Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qhi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 GLN 278.A OE1 no hydrogen 3.094 N/A LEU 4.A N THR 279.A O no hydrogen 2.685 N/A LEU 5.A N LEU 101.A O no hydrogen 3.011 N/A ARG 6.A NH1 TYR 8.A OH no hydrogen 2.890 N/A VAL 7.A N LEU 103.A O no hydrogen 2.693 N/A TYR 8.A N ASN 146.A O no hydrogen 2.947 N/A ILE 9.A N PHE 105.A O no hydrogen 2.929 N/A ASP 10.A N VAL 148.A O no hydrogen 2.711 N/A GLY 11.A N ASP 10.A OD2 no hydrogen 2.811 N/A HIS 13.A N TYR 116.A OH no hydrogen 3.318 N/A HIS 13.A NE2 GLU 169.A OE1 no hydrogen 3.245 N/A THR 20.A N GLY 16.A O no hydrogen 2.850 N/A THR 20.A OG1 LYS 17.A O no hydrogen 2.640 N/A THR 21.A N LYS 17.A O no hydrogen 2.748 N/A THR 21.A OG1 LYS 17.A O no hydrogen 3.065 N/A THR 21.A OG1 THR 18.A O no hydrogen 3.136 N/A GLN 22.A N THR 18.A O no hydrogen 2.858 N/A LEU 23.A N THR 20.A O no hydrogen 3.143 N/A LEU 24.A N THR 21.A O no hydrogen 3.164 N/A VAL 28.A N THR 102.A O no hydrogen 3.048 N/A TYR 29.A OH ASP 106.A OD1 no hydrogen 2.670 N/A VAL 30.A N ILE 104.A O no hydrogen 2.859 N/A MET 34.A N GLU 32.A O no hydrogen 2.796 N/A THR 35.A N MET 301.A O no hydrogen 2.988 N/A THR 35.A OG1 MET 301.A O no hydrogen 3.452 N/A TYR 36.A N PRO 33.A O no hydrogen 2.975 N/A TRP 37.A N PRO 33.A O no hydrogen 3.203 N/A TRP 37.A NE1 MET 77.A O no hydrogen 2.937 N/A ARG 38.A N MET 34.A O no hydrogen 2.866 N/A ARG 38.A NH1 GLU 44.A OE1 no hydrogen 3.504 N/A ARG 38.A NH1 GLU 44.A OE2 no hydrogen 3.464 N/A VAL 39.A N THR 35.A O no hydrogen 2.759 N/A LEU 40.A N THR 35.A O no hydrogen 2.890 N/A GLY 41.A N TYR 36.A O no hydrogen 2.863 N/A GLU 44.A N ARG 38.A O no hydrogen 2.898 N/A THR 45.A N TRP 37.A O no hydrogen 2.800 N/A THR 45.A OG1 TRP 37.A O no hydrogen 2.824 N/A ASN 48.A N GLU 44.A O no hydrogen 3.197 N/A ILE 49.A N THR 45.A O no hydrogen 2.941 N/A TYR 50.A N ILE 46.A O no hydrogen 2.994 N/A TYR 50.A OH HIS 13.A NE2 no hydrogen 3.384 N/A THR 51.A N ALA 47.A O no hydrogen 2.822 N/A THR 51.A OG1 ALA 47.A O no hydrogen 2.820 N/A THR 52.A N ASN 48.A O no hydrogen 3.041 N/A THR 52.A OG1 ASN 48.A O no hydrogen 2.854 N/A GLN 53.A N ILE 49.A O no hydrogen 3.197 N/A GLN 53.A NE2 ASP 57.A OD1 no hydrogen 3.144 N/A GLN 53.A NE2 MET 123.A O no hydrogen 3.042 N/A HIS 54.A N TYR 50.A O no hydrogen 2.985 N/A ARG 55.A N THR 51.A O no hydrogen 2.852 N/A LEU 56.A N THR 52.A O no hydrogen 3.028 N/A ASP 57.A N GLN 53.A O no hydrogen 2.695 N/A GLN 58.A N HIS 54.A O no hydrogen 2.857 N/A GLY 59.A N LEU 56.A O no hydrogen 2.926 N/A GLU 60.A N ARG 55.A O no hydrogen 2.887 N/A SER 62.A N ASP 65.A OD2 no hydrogen 3.392 N/A ASP 65.A N SER 62.A OG no hydrogen 3.328 N/A ALA 66.A N SER 62.A O no hydrogen 2.932 N/A ALA 67.A N ALA 63.A O no hydrogen 3.038 N/A VAL 68.A N GLY 64.A O no hydrogen 3.277 N/A VAL 69.A N ASP 65.A O no hydrogen 3.342 N/A MET 70.A N ALA 66.A O no hydrogen 2.784 N/A THR 71.A N ALA 67.A O no hydrogen 2.862 N/A THR 71.A OG1 ALA 67.A O no hydrogen 2.646 N/A SER 72.A N VAL 68.A O no hydrogen 3.265 N/A ALA 73.A N VAL 69.A O no hydrogen 3.072 N/A GLN 74.A N MET 70.A O no hydrogen 3.258 N/A GLN 74.A N THR 71.A O no hydrogen 3.101 N/A GLN 74.A NE2 MET 70.A O no hydrogen 3.164 N/A MET 77.A N ALA 73.A O no hydrogen 3.050 N/A GLY 78.A N GLN 74.A O no hydrogen 2.988 N/A MET 79.A N ILE 75.A O no hydrogen 3.274 N/A TYR 81.A N GLY 78.A O no hydrogen 2.998 N/A TYR 81.A OH ASP 106.A O no hydrogen 2.740 N/A ALA 82.A N GLY 78.A O no hydrogen 3.103 N/A VAL 83.A N MET 79.A O no hydrogen 3.018 N/A THR 84.A N PRO 80.A O no hydrogen 3.174 N/A THR 84.A OG1 PRO 80.A O no hydrogen 2.676 N/A ASP 85.A N TYR 81.A O no hydrogen 3.024 N/A ALA 86.A N ALA 82.A O no hydrogen 2.930 N/A VAL 87.A N VAL 83.A O no hydrogen 2.854 N/A LEU 88.A N THR 84.A O no hydrogen 2.983 N/A ALA 89.A N ASP 85.A O no hydrogen 2.902 N/A HIS 91.A N LEU 88.A O no hydrogen 2.787 N/A ILE 92.A N ALA 89.A O no hydrogen 3.272 N/A GLY 93.A N HIS 280.A O no hydrogen 2.534 N/A ALA 96.A N GLN 278.A O no hydrogen 2.775 N/A ALA 100.A N THR 3.A O no hydrogen 2.741 N/A THR 102.A N ASP 26.A O no hydrogen 2.890 N/A LEU 103.A N LEU 5.A O no hydrogen 2.611 N/A ILE 104.A N VAL 28.A O no hydrogen 2.949 N/A PHE 105.A N VAL 7.A O no hydrogen 2.657 N/A ASP 106.A N VAL 30.A O no hydrogen 2.924 N/A ARG 107.A N ILE 9.A O no hydrogen 2.935 N/A ARG 107.A NH1 GLY 11.A O no hydrogen 2.908 N/A ARG 107.A NH2 GLY 11.A O no hydrogen 3.178 N/A HIS 108.A N ASP 10.A OD1 no hydrogen 2.881 N/A ILE 110.A N HIS 108.A ND1 no hydrogen 3.172 N/A ALA 111.A N HIS 108.A O no hydrogen 2.946 N/A ALA 112.A N PRO 109.A O no hydrogen 2.889 N/A LEU 113.A N PRO 109.A O no hydrogen 2.846 N/A LEU 114.A N ILE 110.A O no hydrogen 2.959 N/A CYS 115.A N ILE 110.A O no hydrogen 2.896 N/A CYS 115.A SG ILE 110.A O no hydrogen 3.764 N/A TYR 116.A N ALA 111.A O no hydrogen 3.044 N/A TYR 116.A OH HIS 13.A ND1 no hydrogen 2.595 N/A ALA 118.A N LEU 114.A O no hydrogen 3.007 N/A ALA 119.A N CYS 115.A O no hydrogen 3.100 N/A ARG 120.A N TYR 116.A O no hydrogen 2.957 N/A ARG 120.A NH1 GLN 53.A OE1 no hydrogen 2.884 N/A TYR 121.A N PRO 117.A O no hydrogen 2.936 N/A LEU 122.A N ALA 118.A O no hydrogen 2.991 N/A MET 123.A N ARG 120.A O no hydrogen 2.988 N/A GLY 124.A N TYR 121.A O no hydrogen 2.926 N/A SER 125.A N ARG 120.A O no hydrogen 3.067 N/A SER 125.A OG GLN 53.A OE1 no hydrogen 2.693 N/A SER 125.A OG ARG 120.A O no hydrogen 3.399 N/A GLN 129.A N GLN 129.A OE1 no hydrogen 2.780 N/A ALA 130.A N THR 127.A OG1 no hydrogen 3.139 N/A VAL 131.A N THR 127.A O no hydrogen 3.152 N/A LEU 132.A N PRO 128.A O no hydrogen 3.027 N/A ALA 133.A N GLN 129.A O no hydrogen 3.200 N/A ALA 133.A N ALA 130.A O no hydrogen 3.219 N/A PHE 134.A N ALA 130.A O no hydrogen 3.286 N/A VAL 135.A N VAL 131.A O no hydrogen 3.045 N/A ALA 136.A N LEU 132.A O no hydrogen 2.907 N/A LEU 137.A N PHE 134.A O no hydrogen 3.096 N/A ILE 138.A N VAL 135.A O no hydrogen 3.170 N/A THR 141.A OG1 ARG 247.A O no hydrogen 2.601 N/A THR 145.A OG1 LEU 142.A O no hydrogen 2.582 N/A ASN 146.A ND2 ARG 6.A O no hydrogen 2.878 N/A ASN 146.A ND2 VAL 277.A O no hydrogen 3.148 N/A ILE 147.A N HIS 252.A O no hydrogen 2.867 N/A VAL 148.A N TYR 8.A O no hydrogen 2.860 N/A LEU 149.A N PHE 254.A O no hydrogen 2.732 N/A ALA 151.A N LEU 256.A O no hydrogen 2.918 N/A ARG 156.A NH1 ASP 259.A OD1 no hydrogen 3.202 N/A HIS 157.A N PRO 153.A O no hydrogen 3.020 N/A HIS 157.A NE2 HIS 13.A O no hydrogen 2.883 N/A ILE 158.A N GLU 154.A O no hydrogen 2.817 N/A ASP 159.A N ASP 155.A O no hydrogen 3.020 N/A ARG 160.A N ARG 156.A O no hydrogen 2.792 N/A ARG 160.A NH1 MET 15.A O no hydrogen 2.780 N/A ARG 160.A NH1 TYR 258.A O no hydrogen 2.997 N/A ARG 160.A NH2 TYR 258.A O no hydrogen 3.032 N/A ARG 160.A NH2 GLN 260.A O no hydrogen 3.041 N/A LEU 161.A N HIS 157.A O no hydrogen 2.691 N/A ALA 162.A N ILE 158.A O no hydrogen 2.955 N/A LYS 163.A N ASP 159.A O no hydrogen 3.227 N/A LYS 163.A NZ ARG 160.A O no hydrogen 3.325 N/A ARG 164.A N LEU 161.A O no hydrogen 2.938 N/A ARG 164.A NH1 GLN 165.A O no hydrogen 3.566 N/A ARG 166.A N GLU 169.A OE2 no hydrogen 2.943 N/A ARG 166.A NE GLU 32.A OE1 no hydrogen 2.876 N/A ARG 166.A NH2 GLU 32.A OE1 no hydrogen 3.449 N/A ARG 166.A NH2 GLU 32.A OE2 no hydrogen 3.442 N/A GLU 169.A N ARG 166.A O no hydrogen 3.064 N/A ARG 170.A NH2 THR 51.A OG1 no hydrogen 2.946 N/A MET 175.A N ASP 172.A OD1 no hydrogen 3.042 N/A LEU 176.A N ASP 172.A O no hydrogen 3.054 N/A ALA 177.A N LEU 173.A O no hydrogen 3.052 N/A ALA 178.A N ALA 174.A O no hydrogen 2.904 N/A ILE 179.A N MET 175.A O no hydrogen 2.887 N/A ARG 180.A N LEU 176.A O no hydrogen 3.021 N/A ARG 180.A NH1 LEU 152.A O no hydrogen 2.817 N/A ARG 180.A NH1 HIS 157.A ND1 no hydrogen 2.887 N/A ARG 180.A NH2 LEU 152.A O no hydrogen 2.887 N/A ARG 181.A N ALA 177.A O no hydrogen 2.850 N/A VAL 182.A N ALA 178.A O no hydrogen 2.980 N/A TYR 183.A N ILE 179.A O no hydrogen 3.166 N/A TYR 183.A OH ASP 10.A OD2 no hydrogen 2.600 N/A GLY 184.A N ARG 180.A O no hydrogen 2.978 N/A LEU 185.A N ARG 181.A O no hydrogen 2.925 N/A LEU 186.A N VAL 182.A O no hydrogen 2.847 N/A ALA 187.A N TYR 183.A O no hydrogen 3.148 N/A ASN 188.A N GLY 184.A O no hydrogen 3.168 N/A ASN 188.A ND2 ASP 215.A O no hydrogen 3.012 N/A THR 189.A N LEU 185.A O no hydrogen 2.727 N/A THR 189.A OG1 LEU 185.A O no hydrogen 2.702 N/A VAL 190.A N LEU 186.A O no hydrogen 3.108 N/A ARG 191.A N ALA 187.A O no hydrogen 3.370 N/A ARG 191.A NH2 ASN 188.A OD1 no hydrogen 3.048 N/A TYR 192.A N ASN 188.A O no hydrogen 2.943 N/A TYR 192.A OH ASP 202.A OD2 no hydrogen 2.709 N/A LEU 193.A N THR 189.A O no hydrogen 2.948 N/A GLN 194.A N VAL 190.A O no hydrogen 2.870 N/A GLN 194.A NE2 ARG 249.A O no hydrogen 2.903 N/A GLN 194.A NE2 MET 251.A O no hydrogen 2.796 N/A CYS 195.A N ARG 191.A O no hydrogen 3.071 N/A CYS 195.A SG ARG 191.A O no hydrogen 3.322 N/A CYS 195.A SG PRO 209.A O no hydrogen 3.221 N/A GLY 196.A N LEU 193.A O no hydrogen 3.145 N/A GLY 197.A N TYR 192.A O no hydrogen 2.884 N/A TRP 199.A NE1 ASP 242.A OD1 no hydrogen 3.014 N/A ARG 200.A NE ASP 242.A OD1 no hydrogen 3.006 N/A ARG 200.A NE ASP 242.A OD2 no hydrogen 3.341 N/A ARG 200.A NH2 ASP 242.A OD2 no hydrogen 2.716 N/A ASP 202.A N SER 198.A O no hydrogen 2.925 N/A GLN 205.A N ASP 202.A O no hydrogen 3.104 N/A LEU 206.A N TRP 203.A O no hydrogen 3.043 N/A SER 207.A N GLY 204.A O no hydrogen 2.759 N/A GLY 208.A N GLY 204.A O no hydrogen 2.984 N/A ARG 210.A NH2 CYS 195.A O no hydrogen 3.089 N/A GLY 214.A N HIS 212.A ND1 no hydrogen 2.964 N/A ASP 215.A N HIS 212.A O no hydrogen 2.593 N/A THR 216.A N ILE 213.A O no hydrogen 3.185 N/A THR 216.A OG1 ILE 213.A O no hydrogen 2.585 N/A LEU 217.A N THR 189.A OG1 no hydrogen 2.757 N/A THR 219.A N THR 216.A O no hydrogen 3.301 N/A LEU 220.A N LEU 217.A O no hydrogen 3.139 N/A PHE 221.A N PHE 218.A O no hydrogen 3.052 N/A ARG 222.A N THR 219.A O no hydrogen 3.404 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.889 N/A LEU 226.A N ALA 223.A O no hydrogen 2.839 N/A LEU 227.A N PRO 224.A O no hydrogen 3.320 N/A ALA 228.A N ASP 232.A O no hydrogen 2.578 N/A GLY 231.A N ALA 228.A O no hydrogen 2.535 N/A ASP 232.A N ASN 230.A OD1 no hydrogen 2.549 N/A TYR 234.A N LEU 226.A O no hydrogen 3.165 N/A PHE 237.A N TYR 234.A O no hydrogen 3.112 N/A ALA 238.A N TYR 234.A O no hydrogen 3.114 N/A TRP 239.A N ASN 235.A O no hydrogen 2.845 N/A ALA 240.A N VAL 236.A O no hydrogen 3.319 N/A LEU 241.A N PHE 237.A O no hydrogen 3.052 N/A ASP 242.A N ALA 238.A O no hydrogen 2.954 N/A VAL 243.A N TRP 239.A O no hydrogen 3.114 N/A LEU 244.A N ALA 240.A O no hydrogen 3.150 N/A ALA 245.A N LEU 241.A O no hydrogen 3.008 N/A LYS 246.A N ASP 242.A O no hydrogen 3.006 N/A ARG 247.A N VAL 243.A O no hydrogen 2.860 N/A ARG 247.A NH1 ILE 138.A O no hydrogen 3.186 N/A LEU 248.A N LEU 244.A O no hydrogen 3.107 N/A ARG 249.A N ALA 245.A O no hydrogen 3.275 N/A ARG 249.A NE LEU 193.A O no hydrogen 3.548 N/A MET 251.A N LEU 248.A O no hydrogen 3.248 N/A HIS 252.A N THR 145.A O no hydrogen 2.993 N/A PHE 254.A N ILE 147.A O no hydrogen 2.823 N/A LEU 256.A N LEU 149.A O no hydrogen 2.976 N/A TYR 258.A N ALA 151.A O no hydrogen 2.710 N/A ASP 259.A N ASP 257.A OD1 no hydrogen 3.063 N/A GLN 260.A N TYR 258.A O no hydrogen 2.675 N/A GLN 260.A NE2 ASP 257.A O no hydrogen 2.560 N/A GLY 264.A N SER 261.A OG no hydrogen 3.402 N/A CYS 265.A N SER 261.A O no hydrogen 2.552 N/A CYS 265.A SG ASP 257.A O no hydrogen 3.867 N/A CYS 265.A SG TYR 258.A O no hydrogen 3.477 N/A CYS 265.A SG GLN 260.A O no hydrogen 3.882 N/A CYS 265.A SG SER 261.A O no hydrogen 3.745 N/A ARG 266.A N PRO 262.A O no hydrogen 2.976 N/A ASP 267.A N ALA 263.A O no hydrogen 2.702 N/A ALA 268.A N GLY 264.A O no hydrogen 2.536 N/A LEU 269.A N CYS 265.A O no hydrogen 2.905 N/A LEU 270.A N ARG 266.A O no hydrogen 3.329 N/A GLN 271.A N ASP 267.A O no hydrogen 3.238 N/A GLN 271.A N ALA 268.A O no hydrogen 3.122 N/A LEU 272.A N ALA 268.A O no hydrogen 3.285 N/A SER 274.A N GLN 271.A O no hydrogen 3.217 N/A SER 274.A OG GLN 271.A O no hydrogen 2.942 N/A GLY 275.A N LEU 272.A O no hydrogen 3.250 N/A MET 276.A N THR 273.A O no hydrogen 3.259 N/A VAL 277.A N ASN 146.A OD1 no hydrogen 3.044 N/A THR 279.A N LEU 4.A O no hydrogen 3.088 N/A THR 279.A OG1 HIS 280.A O no hydrogen 3.295 N/A HIS 280.A N GLY 94.A O no hydrogen 2.831 N/A HIS 280.A ND1 GLY 94.A O no hydrogen 2.918 N/A VAL 281.A N PRO 2.A O no hydrogen 2.990 N/A THR 282.A N HIS 91.A O no hydrogen 2.690 N/A THR 283.A N SER 286.A OG no hydrogen 3.162 N/A THR 283.A OG1 SER 286.A OG no hydrogen 2.813 N/A SER 286.A N THR 283.A O no hydrogen 3.241 N/A SER 286.A OG THR 283.A O no hydrogen 3.514 N/A SER 286.A OG THR 283.A OG1 no hydrogen 2.813 N/A THR 289.A N GLY 285.A O no hydrogen 3.413 N/A THR 289.A OG1 GLY 285.A O no hydrogen 2.941 N/A ILE 290.A N SER 286.A O no hydrogen 2.779 N/A CYS 291.A N ILE 287.A O no hydrogen 2.825 N/A ASP 292.A N PRO 288.A O no hydrogen 2.801 N/A LEU 293.A N THR 289.A O no hydrogen 3.024 N/A ALA 294.A N ILE 290.A O no hydrogen 3.152 N/A ARG 295.A N CYS 291.A O no hydrogen 3.064 N/A THR 296.A N ASP 292.A O no hydrogen 2.863 N/A THR 296.A OG1 ASP 292.A O no hydrogen 2.663 N/A PHE 297.A N LEU 293.A O no hydrogen 2.887 N/A ALA 298.A N ALA 294.A O no hydrogen 2.993 N/A ARG 299.A N ARG 295.A O no hydrogen 2.939 N/A GLU 300.A N THR 296.A O no hydrogen 2.994 N/A MET 301.A N PHE 297.A O no hydrogen 2.763 N/A GLY 302.A N ALA 298.A O no hydrogen 2.947 N/A