Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1h44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG SER 32.A OG no hydrogen 3.247 N/A GLN 4.A N ASP 52.A OD2 no hydrogen 2.841 N/A TRP 5.A N SER 32.A O no hydrogen 2.902 N/A CYS 6.A N ALA 53.A O no hydrogen 2.906 N/A CYS 6.A SG ALA 7.A O no hydrogen 3.826 N/A ALA 7.A N ILE 34.A O no hydrogen 2.787 N/A VAL 8.A N GLU 12.A OE1 no hydrogen 3.096 N/A GLN 10.A NE2 THR 14.A OG1 no hydrogen 3.327 N/A GLU 12.A N SER 9.A OG no hydrogen 3.235 N/A ALA 13.A N SER 9.A O no hydrogen 2.965 N/A THR 14.A N GLN 10.A O no hydrogen 2.809 N/A THR 14.A OG1 GLN 10.A O no hydrogen 3.071 N/A LYS 15.A N PRO 11.A O no hydrogen 3.069 N/A LYS 15.A NZ LEU 285.A O no hydrogen 2.834 N/A LYS 15.A NZ GLY 287.A O no hydrogen 2.688 N/A LYS 15.A NZ LEU 295.A O no hydrogen 2.833 N/A CYS 16.A N GLU 12.A O no hydrogen 2.846 N/A CYS 16.A SG SER 32.A O no hydrogen 3.914 N/A PHE 17.A N ALA 13.A O no hydrogen 3.049 N/A GLN 18.A N THR 14.A O no hydrogen 3.136 N/A TRP 19.A N LYS 15.A O no hydrogen 2.774 N/A GLN 20.A N CYS 16.A O no hydrogen 2.813 N/A GLN 20.A NE2 VAL 31.A O no hydrogen 2.965 N/A ARG 21.A N PHE 17.A O no hydrogen 2.892 N/A ASN 22.A N GLN 18.A O no hydrogen 3.067 N/A ASN 22.A ND2 GLN 18.A O no hydrogen 2.856 N/A MET 23.A N TRP 19.A O no hydrogen 2.940 N/A ARG 24.A N GLN 20.A O no hydrogen 3.196 N/A LYS 25.A N ARG 21.A O no hydrogen 2.925 N/A VAL 26.A N ASN 22.A O no hydrogen 2.997 N/A ARG 27.A N ARG 24.A O no hydrogen 2.888 N/A GLY 28.A N MET 23.A O no hydrogen 2.759 N/A SER 32.A N VAL 3.A O no hydrogen 2.862 N/A SER 32.A OG SER 2.A OG no hydrogen 3.247 N/A ILE 34.A N TRP 5.A O no hydrogen 2.833 N/A LYS 35.A NZ ASP 37.A OD1 no hydrogen 3.187 N/A LYS 35.A NZ ASP 37.A OD2 no hydrogen 2.787 N/A ARG 36.A N ALA 7.A O no hydrogen 2.900 N/A ARG 36.A NH1 LYS 35.A O no hydrogen 2.897 N/A ASP 37.A N GLN 41.A OE1 no hydrogen 2.913 N/A GLN 41.A N SER 38.A OG no hydrogen 3.222 N/A CYS 42.A N SER 38.A O no hydrogen 3.183 N/A CYS 42.A SG ALA 7.A O no hydrogen 3.228 N/A ILE 43.A N PRO 39.A O no hydrogen 2.904 N/A GLN 44.A N ILE 40.A O no hydrogen 3.190 N/A ALA 45.A N GLN 41.A O no hydrogen 2.913 N/A ILE 46.A N CYS 42.A O no hydrogen 2.870 N/A ALA 47.A N ILE 43.A O no hydrogen 2.975 N/A GLU 48.A N GLN 44.A O no hydrogen 2.791 N/A ASN 49.A N ILE 46.A O no hydrogen 3.034 N/A ARG 50.A N ALA 45.A O no hydrogen 2.658 N/A ASP 52.A N GLN 4.A O no hydrogen 2.739 N/A ALA 53.A N GLN 4.A O no hydrogen 3.264 N/A THR 55.A OG1 LEU 296.A O no hydrogen 2.947 N/A LEU 56.A N ALA 251.A O no hydrogen 2.843 N/A GLY 59.A N ASP 57.A OD2 no hydrogen 3.087 N/A PHE 60.A N ASP 57.A O no hydrogen 2.864 N/A ILE 61.A N ASP 57.A O no hydrogen 3.062 N/A TYR 62.A N GLY 58.A O no hydrogen 3.096 N/A ALA 64.A N PHE 60.A O no hydrogen 2.811 N/A GLY 65.A N ILE 61.A O no hydrogen 3.061 N/A GLY 65.A N TYR 62.A O no hydrogen 3.119 N/A LEU 66.A N GLU 63.A O no hydrogen 3.424 N/A TYR 69.A N LEU 66.A O no hydrogen 3.053 N/A LYS 70.A N LEU 66.A O no hydrogen 3.118 N/A LEU 71.A N ALA 64.A O no hydrogen 2.833 N/A ARG 72.A N ALA 254.A O no hydrogen 2.846 N/A ARG 72.A NE GLU 261.A OE1 no hydrogen 2.780 N/A ARG 72.A NH1 PRO 308.A O no hydrogen 3.392 N/A ARG 72.A NH1 ILE 311.A O no hydrogen 2.790 N/A ARG 72.A NH2 GLU 261.A OE2 no hydrogen 3.175 N/A ARG 72.A NH2 VAL 307.A O no hydrogen 3.084 N/A ARG 72.A NH2 PRO 308.A O no hydrogen 3.341 N/A VAL 74.A N VAL 252.A O no hydrogen 2.794 N/A ALA 75.A N VAL 252.A O no hydrogen 3.489 N/A ALA 76.A N SER 305.A O no hydrogen 2.980 N/A GLU 77.A N HIS 250.A O no hydrogen 3.040 N/A VAL 78.A N GLY 303.A O no hydrogen 2.878 N/A TYR 79.A N ARG 86.A O no hydrogen 2.828 N/A TYR 79.A OH GLU 77.A OE1 no hydrogen 2.653 N/A THR 81.A N GLN 84.A O no hydrogen 3.365 N/A GLN 84.A N THR 81.A OG1 no hydrogen 2.940 N/A ARG 86.A N TYR 79.A O no hydrogen 2.953 N/A ARG 86.A NH2 HIS 88.A O no hydrogen 3.192 N/A TYR 89.A N VAL 247.A O no hydrogen 2.872 N/A TYR 89.A OH HIS 250.A NE2 no hydrogen 3.408 N/A TYR 90.A N GLU 208.A OE1 no hydrogen 2.611 N/A ALA 91.A N ALA 245.A O no hydrogen 2.875 N/A VAL 92.A N ILE 206.A O no hydrogen 2.709 N/A VAL 94.A N ALA 204.A O no hydrogen 2.990 N/A VAL 95.A N GLU 225.A O no hydrogen 2.983 N/A LYS 97.A N GLU 223.A O no hydrogen 2.843 N/A LYS 97.A NZ ASP 222.A O no hydrogen 3.318 N/A GLN 102.A N GLU 105.A OE1 no hydrogen 2.863 N/A ASN 104.A N ASN 231.A OD1 no hydrogen 3.265 N/A GLU 105.A N GLN 102.A O no hydrogen 2.718 N/A GLY 108.A N PHE 149.A O no hydrogen 2.836 N/A LEU 109.A N LEU 106.A O no hydrogen 2.992 N/A LYS 110.A N ASP 202.A OD2 no hydrogen 2.910 N/A SER 111.A N ALA 152.A O no hydrogen 3.143 N/A SER 111.A OG HIS 113.A NE2 no hydrogen 2.711 N/A SER 111.A OG SER 153.A OG no hydrogen 2.907 N/A CYS 112.A N VAL 203.A O no hydrogen 2.794 N/A HIS 113.A N CYS 154.A O no hydrogen 3.002 N/A HIS 113.A ND1 GLY 121.A O no hydrogen 2.810 N/A HIS 113.A NE2 SER 111.A OG no hydrogen 2.711 N/A LEU 116.A N PRO 156.A O no hydrogen 2.768 N/A ARG 117.A NH1 GLU 143.A OE1 no hydrogen 3.113 N/A ARG 118.A N GLY 115.A O no hydrogen 3.226 N/A ARG 118.A NH1 SER 188.A OG no hydrogen 3.172 N/A ARG 118.A NH2 SER 188.A OG no hydrogen 2.952 N/A THR 119.A N ASP 57.A OD1 no hydrogen 3.463 N/A THR 119.A N ASP 57.A OD2 no hydrogen 2.700 N/A THR 119.A OG1 ASP 57.A OD1 no hydrogen 3.311 N/A THR 119.A OG1 ASP 57.A OD2 no hydrogen 3.256 N/A TRP 122.A N ARG 118.A O no hydrogen 3.008 N/A ASN 123.A N ARG 118.A O no hydrogen 2.882 N/A ASN 123.A ND2 ARG 117.A O no hydrogen 3.299 N/A VAL 124.A N THR 119.A O no hydrogen 2.981 N/A ILE 126.A N TRP 122.A O no hydrogen 2.832 N/A GLY 127.A N ASN 123.A O no hydrogen 3.075 N/A THR 128.A N VAL 124.A O no hydrogen 2.713 N/A THR 128.A OG1 VAL 124.A O no hydrogen 2.960 N/A LEU 129.A N PRO 125.A O no hydrogen 2.882 N/A ARG 130.A N GLY 127.A O no hydrogen 3.390 N/A PHE 132.A N LEU 129.A O no hydrogen 2.809 N/A LEU 133.A N ARG 130.A O no hydrogen 2.869 N/A TRP 135.A NE1 GLU 140.A O no hydrogen 2.832 N/A THR 136.A N GLU 140.A OE1 no hydrogen 3.247 N/A THR 136.A OG1 GLU 140.A OE1 no hydrogen 3.335 N/A GLU 140.A N GLY 137.A O no hydrogen 3.006 N/A GLU 143.A N GLU 143.A OE2 no hydrogen 2.663 N/A ALA 144.A N PRO 141.A O no hydrogen 2.790 N/A VAL 146.A N ILE 142.A O no hydrogen 3.110 N/A ALA 147.A N GLU 143.A O no hydrogen 2.846 N/A ARG 148.A NH1 ASN 134.A OD1 no hydrogen 2.745 N/A ARG 148.A NH2 GLU 140.A OE2 no hydrogen 2.617 N/A PHE 149.A N VAL 146.A O no hydrogen 2.844 N/A PHE 150.A N VAL 146.A O no hydrogen 2.961 N/A SER 151.A N LEU 109.A O no hydrogen 2.992 N/A SER 151.A OG GLY 108.A O no hydrogen 3.109 N/A SER 151.A OG LEU 109.A O no hydrogen 3.454 N/A SER 153.A N ASN 165.A O no hydrogen 2.874 N/A SER 153.A OG SER 111.A OG no hydrogen 2.907 N/A CYS 154.A N SER 111.A O no hydrogen 3.029 N/A VAL 155.A N LEU 166.A O no hydrogen 2.644 N/A GLY 157.A N CYS 178.A O no hydrogen 2.860 N/A ALA 158.A N VAL 155.A O no hydrogen 3.034 N/A GLY 161.A N ASP 159.A OD1 no hydrogen 2.786 N/A GLN 162.A N ASP 159.A OD1 no hydrogen 2.923 N/A PHE 163.A N ASP 159.A O no hydrogen 3.027 N/A ASN 165.A ND2 ALA 147.A O no hydrogen 3.024 N/A LEU 166.A N PHE 163.A O no hydrogen 3.006 N/A CYS 167.A N PRO 164.A O no hydrogen 2.919 N/A CYS 167.A SG ALA 158.A O no hydrogen 3.445 N/A ARG 168.A N PRO 164.A O no hydrogen 2.839 N/A ARG 168.A NH1 SER 151.A O no hydrogen 3.374 N/A LEU 169.A N SER 153.A O no hydrogen 3.047 N/A CYS 170.A N CYS 167.A O no hydrogen 2.942 N/A ALA 171.A N GLU 184.A OE2 no hydrogen 2.945 N/A GLY 172.A N GLU 184.A OE1 no hydrogen 2.839 N/A ASN 176.A N THR 173.A O no hydrogen 3.270 N/A ASN 176.A ND2 THR 173.A O no hydrogen 2.774 N/A LYS 177.A N GLY 174.A O no hydrogen 3.300 N/A LYS 177.A NZ CYS 167.A O no hydrogen 3.425 N/A LYS 177.A NZ ARG 168.A O no hydrogen 3.037 N/A LYS 177.A NZ CYS 170.A O no hydrogen 3.126 N/A CYS 178.A N GLU 184.A OE1 no hydrogen 2.893 N/A CYS 178.A SG VAL 155.A O no hydrogen 3.388 N/A CYS 178.A SG ALA 158.A O no hydrogen 3.998 N/A ALA 179.A N ASN 176.A O no hydrogen 2.901 N/A GLN 183.A N SER 181.A OG no hydrogen 3.057 N/A GLU 184.A N SER 181.A O no hydrogen 2.925 N/A TYR 186.A N GLU 184.A OE2 no hydrogen 2.943 N/A TYR 186.A OH ASP 198.A OD2 no hydrogen 2.974 N/A PHE 187.A N GLU 184.A O no hydrogen 3.063 N/A SER 188.A N THR 114.A O no hydrogen 2.868 N/A SER 188.A OG ASP 294.A OD2 no hydrogen 2.760 N/A TYR 189.A OH HIS 250.A NE2 no hydrogen 2.858 N/A SER 190.A OG ASP 214.A OD1 no hydrogen 3.446 N/A SER 190.A OG ASP 214.A OD2 no hydrogen 3.014 N/A GLY 191.A N PHE 187.A O no hydrogen 3.156 N/A ALA 192.A N SER 188.A O no hydrogen 2.987 N/A PHE 193.A N TYR 189.A O no hydrogen 3.071 N/A LYS 194.A N SER 190.A O no hydrogen 3.004 N/A LYS 194.A NZ ASP 198.A OD1 no hydrogen 3.509 N/A LYS 194.A NZ ASP 198.A OD2 no hydrogen 2.880 N/A CYS 195.A N GLY 191.A O no hydrogen 2.958 N/A LEU 196.A N ALA 192.A O no hydrogen 3.239 N/A LEU 196.A N PHE 193.A O no hydrogen 3.014 N/A ARG 197.A N PHE 193.A O no hydrogen 2.760 N/A ARG 197.A NH1 GLU 220.A OE1 no hydrogen 3.151 N/A ASP 198.A N LYS 194.A O no hydrogen 2.729 N/A GLY 199.A N LEU 196.A O no hydrogen 2.914 N/A ALA 200.A N CYS 195.A O no hydrogen 2.966 N/A GLY 201.A N CYS 195.A O no hydrogen 3.132 N/A ASP 202.A N LYS 110.A O no hydrogen 2.740 N/A VAL 203.A N LYS 110.A O no hydrogen 3.203 N/A ALA 204.A N VAL 94.A O no hydrogen 3.032 N/A PHE 205.A N CYS 112.A O no hydrogen 2.985 N/A ILE 206.A N VAL 92.A O no hydrogen 3.116 N/A GLU 208.A N TYR 90.A O no hydrogen 3.090 N/A GLU 213.A N SER 209.A O no hydrogen 3.067 N/A GLU 213.A N THR 210.A O no hydrogen 3.068 N/A ASP 214.A N THR 210.A O no hydrogen 2.839 N/A ALA 219.A N ASP 217.A OD1 no hydrogen 2.953 N/A GLU 220.A N ASP 217.A O no hydrogen 2.923 N/A ARG 221.A N GLU 218.A O no hydrogen 3.066 N/A ASP 222.A N ALA 219.A O no hydrogen 3.400 N/A GLU 223.A N GLU 220.A O no hydrogen 3.128 N/A TYR 224.A N ARG 221.A O no hydrogen 3.092 N/A GLU 225.A N VAL 95.A O no hydrogen 3.134 N/A LEU 226.A N LYS 234.A O no hydrogen 2.759 N/A LEU 227.A N ALA 93.A O no hydrogen 2.863 N/A CYS 228.A N THR 232.A O no hydrogen 2.816 N/A CYS 228.A SG THR 232.A O no hydrogen 3.280 N/A CYS 228.A SG THR 232.A OG1 no hydrogen 3.755 N/A ASN 231.A N CYS 228.A O no hydrogen 2.896 N/A THR 232.A OG1 ASP 230.A OD1 no hydrogen 2.675 N/A THR 232.A OG1 ASP 230.A OD2 no hydrogen 3.269 N/A ARG 233.A NE GLU 225.A OE2 no hydrogen 2.623 N/A ARG 233.A NH1 PHE 101.A O no hydrogen 2.914 N/A ARG 233.A NH2 GLU 225.A OE2 no hydrogen 2.737 N/A LYS 234.A N LEU 226.A O no hydrogen 3.147 N/A LYS 238.A N PRO 235.A O no hydrogen 3.110 N/A ASP 241.A N LYS 238.A O no hydrogen 3.037 N/A CYS 242.A N PHE 239.A O no hydrogen 2.900 N/A HIS 243.A ND1 PHE 239.A O no hydrogen 2.898 N/A HIS 243.A NE2 TYR 321.A OH no hydrogen 3.175 N/A LEU 244.A N ALA 91.A O no hydrogen 2.963 N/A ARG 246.A NH1 SER 319.A O no hydrogen 3.006 N/A VAL 247.A N TYR 89.A O no hydrogen 2.814 N/A SER 249.A N THR 87.A O no hydrogen 2.921 N/A SER 249.A OG GLU 77.A O no hydrogen 2.670 N/A SER 249.A OG THR 87.A O no hydrogen 3.140 N/A HIS 250.A N TYR 79.A OH no hydrogen 3.210 N/A ALA 251.A N LEU 56.A O no hydrogen 2.881 N/A VAL 252.A N ALA 75.A O no hydrogen 2.693 N/A VAL 253.A N VAL 54.A O no hydrogen 2.997 N/A ALA 254.A N ARG 72.A O no hydrogen 2.959 N/A ARG 255.A NE ILE 46.A O no hydrogen 2.728 N/A ARG 255.A NH1 ASN 258.A O no hydrogen 3.049 N/A ARG 255.A NH2 ALA 51.A O no hydrogen 2.466 N/A ARG 255.A NH2 ASP 52.A OD1 no hydrogen 2.457 N/A SER 256.A OG LYS 70.A O no hydrogen 2.764 N/A LYS 260.A NZ SER 2.A O no hydrogen 2.981 N/A LYS 260.A NZ ASP 52.A OD2 no hydrogen 2.843 N/A ILE 264.A N LYS 260.A O no hydrogen 2.951 N/A TRP 265.A N GLU 261.A O no hydrogen 2.898 N/A ASN 266.A N ASP 262.A O no hydrogen 3.047 N/A LEU 267.A N ALA 263.A O no hydrogen 3.022 N/A LEU 268.A N ILE 264.A O no hydrogen 3.042 N/A ARG 269.A N TRP 265.A O no hydrogen 2.817 N/A GLN 270.A N ASN 266.A O no hydrogen 3.053 N/A ALA 271.A N LEU 267.A O no hydrogen 2.733 N/A GLN 272.A N LEU 268.A O no hydrogen 2.878 N/A GLU 273.A N ARG 269.A O no hydrogen 3.205 N/A LYS 274.A N GLN 270.A O no hydrogen 3.178 N/A PHE 275.A N ALA 271.A O no hydrogen 2.851 N/A LYS 279.A N GLY 276.A O no hydrogen 3.238 N/A SER 280.A N LYS 274.A O no hydrogen 3.114 N/A LYS 282.A N SER 280.A OG no hydrogen 3.024 N/A LEU 285.A N PHE 275.A O no hydrogen 2.819 N/A SER 288.A OG ASP 299.A OD1 no hydrogen 2.555 N/A GLN 292.A N PRO 289.A O no hydrogen 2.792 N/A LYS 293.A N SER 182.A OG no hydrogen 2.823 N/A LYS 293.A NZ GLY 291.A O no hydrogen 3.216 N/A ASP 294.A N ASP 299.A OD2 no hydrogen 2.860 N/A LEU 295.A N SER 288.A OG no hydrogen 2.944 N/A LEU 296.A N GLU 12.A OE2 no hydrogen 2.835 N/A LYS 298.A N GLU 77.A OE2 no hydrogen 2.887 N/A LYS 298.A NZ TYR 79.A OH no hydrogen 3.331 N/A LYS 298.A NZ HIS 250.A NE2 no hydrogen 3.495 N/A ASP 299.A N ASP 294.A OD1 no hydrogen 2.645 N/A ALA 301.A N LYS 298.A O no hydrogen 3.085 N/A ILE 302.A N VAL 78.A O no hydrogen 2.747 N/A PHE 304.A N GLN 272.A OE1 no hydrogen 2.632 N/A SER 305.A N ALA 76.A O no hydrogen 2.952 N/A ARG 306.A NH2 ASP 262.A OD2 no hydrogen 2.625 N/A VAL 307.A N VAL 74.A O no hydrogen 3.079 N/A LEU 315.A N ASP 312.A OD1 no hydrogen 2.966 N/A TYR 316.A N ASP 312.A O no hydrogen 3.124 N/A TYR 316.A OH SER 249.A O no hydrogen 2.731 N/A LEU 317.A N SER 313.A O no hydrogen 2.831 N/A GLY 318.A N GLY 314.A O no hydrogen 2.925 N/A GLY 320.A N LEU 317.A O no hydrogen 2.831 N/A TYR 321.A N ARG 246.A O no hydrogen 3.307 N/A TYR 321.A OH HIS 243.A NE2 no hydrogen 3.175 N/A THR 323.A N LEU 244.A O no hydrogen 2.762 N/A