Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3t89_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 8.A N ASP 5.A O no hydrogen 3.065 N/A LEU 9.A N ASP 5.A O no hydrogen 3.168 N/A TYR 10.A N GLU 6.A O no hydrogen 2.787 N/A TYR 10.A OH GLU 198.A OE1 no hydrogen 2.803 N/A TYR 10.A OH GLU 198.A OE2 no hydrogen 3.226 N/A ALA 11.A N MET 8.A O no hydrogen 3.138 N/A TRP 15.A NE1 GLU 196.A OE2 no hydrogen 2.947 N/A HIS 16.A N LYS 29.A O no hydrogen 2.762 N/A CYS 18.A N TYR 27.A O no hydrogen 2.692 N/A CYS 18.A SG HIS 16.A O no hydrogen 3.734 N/A SER 19.A N ASP 17.A OD2 no hydrogen 3.154 N/A SER 19.A OG ASP 17.A OD1 no hydrogen 2.656 N/A SER 19.A OG TYR 27.A O no hydrogen 3.263 N/A PHE 22.A N SER 19.A O no hydrogen 2.949 N/A GLU 23.A N GLU 55.A OE1 no hydrogen 3.209 N/A GLU 23.A N GLU 55.A OE2 no hydrogen 2.704 N/A ASP 24.A N GLU 55.A OE1 no hydrogen 2.795 N/A ARG 26.A N THR 38.A O no hydrogen 2.897 N/A TYR 27.A N SER 19.A OG no hydrogen 2.757 N/A TYR 27.A OH ASP 62.A OD2 no hydrogen 2.789 N/A GLU 28.A N LYS 36.A O no hydrogen 3.027 N/A LYS 29.A N HIS 16.A O no hydrogen 2.913 N/A LYS 29.A NZ ASP 62.A OD2 no hydrogen 2.625 N/A LYS 29.A NZ ASP 66.A OD2 no hydrogen 2.727 N/A SER 30.A N ILE 34.A O no hydrogen 2.849 N/A SER 30.A OG ASP 32.A OD1 no hydrogen 2.657 N/A SER 30.A OG ILE 34.A O no hydrogen 3.404 N/A GLY 33.A N SER 30.A O no hydrogen 3.158 N/A ILE 34.A N SER 30.A OG no hydrogen 2.862 N/A ALA 35.A N VAL 71.A O no hydrogen 2.798 N/A LYS 36.A N GLU 28.A O no hydrogen 2.772 N/A LYS 36.A NZ GLU 196.A OE1 no hydrogen 3.004 N/A ILE 37.A N ILE 73.A O no hydrogen 2.774 N/A THR 38.A N ARG 26.A O no hydrogen 2.916 N/A ILE 39.A N THR 75.A O no hydrogen 2.870 N/A ASN 40.A N ASP 24.A O no hydrogen 2.728 N/A ARG 41.A N ASN 46.A OD1 no hydrogen 2.890 N/A ARG 41.A NH1 ASP 87.A OD1 no hydrogen 3.108 N/A ARG 41.A NH2 ALA 47.A O no hydrogen 2.896 N/A ARG 41.A NH2 ASP 87.A OD1 no hydrogen 3.031 N/A GLN 43.A N GLN 43.A OE1 no hydrogen 2.698 N/A VAL 44.A N ARG 41.A O no hydrogen 2.989 N/A ARG 45.A N PRO 42.A O no hydrogen 3.090 N/A ASN 46.A N ARG 41.A O no hydrogen 2.857 N/A ASN 46.A ND2 ALA 77.A O no hydrogen 2.940 N/A ASN 46.A ND2 ALA 81.A O no hydrogen 2.747 N/A ALA 47.A N VAL 44.A O no hydrogen 3.242 N/A PHE 48.A N GLY 85.A O no hydrogen 2.860 N/A ARG 49.A N THR 52.A OG1 no hydrogen 3.057 N/A ARG 49.A NE ASP 24.A OD2 no hydrogen 2.747 N/A ARG 49.A NH2 ASP 24.A OD1 no hydrogen 2.740 N/A THR 52.A OG1 ASP 24.A OD2 no hydrogen 2.597 N/A THR 52.A OG1 ARG 49.A O no hydrogen 3.366 N/A VAL 53.A N ARG 49.A O no hydrogen 3.143 N/A LYS 54.A N PRO 50.A O no hydrogen 2.978 N/A GLU 55.A N LEU 51.A O no hydrogen 3.098 N/A MET 56.A N THR 52.A O no hydrogen 2.980 N/A ILE 57.A N VAL 53.A O no hydrogen 2.944 N/A GLN 58.A N LYS 54.A O no hydrogen 3.021 N/A ALA 59.A N GLU 55.A O no hydrogen 2.902 N/A LEU 60.A N MET 56.A O no hydrogen 2.877 N/A ALA 61.A N ILE 57.A O no hydrogen 2.971 N/A ASP 62.A N GLN 58.A O no hydrogen 3.146 N/A ALA 63.A N ALA 59.A O no hydrogen 2.990 N/A ARG 64.A N LEU 60.A O no hydrogen 2.923 N/A TYR 65.A N ALA 61.A O no hydrogen 3.002 N/A ASP 66.A N ALA 63.A O no hydrogen 3.311 N/A ASN 68.A N ASP 66.A OD1 no hydrogen 2.961 N/A ILE 69.A N ASP 66.A O no hydrogen 2.793 N/A GLY 70.A N GLY 33.A O no hydrogen 2.808 N/A VAL 71.A N GLY 33.A O no hydrogen 3.276 N/A ILE 72.A N PRO 106.A O no hydrogen 2.954 N/A ILE 73.A N ALA 35.A O no hydrogen 2.677 N/A LEU 74.A N VAL 108.A O no hydrogen 2.845 N/A THR 75.A N ILE 37.A O no hydrogen 2.921 N/A THR 75.A OG1 MET 110.A O no hydrogen 2.782 N/A ALA 77.A N ILE 39.A O no hydrogen 2.775 N/A PHE 82.A N TYR 114.A O no hydrogen 2.828 N/A CYS 83.A N TYR 114.A O no hydrogen 2.983 N/A CYS 83.A SG ASN 46.A O no hydrogen 3.331 N/A CYS 83.A SG GLY 85.A O no hydrogen 3.980 N/A SER 84.A N ARG 45.A O no hydrogen 3.069 N/A SER 84.A OG VAL 44.A O no hydrogen 3.261 N/A SER 84.A OG ARG 45.A O no hydrogen 3.003 N/A ASP 87.A N PHE 48.A O no hydrogen 2.688 N/A LYS 89.A N ASP 87.A OD2 no hydrogen 3.150 N/A ASN 92.A ND2 PRO 50.A O no hydrogen 3.133 N/A LEU 94.A N LEU 91.A O no hydrogen 3.024 N/A ASP 95.A N ASN 92.A O no hydrogen 3.060 N/A PHE 96.A N ASN 92.A O no hydrogen 3.359 N/A GLN 97.A N VAL 93.A O no hydrogen 2.872 N/A GLN 97.A NE2 ASP 148.A OD2 no hydrogen 3.102 N/A ARG 98.A N LEU 94.A O no hydrogen 3.259 N/A GLN 99.A N ASP 95.A O no hydrogen 2.947 N/A GLN 99.A NE2 ILE 57.A O no hydrogen 2.840 N/A ILE 100.A N PHE 96.A O no hydrogen 2.931 N/A ARG 101.A N GLN 97.A O no hydrogen 2.970 N/A ARG 101.A NE ASP 226.A OD2 no hydrogen 2.746 N/A ARG 101.A NH2 ASP 226.A OD1 no hydrogen 2.919 N/A ARG 101.A NH2 ASP 226.A OD2 no hydrogen 3.452 N/A THR 102.A N ARG 98.A O no hydrogen 2.930 N/A THR 102.A OG1 ARG 98.A O no hydrogen 3.023 N/A CYS 103.A N ILE 100.A O no hydrogen 3.284 N/A CYS 103.A SG LYS 105.A O no hydrogen 3.555 N/A LYS 105.A NZ ALA 63.A O no hydrogen 2.826 N/A LYS 105.A NZ ARG 64.A O no hydrogen 3.021 N/A LYS 105.A NZ ILE 69.A O no hydrogen 2.682 N/A VAL 107.A N ASP 127.A OD2 no hydrogen 2.851 N/A VAL 108.A N ILE 72.A O no hydrogen 2.715 N/A ALA 109.A N LEU 128.A O no hydrogen 2.870 N/A MET 110.A N LEU 74.A O no hydrogen 2.944 N/A VAL 111.A N ILE 130.A O no hydrogen 2.819 N/A GLY 113.A N ASN 134.A OD1 no hydrogen 2.919 N/A TYR 114.A N LYS 80.A O no hydrogen 3.108 N/A SER 115.A N ILE 136.A O no hydrogen 2.759 N/A SER 115.A OG GLY 119.A O no hydrogen 2.974 N/A ILE 116.A N CYS 83.A O no hydrogen 2.973 N/A GLY 117.A N GLY 138.A O no hydrogen 2.968 N/A GLY 119.A N ILE 116.A O no hydrogen 2.936 N/A HIS 120.A N GLY 117.A O no hydrogen 2.859 N/A HIS 120.A ND1 GLN 139.A OE1 no hydrogen 2.738 N/A VAL 121.A N GLY 117.A O no hydrogen 3.182 N/A LEU 122.A N GLY 118.A O no hydrogen 3.069 N/A HIS 123.A N GLY 119.A O no hydrogen 3.316 N/A HIS 123.A ND1 THR 129.A OG1 no hydrogen 2.824 N/A HIS 123.A NE2 HIS 120.A NE2 no hydrogen 3.223 N/A MET 124.A N HIS 120.A O no hydrogen 3.121 N/A MET 125.A N VAL 121.A O no hydrogen 2.905 N/A CYS 126.A N LEU 122.A O no hydrogen 3.334 N/A CYS 126.A SG LEU 122.A O no hydrogen 3.389 N/A ASP 127.A N VAL 107.A O no hydrogen 2.864 N/A LEU 128.A N VAL 107.A O no hydrogen 3.477 N/A THR 129.A N ASN 187.A OD1 no hydrogen 2.726 N/A THR 129.A OG1 HIS 123.A ND1 no hydrogen 2.824 N/A ILE 130.A N ALA 109.A O no hydrogen 2.808 N/A ALA 131.A N THR 188.A O no hydrogen 3.036 N/A ALA 132.A N VAL 111.A O no hydrogen 2.764 N/A ASP 133.A N VAL 190.A O no hydrogen 2.862 N/A ASN 134.A ND2 ASP 79.A O no hydrogen 2.928 N/A ALA 135.A N ALA 132.A O no hydrogen 2.935 N/A ILE 136.A N GLY 113.A O no hydrogen 2.814 N/A PHE 137.A N TYR 175.A O no hydrogen 2.812 N/A GLN 139.A NE2 GLY 117.A O no hydrogen 3.132 N/A LYS 143.A N THR 140.A O no hydrogen 2.818 N/A VAL 144.A N GLY 141.A O no hydrogen 2.799 N/A SER 146.A N GLY 141.A O no hydrogen 3.015 N/A GLY 150.A N ASP 148.A OD1 no hydrogen 3.017 N/A TRP 151.A NE1 ASP 226.A OD1 no hydrogen 3.142 N/A GLY 152.A N ASP 148.A OD1 no hydrogen 3.176 N/A ALA 153.A N GLY 150.A O no hydrogen 3.074 N/A SER 154.A N GLY 150.A O no hydrogen 3.172 N/A SER 154.A OG GLY 150.A O no hydrogen 2.970 N/A ALA 157.A N ALA 153.A O no hydrogen 3.008 N/A ARG 158.A N SER 154.A O no hydrogen 3.179 N/A ARG 158.A NH1 ASP 224.A O no hydrogen 3.111 N/A ILE 159.A N TYR 155.A O no hydrogen 3.128 N/A ILE 159.A N MET 156.A O no hydrogen 3.026 N/A VAL 160.A N MET 156.A O no hydrogen 2.940 N/A GLY 161.A N ALA 157.A O no hydrogen 2.861 N/A LYS 164.A NZ GLU 167.A OE1 no hydrogen 2.965 N/A ALA 165.A N GLY 161.A O no hydrogen 3.056 N/A ARG 166.A N GLN 162.A O no hydrogen 3.109 N/A ARG 166.A NE GLN 162.A OE1 no hydrogen 2.949 N/A ARG 166.A NH2 GLN 162.A OE1 no hydrogen 2.991 N/A GLU 167.A N LYS 163.A O no hydrogen 3.083 N/A ILE 168.A N LYS 164.A O no hydrogen 2.849 N/A TRP 169.A N ALA 165.A O no hydrogen 3.122 N/A TRP 169.A NE1 GLY 152.A O no hydrogen 2.850 N/A PHE 170.A N ARG 166.A O no hydrogen 2.803 N/A LEU 171.A N GLU 167.A O no hydrogen 3.156 N/A CYS 172.A N ILE 168.A O no hydrogen 3.171 N/A CYS 172.A SG TRP 169.A O no hydrogen 3.424 N/A TYR 175.A N PHE 137.A O no hydrogen 2.697 N/A TYR 175.A OH GLU 167.A OE2 no hydrogen 2.748 N/A ASP 176.A N GLN 179.A OE1 no hydrogen 3.047 N/A GLN 179.A N ASP 176.A OD1 no hydrogen 2.800 N/A ALA 180.A N ASP 176.A O no hydrogen 3.075 N/A LEU 181.A N ALA 177.A O no hydrogen 2.947 N/A ASP 182.A N LYS 178.A O no hydrogen 2.904 N/A MET 183.A N GLN 179.A O no hydrogen 3.159 N/A GLY 184.A N LEU 181.A O no hydrogen 3.093 N/A LEU 185.A N ALA 180.A O no hydrogen 2.851 N/A ASN 187.A N THR 129.A O no hydrogen 2.957 N/A VAL 190.A N ALA 131.A O no hydrogen 2.869 N/A LEU 192.A N ASP 133.A OD1 no hydrogen 3.061 N/A ASP 194.A N PRO 191.A O no hydrogen 2.770 N/A LEU 195.A N LEU 192.A O no hydrogen 3.150 N/A GLU 198.A N ASP 194.A O no hydrogen 2.918 N/A THR 199.A N LEU 195.A O no hydrogen 3.011 N/A THR 199.A OG1 LEU 195.A O no hydrogen 2.778 N/A VAL 200.A N GLU 196.A O no hydrogen 2.800 N/A ARG 201.A N LYS 197.A O no hydrogen 3.162 N/A ARG 201.A NE GLU 205.A OE2 no hydrogen 2.808 N/A ARG 201.A NH2 TYR 10.A OH no hydrogen 2.726 N/A TRP 202.A N GLU 198.A O no hydrogen 2.999 N/A CYS 203.A N THR 199.A O no hydrogen 2.970 N/A CYS 203.A SG THR 199.A O no hydrogen 3.362 N/A ARG 204.A N VAL 200.A O no hydrogen 2.808 N/A ARG 204.A NE ASP 32.A OD2 no hydrogen 2.838 N/A ARG 204.A NH1 LEU 9.A O no hydrogen 2.911 N/A ARG 204.A NH1 ALA 11.A O no hydrogen 2.683 N/A ARG 204.A NH2 ALA 11.A O no hydrogen 3.414 N/A ARG 204.A NH2 PRO 12.A O no hydrogen 3.058 N/A ARG 204.A NH2 ASP 32.A OD2 no hydrogen 3.346 N/A GLU 205.A N ARG 201.A O no hydrogen 2.895 N/A MET 206.A N TRP 202.A O no hydrogen 3.149 N/A LEU 207.A N CYS 203.A O no hydrogen 2.802 N/A GLN 208.A N ARG 204.A O no hydrogen 3.140 N/A ASN 209.A N MET 206.A O no hydrogen 2.940 N/A ALA 213.A N SER 210.A OG no hydrogen 3.040 N/A LEU 214.A N SER 210.A O no hydrogen 3.001 N/A ARG 215.A N PRO 211.A O no hydrogen 3.042 N/A ARG 215.A NE ASN 237.A OD1 no hydrogen 2.685 N/A CYS 216.A N MET 212.A O no hydrogen 2.983 N/A CYS 216.A SG MET 212.A O no hydrogen 3.392 N/A LEU 217.A N ALA 213.A O no hydrogen 2.931 N/A LYS 218.A N LEU 214.A O no hydrogen 2.877 N/A LYS 218.A NZ ILE 100.A O no hydrogen 3.173 N/A LYS 218.A NZ CYS 103.A O no hydrogen 2.955 N/A LYS 218.A NZ LYS 105.A O no hydrogen 3.349 N/A LYS 218.A NZ ASP 127.A OD2 no hydrogen 2.773 N/A ALA 219.A N ARG 215.A O no hydrogen 3.061 N/A ALA 220.A N CYS 216.A O no hydrogen 2.904 N/A LEU 221.A N LEU 217.A O no hydrogen 2.898 N/A ASN 222.A N LYS 218.A O no hydrogen 2.907 N/A ASN 222.A ND2 ARG 101.A O no hydrogen 2.826 N/A ASN 222.A ND2 GLU 233.A OE2 no hydrogen 2.899 N/A ALA 223.A N ALA 219.A O no hydrogen 2.758 N/A ASP 224.A N LEU 221.A O no hydrogen 3.341 N/A CYS 225.A N ASN 222.A O no hydrogen 2.815 N/A ASP 226.A N ASN 222.A O no hydrogen 2.857 N/A GLY 230.A N ASP 226.A O no hydrogen 3.012 N/A LEU 231.A N GLY 227.A O no hydrogen 2.979 N/A GLN 232.A N GLN 228.A O no hydrogen 2.816 N/A GLU 233.A N ALA 229.A O no hydrogen 3.365 N/A LEU 234.A N GLY 230.A O no hydrogen 2.998 N/A ALA 235.A N LEU 231.A O no hydrogen 2.804 N/A GLY 236.A N GLN 232.A O no hydrogen 2.975 N/A ASN 237.A N GLU 233.A O no hydrogen 3.087 N/A ASN 237.A ND2 GLU 233.A O no hydrogen 2.962 N/A ALA 238.A N LEU 234.A O no hydrogen 3.086 N/A THR 239.A N ALA 235.A O no hydrogen 2.763 N/A THR 239.A OG1 ALA 235.A O no hydrogen 3.183 N/A MET 240.A N GLY 236.A O no hydrogen 2.944 N/A LEU 241.A N ASN 237.A O no hydrogen 2.902 N/A PHE 242.A N ALA 238.A O no hydrogen 2.859 N/A TYR 243.A N THR 239.A O no hydrogen 3.014 N/A MET 244.A N LEU 241.A O no hydrogen 2.819 N/A THR 245.A N PHE 242.A O no hydrogen 2.999 N/A THR 245.A OG1 PHE 242.A O no hydrogen 2.771 N/A GLY 248.A N THR 245.A OG1 no hydrogen 3.152 N/A GLN 249.A N GLU 246.A O no hydrogen 2.969 N/A GLN 249.A NE2 TYR 243.A O no hydrogen 3.032 N/A GLU 250.A N GLU 247.A O no hydrogen 3.376 N/A ASN 253.A N GLN 249.A O no hydrogen 2.882 N/A ALA 254.A N GLU 250.A O no hydrogen 2.756 N/A PHE 255.A N GLY 251.A O no hydrogen 3.044 N/A ASN 256.A N ARG 252.A O no hydrogen 2.871 N/A GLN 257.A N ASN 253.A O no hydrogen 2.830 N/A LYS 258.A N PHE 255.A O no hydrogen 3.201 N/A ARG 259.A N ALA 254.A O no hydrogen 3.097 N/A ARG 259.A NE GLN 257.A OE1 no hydrogen 2.700 N/A ARG 259.A NH1 GLU 250.A OE1 no hydrogen 3.154 N/A ARG 259.A NH1 GLU 250.A OE2 no hydrogen 3.433 N/A ARG 259.A NH1 GLN 257.A OE1 no hydrogen 3.088 N/A ARG 259.A NH2 GLU 250.A OE2 no hydrogen 2.757 N/A ARG 259.A NH2 GLN 260.A O no hydrogen 3.225 N/A ASP 262.A N GLU 250.A OE2 no hydrogen 2.735 N/A SER 264.A N ASP 262.A OD1 no hydrogen 2.915 N/A SER 264.A OG ASP 262.A OD1 no hydrogen 2.531 N/A SER 264.A OG ASP 262.A OD2 no hydrogen 3.256 N/A LYS 265.A NZ GLU 250.A OE1 no hydrogen 2.764 N/A LYS 265.A NZ GLU 250.A OE2 no hydrogen 3.431 N/A PHE 266.A N PHE 263.A O no hydrogen 3.382 N/A