 no hydrogen 2.507 N/A SER 96.A OG ASP 93.A OD2 no hydrogen 3.266 N/A TRP 97.A N ASP 93.A O no hydrogen 3.152 N/A LEU 98.A N LEU 94.A O no hydrogen 2.963 N/A LYS 99.A N ASN 95.A O no hydrogen 3.187 N/A LYS 100.A N SER 96.A O no hydrogen 3.464 N/A LYS 101.A N TRP 97.A O no hydrogen 3.297 N/A TRP 107.A N ASP 105.A OD1 no hydrogen 3.443 N/A ARG 109.A N ASP 105.A O no hydrogen 2.907 N/A ARG 109.A NH1 MET 188.A O no hydrogen 3.098 N/A ARG 109.A NH2 GLU 222.A OE2 no hydrogen 3.025 N/A LYS 110.A N PRO 106.A O no hydrogen 3.121 N/A SER 111.A N TRP 107.A O no hydrogen 3.061 N/A TYR 112.A N GLU 108.A O no hydrogen 2.997 N/A TRP 113.A N ARG 109.A O no hydrogen 2.908 N/A LYS 114.A N LYS 110.A O no hydrogen 2.967 N/A ASN 115.A N SER 111.A O no hydrogen 3.083 N/A MET 116.A N TYR 112.A O no hydrogen 2.731 N/A LEU 117.A N TRP 113.A O no hydrogen 2.858 N/A GLU 118.A N LYS 114.A O no hydrogen 2.888 N/A ALA 119.A N ASN 115.A O no hydrogen 3.029 N/A VAL 120.A N MET 116.A O no hydrogen 3.039 N/A HIS 121.A N LEU 117.A O no hydrogen 2.829 N/A THR 122.A N GLU 118.A O no hydrogen 3.002 N/A THR 122.A OG1 GLU 118.A O no hydrogen 2.713 N/A ILE 123.A N ALA 119.A O no hydrogen 3.244 N/A HIS 124.A N VAL 120.A O no hydrogen 2.931 N/A HIS 124.A NE2 ASP 177.A OD2 no hydrogen 2.745 N/A GLN 125.A N HIS 121.A O no hydrogen 2.952 N/A HIS 126.A N THR 122.A O no hydrogen 3.311 N/A HIS 126.A N ILE 123.A O no hydrogen 3.127 N/A HIS 126.A ND1 THR 122.A O no hydrogen 2.959 N/A GLY 127.A N HIS 124.A O no hydrogen 2.952 N/A ILE 128.A N ILE 123.A O no hydrogen 2.963 N/A HIS 130.A N ASP 177.A OD2 no hydrogen 2.972 N/A HIS 130.A NE2 ASP 149.A OD1 no hydrogen 2.780 N/A SER 131.A N ASP 177.A OD1 no hydrogen 2.841 N/A ASP 132.A N HIS 130.A ND1 no hydrogen 3.069 N/A LYS 134.A N ASN 137.A OD1 no hydrogen 2.951 N/A LYS 134.A NZ ASP 132.A O no hydrogen 3.187 N/A LYS 134.A NZ ASP 132.A OD2 no hydrogen 3.452 N/A LYS 134.A NZ ASN 137.A OD1 no hydrogen 2.941 N/A ASN 137.A N LYS 134.A O no hydrogen 3.153 N/A ASN 137.A ND2 ASP 149.A OD1 no hydrogen 2.663 N/A PHE 138.A N PRO 135.A O no hydrogen 2.976 N/A LEU 139.A N LYS 146.A O no hydrogen 2.916 N/A ILE 140.A N ILE 92.A O no hydrogen 2.783 N/A VAL 141.A N MET 144.A O no hydrogen 2.949 N/A MET 144.A N VAL 141.A O no hydrogen 3.443 N/A LYS 146.A N LEU 139.A O no hydrogen 2.888 N/A LYS 146.A NZ ASP 68.A O no hydrogen 2.748 N/A LYS 146.A NZ ILE 70.A O no hydrogen 3.495 N/A LYS 146.A NZ GLU 88.A OE2 no hydrogen 2.865 N/A LEU 147.A N LYS 69.A O no hydrogen 2.675 N/A ILE 148.A N.A ASN 137.A O no hydrogen 2.974 N/A ILE 148.A N.B ASN 137.A O no hydrogen 3.029 N/A ASN 154.A ND2 GLY 151.A O no hydrogen 2.797 N/A MET 163.A N VAL 160.A O no hydrogen 3.288 N/A GLU 166.A N GLU 166.A OE2 no hydrogen 2.926 N/A ALA 167.A N PRO 164.A O no hydrogen 3.124 N/A ILE 168.A N PRO 165.A O no hydrogen 3.189 N/A LYS 169.A N PRO 165.A O no hydrogen 2.879 N/A ASP 170.A N GLU 166.A O no hydrogen 3.155 N/A MET 171.A N LYS 169.A O no hydrogen 3.028 N/A LYS 175.A N SER 173.A OG no hydrogen 2.885 N/A LYS 175.A NZ PRO 237.A O no hydrogen 2.826 N/A LYS 175.A NZ ARG 240.A O no hydrogen 2.744 N/A SER 176.A N SER 173.A O no hydrogen 3.103 N/A SER 176.A OG GLU 166.A OE1 no hydrogen 2.786 N/A SER 176.A OG SER 173.A O no hydrogen 3.235 N/A ASP 177.A N PRO 174.A O no hydrogen 2.981 N/A TRP 179.A N LYS 175.A O no hydrogen 3.268 N/A SER 180.A N SER 176.A O no hydrogen 3.462 N/A SER 180.A OG TYR 162.A O no hydrogen 2.831 N/A LEU 181.A N ASP 177.A O no hydrogen 2.862 N/A GLY 182.A N VAL 178.A O no hydrogen 2.843 N/A CYS 183.A N TRP 179.A O no hydrogen 2.903 N/A CYS 183.A SG ASN 161.A O no hydrogen 3.743 N/A CYS 183.A SG TRP 179.A O no hydrogen 3.698 N/A ILE 184.A N SER 180.A O no hydrogen 2.984 N/A LEU 185.A N LEU 181.A O no hydrogen 2.702 N/A TYR 186.A N GLY 182.A O no hydrogen 2.851 N/A TYR 186.A OH GLU 216.A O no hydrogen 2.738 N/A TYR 187.A N CYS 183.A O no hydrogen 2.913 N/A MET 188.A N ILE 184.A O no hydrogen 3.005 N/A THR 189.A N TYR 186.A O no hydrogen 3.127 N/A TYR 190.A N TYR 186.A O no hydrogen 2.934 N/A TYR 190.A OH PRO 218.A O no hydrogen 2.786 N/A GLY 191.A N TYR 187.A O no hydrogen 2.779 N/A LYS 192.A NZ THR 193.A O no hydrogen 3.430 N/A LYS 192.A NZ GLN 197.A OE1 no hydrogen 2.907 N/A GLN 197.A NE2 PRO 194.A O no hydrogen 3.435 N/A GLN 201.A NE2 ILE 199.A O no hydrogen 3.404 N/A SER 203.A N ASN 200.A OD1 no hydrogen 2.960 N/A LYS 204.A N GLN 201.A O no hydrogen 3.098 N/A LYS 204.A NZ ASN 161.A OD1 no hydrogen 2.662 N/A LYS 204.A NZ PHE 195.A O no hydrogen 2.869 N/A LYS 204.A NZ GLN 196.A O no hydrogen 3.216 N/A LYS 204.A NZ ILE 198.A O no hydrogen 3.399 N/A LEU 205.A N GLN 201.A O no hydrogen 3.273 N/A ALA 207.A N SER 203.A O no hydrogen 3.248 N/A ILE 208.A N LYS 204.A O no hydrogen 2.946 N/A ASP 210.A N HIS 206.A O no hydrogen 2.955 N/A ASN 212.A N ASP 210.A OD1 no hydrogen 2.838 N/A HIS 213.A N ASP 210.A O no hydrogen 3.135 N/A LYS 223.A NZ ILE 220.A O no hydrogen 2.717 N/A GLN 226.A N GLU 222.A O no hydrogen 3.354 N/A GLN 226.A NE2 PHE 217.A O no hydrogen 3.151 N/A GLN 226.A NE2 ASP 219.A OD1 no hydrogen 3.481 N/A ASP 227.A N LYS 223.A O no hydrogen 3.168 N/A VAL 228.A N ASP 224.A O no hydrogen 2.906 N/A LEU 229.A N LEU 225.A O no hydrogen 2.936 N/A LYS 230.A N GLN 226.A O no hydrogen 3.070 N/A CYS 231.A N ASP 227.A O no hydrogen 2.929 N/A CYS 231.A SG ASP 227.A O no hydrogen 3.208 N/A CYS 231.A SG ASP 227.A OD1 no hydrogen 3.811 N/A CYS 231.A SG ASP 227.A OD2 no hydrogen 3.763 N/A CYS 232.A N VAL 228.A O no hydrogen 2.909 N/A CYS 232.A SG VAL 228.A O no hydrogen 3.212 N/A LEU 233.A N LEU 229.A O no hydrogen 2.993 N/A ARG 235.A NE ILE 208.A O no hydrogen 2.836 N/A ARG 235.A NH1 HIS 213.A O no hydrogen 2.749 N/A ARG 235.A NH2 ALA 207.A O no hydrogen 2.948 N/A ARG 235.A NH2 HIS 213.A O no hydrogen 2.713 N/A LYS 238.A N ASP 236.A OD1 no hydrogen 3.144 N/A GLN 239.A N ASP 236.A O no hydrogen 2.736 N/A ARG 240.A N PRO 237.A O no hydrogen 3.255 N/A ARG 240.A NE LYS 175.A O no hydrogen 3.145 N/A ARG 240.A NH1 LYS 234.A O no hydrogen 2.464 N/A ARG 240.A NH2 GLU 166.A OE2 no hydrogen 2.936 N/A ARG 240.A NH2 LYS 175.A O no hydrogen 3.132 N/A ILE 241.A N CYS 231.A O no hydrogen 3.286 N/A SER 242.A N GLU 245.A OE1 no hydrogen 3.022 N/A SER 242.A OG GLU 245.A OE1 no hydrogen 3.361 N/A GLU 245.A N SER 242.A OG no hydrogen 3.142 N/A LEU 246.A N SER 242.A O no hydrogen 3.016 N/A LEU 247.A N ILE 243.A O no hydrogen 2.978 N/A ALA 248.A N GLU 245.A O no hydrogen 2.731 N/A HIS 249.A N LEU 246.A O no hydrogen 3.265 N/A HIS 249.A NE2 ASP 227.A OD2 no hydrogen 2.629 N/A TYR 251.A N HIS 249.A ND1 no hydrogen 2.974 N/A VAL 252.A N HIS 249.A O no hydrogen 3.081 N/A GLN 253.A N PRO 250.A O no hydrogen 3.037 N/A GLN 253.A NE2 LEU 247.A O no hydrogen 2.962 N/A ILE 254.A N PRO 250.A O no hydrogen 2.819 N/A