Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w45_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N THR 47.A OG1 no hydrogen 2.551 N/A THR 7.A OG1 LYS 43.A O no hydrogen 3.561 N/A SER 10.A OG GLU 2.A OE1 no hydrogen 3.301 N/A HIS 13.A ND1 HIS 13.A O no hydrogen 3.031 N/A ALA 20.A N PRO 16.A O no hydrogen 3.259 N/A GLU 21.A N ASP 17.A O no hydrogen 3.074 N/A THR 22.A N PRO 18.A O no hydrogen 3.033 N/A THR 22.A OG1 PRO 18.A O no hydrogen 3.259 N/A LEU 23.A N ASP 19.A O no hydrogen 3.175 N/A TYR 24.A N ALA 20.A O no hydrogen 3.269 N/A LYS 25.A N GLU 21.A O no hydrogen 2.930 N/A ALA 26.A N THR 22.A O no hydrogen 2.801 N/A MET 27.A N LEU 23.A O no hydrogen 3.022 N/A MET 27.A N TYR 24.A O no hydrogen 3.101 N/A LYS 28.A N TYR 24.A O no hydrogen 2.671 N/A LYS 28.A NZ TYR 24.A OH no hydrogen 2.784 N/A THR 32.A OG1 GLU 71.A OE1 no hydrogen 3.505 N/A ASN 33.A N ALA 26.A O no hydrogen 3.049 N/A GLU 34.A N GLU 34.A OE2 no hydrogen 2.993 N/A GLN 35.A NE2 ASP 39.A OD2 no hydrogen 3.394 N/A ALA 36.A N ASN 33.A OD1 no hydrogen 3.200 N/A ILE 38.A N GLU 34.A O no hydrogen 3.014 N/A ASP 39.A N GLN 35.A O no hydrogen 2.852 N/A VAL 40.A N ALA 36.A O no hydrogen 3.029 N/A LEU 41.A N ILE 37.A O no hydrogen 2.979 N/A THR 42.A N ILE 38.A O no hydrogen 3.062 N/A THR 42.A OG1 ILE 38.A O no hydrogen 2.671 N/A THR 42.A OG1 SER 314.A OG no hydrogen 2.892 N/A LYS 43.A N VAL 40.A O no hydrogen 3.197 N/A LYS 43.A NZ SER 314.A OG no hydrogen 2.673 N/A ARG 44.A NE ASP 19.A OD1 no hydrogen 2.732 N/A ARG 44.A NH1 LYS 43.A O no hydrogen 3.302 N/A ARG 44.A NH2 ASP 19.A OD1 no hydrogen 3.284 N/A ARG 44.A NH2 ASP 19.A OD2 no hydrogen 2.807 N/A ASN 46.A N GLU 278.A OE1 no hydrogen 2.801 N/A ASN 46.A ND2 TYR 85.A O no hydrogen 2.690 N/A GLN 48.A N SER 45.A OG no hydrogen 3.087 N/A ARG 49.A N SER 45.A O no hydrogen 2.873 N/A ARG 49.A NE LEU 83.A O no hydrogen 3.032 N/A ARG 49.A NH1 LEU 41.A O no hydrogen 3.279 N/A ARG 49.A NH1 ARG 44.A O no hydrogen 2.811 N/A ARG 49.A NH2 GLU 4.A O no hydrogen 2.386 N/A ARG 49.A NH2 LEU 83.A O no hydrogen 2.647 N/A GLN 50.A N ASN 46.A O no hydrogen 2.882 N/A GLN 50.A NE2 ASN 46.A O no hydrogen 3.448 N/A GLN 50.A NE2 ASN 46.A OD1 no hydrogen 3.045 N/A GLN 50.A NE2 MET 84.A O no hydrogen 2.684 N/A GLN 51.A N THR 47.A O no hydrogen 3.057 N/A ILE 52.A N GLN 48.A O no hydrogen 2.899 N/A ALA 53.A N ARG 49.A O no hydrogen 3.006 N/A LYS 54.A N GLN 50.A O no hydrogen 3.327 N/A LYS 54.A NZ GLN 51.A OE1 no hydrogen 3.408 N/A SER 55.A N GLN 51.A O no hydrogen 3.138 N/A SER 55.A OG ASP 17.A OD2 no hydrogen 2.749 N/A PHE 56.A N ILE 52.A O no hydrogen 2.914 N/A LYS 57.A N ALA 53.A O no hydrogen 2.803 N/A ALA 58.A N LYS 54.A O no hydrogen 3.098 N/A GLN 59.A N SER 55.A O no hydrogen 2.799 N/A GLN 59.A NE2 ASP 17.A O no hydrogen 3.276 N/A GLN 59.A NE2 SER 55.A OG no hydrogen 2.714 N/A PHE 60.A N PHE 56.A O no hydrogen 3.161 N/A GLY 61.A N LYS 57.A O no hydrogen 2.762 N/A GLU 66.A N ASP 63.A OD2 no hydrogen 3.315 N/A THR 67.A N ASP 63.A O no hydrogen 3.136 N/A THR 67.A OG1 ASP 63.A O no hydrogen 3.061 N/A LEU 68.A N LEU 64.A O no hydrogen 2.859 N/A LYS 69.A N THR 65.A O no hydrogen 2.822 N/A SER 70.A N GLU 66.A O no hydrogen 2.881 N/A GLU 71.A N THR 67.A O no hydrogen 2.762 N/A LEU 72.A N LEU 68.A O no hydrogen 3.068 N/A LYS 75.A NZ ASP 266.A OD2 no hydrogen 2.954 N/A GLU 77.A N SER 73.A O no hydrogen 3.296 N/A ARG 78.A N GLY 74.A O no hydrogen 3.181 N/A LEU 79.A N LYS 75.A O no hydrogen 2.837 N/A ILE 80.A N PHE 76.A O no hydrogen 3.003 N/A VAL 81.A N GLU 77.A O no hydrogen 2.866 N/A ALA 82.A N ARG 78.A O no hydrogen 2.948 N/A LEU 83.A N LEU 79.A O no hydrogen 3.057 N/A MET 84.A N VAL 81.A O no hydrogen 2.865 N/A ARG 89.A NE ASP 131.A OD1 no hydrogen 2.845 N/A ARG 89.A NE ASP 131.A OD2 no hydrogen 3.138 N/A ARG 89.A NH2 GLU 130.A OE2 no hydrogen 3.195 N/A ARG 89.A NH2 ASP 131.A OD2 no hydrogen 2.516 N/A TYR 90.A N PRO 86.A O no hydrogen 3.172 N/A GLU 91.A N GLU 91.A OE2 no hydrogen 2.861 N/A ALA 92.A N TYR 88.A O no hydrogen 3.280 N/A LYS 93.A N ARG 89.A O no hydrogen 2.928 N/A LYS 93.A NZ ASP 97.A OD2 no hydrogen 3.195 N/A GLU 94.A N TYR 90.A O no hydrogen 3.125 N/A LEU 95.A N GLU 91.A O no hydrogen 2.844 N/A HIS 96.A N ALA 92.A O no hydrogen 2.880 N/A ASP 97.A N LYS 93.A O no hydrogen 2.805 N/A ALA 98.A N GLU 94.A O no hydrogen 3.088 N/A MET 99.A N HIS 96.A O no hydrogen 3.118 N/A LYS 100.A N HIS 96.A O no hydrogen 2.874 N/A THR 104.A OG1 ASP 143.A OD2 no hydrogen 2.594 N/A LYS 105.A N ALA 98.A O no hydrogen 3.095 N/A VAL 108.A N LYS 105.A O no hydrogen 3.214 N/A ILE 109.A N LYS 105.A O no hydrogen 3.503 N/A ILE 110.A N GLU 106.A O no hydrogen 2.807 N/A GLU 111.A N GLY 107.A O no hydrogen 2.927 N/A ILE 112.A N VAL 108.A O no hydrogen 3.121 N/A LEU 113.A N ILE 109.A O no hydrogen 3.038 N/A ALA 114.A N ILE 110.A O no hydrogen 3.066 N/A SER 115.A N GLU 111.A O no hydrogen 3.150 N/A SER 115.A OG GLU 111.A O no hydrogen 2.585 N/A SER 115.A OG ILE 112.A O no hydrogen 3.567 N/A ARG 116.A NH1 SER 115.A OG no hydrogen 2.623 N/A ARG 116.A NH2 GLU 91.A OE1 no hydrogen 2.903 N/A ARG 116.A NH2 SER 275.A OG no hydrogen 3.264 N/A THR 117.A N GLN 120.A OE1 no hydrogen 3.001 N/A LYS 118.A N ASP 161.A OD1 no hydrogen 3.408 N/A GLN 120.A N THR 117.A OG1 no hydrogen 3.246 N/A LEU 121.A N THR 117.A O no hydrogen 2.920 N/A ARG 122.A N LYS 118.A O no hydrogen 2.867 N/A GLU 123.A N ASN 119.A O no hydrogen 3.105 N/A ILE 124.A N GLN 120.A O no hydrogen 2.953 N/A MET 125.A N LEU 121.A O no hydrogen 2.852 N/A LYS 126.A N ARG 122.A O no hydrogen 3.089 N/A ALA 127.A N GLU 123.A O no hydrogen 2.844 N/A TYR 128.A N ILE 124.A O no hydrogen 2.698 N/A TYR 128.A OH ASP 139.A OD2 no hydrogen 2.881 N/A GLU 129.A N MET 125.A O no hydrogen 3.182 N/A GLU 130.A N LYS 126.A O no hydrogen 3.167 N/A ASP 131.A N ALA 127.A O no hydrogen 3.209 N/A TYR 132.A N TYR 128.A O no hydrogen 2.923 N/A GLY 133.A N GLU 129.A O no hydrogen 3.088 N/A SER 134.A OG ASP 139.A OD1 no hydrogen 3.058 N/A SER 134.A OG ASP 139.A OD2 no hydrogen 2.776 N/A GLU 138.A N SER 135.A OG no hydrogen 3.334 N/A ASP 139.A N SER 135.A O no hydrogen 3.196 N/A ILE 140.A N LEU 136.A O no hydrogen 3.047 N/A GLN 141.A N GLU 137.A O no hydrogen 2.917 N/A ALA 142.A N GLU 138.A O no hydrogen 2.798 N/A ASP 143.A N ASP 139.A O no hydrogen 2.891 N/A ASP 143.A N ILE 140.A O no hydrogen 3.305 N/A THR 144.A N ILE 140.A O no hydrogen 2.915 N/A THR 144.A OG1 ILE 140.A O no hydrogen 2.626 N/A ILE 151.A N TYR 147.A O no hydrogen 3.122 N/A LEU 152.A N LEU 148.A O no hydrogen 2.985 N/A VAL 153.A N GLU 149.A O no hydrogen 2.747 N/A CYS 154.A N ARG 150.A O no hydrogen 2.904 N/A LEU 155.A N ILE 151.A O no hydrogen 2.761 N/A LEU 156.A N LEU 152.A O no hydrogen 3.042 N/A GLN 157.A N VAL 153.A O no hydrogen 3.074 N/A ARG 160.A NH1 ALA 114.A O no hydrogen 3.212 N/A SER 165.A OG SER 164.A O no hydrogen 2.748 N/A ALA 170.A N ASP 168.A OD1 no hydrogen 2.886 N/A LEU 171.A N ASP 168.A OD1 no hydrogen 3.105 N/A ALA 172.A N ASP 168.A O no hydrogen 2.861 N/A LEU 173.A N PRO 169.A O no hydrogen 2.997 N/A GLN 174.A N ALA 170.A O no hydrogen 3.262 N/A GLN 174.A NE2 GLN 174.A O no hydrogen 3.349 N/A GLN 174.A NE2 ASP 178.A OD1 no hydrogen 3.364 N/A GLN 174.A NE2 ASP 178.A OD2 no hydrogen 2.728 N/A ASP 175.A N LEU 171.A O no hydrogen 2.977 N/A ALA 176.A N ALA 172.A O no hydrogen 3.471 N/A GLN 177.A N LEU 173.A O no hydrogen 3.033 N/A ASP 178.A N GLN 174.A O no hydrogen 2.841 N/A LEU 179.A N ASP 175.A O no hydrogen 2.955 N/A TYR 180.A N ALA 176.A O no hydrogen 2.778 N/A ALA 181.A N GLN 177.A O no hydrogen 2.800 N/A ALA 182.A N ASP 178.A O no hydrogen 3.147 N/A ALA 182.A N LEU 179.A O no hydrogen 3.148 N/A GLU 184.A N ALA 181.A O no hydrogen 3.339 N/A LYS 185.A N ALA 182.A O no hydrogen 2.927 N/A LYS 185.A NZ THR 189.A OG1 no hydrogen 2.924 N/A ARG 187.A NH2 LYS 226.A O no hydrogen 3.050 N/A THR 189.A N ILE 186.A O no hydrogen 3.329 N/A THR 189.A OG1 ILE 186.A O no hydrogen 3.261 N/A LYS 193.A NZ ASP 178.A OD1 no hydrogen 3.327 N/A PHE 194.A N ASP 190.A O no hydrogen 3.362 N/A ILE 195.A N GLU 191.A O no hydrogen 3.226 N/A THR 196.A N MET 192.A O no hydrogen 3.165 N/A THR 196.A OG1 MET 192.A O no hydrogen 2.781 N/A ILE 197.A N LYS 193.A O no hydrogen 3.260 N/A LEU 198.A N PHE 194.A O no hydrogen 2.930 N/A CYS 199.A N ILE 195.A O no hydrogen 2.773 N/A CYS 199.A SG ILE 195.A O no hydrogen 3.117 N/A THR 200.A N THR 196.A O no hydrogen 2.793 N/A THR 200.A OG1 THR 196.A O no hydrogen 2.667 N/A ARG 201.A NE ASP 175.A OD1 no hydrogen 2.928 N/A ARG 201.A NH1 THR 200.A OG1 no hydrogen 3.165 N/A ARG 201.A NH2 ASP 175.A OD2 no hydrogen 2.776 N/A HIS 205.A N SER 202.A OG no hydrogen 3.131 N/A LEU 206.A N SER 202.A O no hydrogen 2.824 N/A LEU 207.A N ALA 203.A O no hydrogen 2.959 N/A ARG 208.A N THR 204.A O no hydrogen 3.464 N/A ARG 208.A NE GLU 212.A OE2 no hydrogen 3.084 N/A VAL 209.A N HIS 205.A O no hydrogen 3.105 N/A PHE 210.A N LEU 206.A O no hydrogen 3.053 N/A GLU 211.A N LEU 207.A O no hydrogen 3.202 N/A GLU 212.A N ARG 208.A O no hydrogen 2.876 N/A TYR 213.A N VAL 209.A O no hydrogen 2.748 N/A GLU 214.A N PHE 210.A O no hydrogen 3.189 N/A LYS 215.A N GLU 211.A O no hydrogen 3.102 N/A LYS 215.A NZ GLU 212.A OE1 no hydrogen 3.001 N/A LYS 215.A NZ GLU 212.A OE2 no hydrogen 3.246 N/A ILE 216.A N GLU 212.A O no hydrogen 2.830 N/A ALA 217.A N TYR 213.A O no hydrogen 2.845 N/A ASN 218.A N GLU 214.A O no hydrogen 3.208 N/A SER 220.A N ASP 223.A OD2 no hydrogen 3.397 N/A SER 220.A OG GLU 222.A OE2 no hydrogen 3.235 N/A SER 220.A OG ASP 223.A OD2 no hydrogen 2.827 N/A GLU 222.A N GLU 222.A OE2 no hydrogen 3.032 N/A ASP 223.A N SER 220.A O no hydrogen 3.248 N/A SER 224.A N SER 220.A O no hydrogen 3.345 N/A SER 224.A OG TYR 213.A OH no hydrogen 2.853 N/A ILE 225.A N ILE 221.A O no hydrogen 3.044 N/A LYS 226.A N GLU 222.A O no hydrogen 3.322 N/A SER 227.A N ASP 223.A O no hydrogen 3.056 N/A SER 227.A N SER 224.A O no hydrogen 3.309 N/A SER 227.A OG ASP 223.A O no hydrogen 3.115 N/A GLU 228.A N ILE 225.A O no hydrogen 3.183 N/A THR 229.A N ILE 225.A O no hydrogen 3.213 N/A THR 229.A OG1 ILE 225.A O no hydrogen 3.111 N/A GLU 234.A N HIS 230.A O no hydrogen 3.182 N/A GLU 235.A N GLY 231.A O no hydrogen 3.081 N/A ALA 236.A N SER 232.A O no hydrogen 2.896 N/A MET 237.A N LEU 233.A O no hydrogen 3.005 N/A LEU 238.A N GLU 234.A O no hydrogen 2.873 N/A THR 239.A N GLU 235.A O no hydrogen 3.047 N/A THR 239.A OG1 GLU 235.A O no hydrogen 2.698 N/A VAL 240.A N ALA 236.A O no hydrogen 3.152 N/A VAL 241.A N MET 237.A O no hydrogen 3.055 N/A LYS 242.A N LEU 238.A O no hydrogen 3.093 N/A LYS 242.A NZ GLU 253.A OE2 no hydrogen 2.711 N/A CYS 243.A N THR 239.A O no hydrogen 2.926 N/A CYS 243.A SG ALA 114.A O no hydrogen 3.893 N/A CYS 243.A SG THR 239.A O no hydrogen 3.486 N/A THR 244.A N VAL 240.A O no hydrogen 3.163 N/A THR 244.A N VAL 241.A O no hydrogen 3.116 N/A THR 244.A OG1 VAL 240.A O no hydrogen 2.702 N/A GLN 245.A N VAL 241.A O no hydrogen 3.071 N/A ASN 246.A N LYS 242.A O no hydrogen 2.944 N/A ASN 246.A ND2 HIS 287.A NE2 no hydrogen 3.380 N/A HIS 248.A N ASN 246.A OD1 no hydrogen 3.182 N/A SER 249.A N ASN 246.A O no hydrogen 3.078 N/A SER 249.A N ASN 246.A OD1 no hydrogen 3.233 N/A TYR 250.A N ASN 246.A O no hydrogen 3.062 N/A PHE 251.A N LEU 247.A O no hydrogen 3.377 N/A ALA 252.A N HIS 248.A O no hydrogen 3.309 N/A GLU 253.A N SER 249.A O no hydrogen 2.951 N/A ARG 254.A N TYR 250.A O no hydrogen 2.756 N/A ARG 254.A NE GLU 111.A OE1 no hydrogen 2.990 N/A ARG 254.A NH2 GLU 111.A OE1 no hydrogen 2.875 N/A LEU 255.A N PHE 251.A O no hydrogen 2.775 N/A TYR 256.A N ALA 252.A O no hydrogen 2.889 N/A TYR 257.A N GLU 253.A O no hydrogen 3.099 N/A ALA 258.A N ARG 254.A O no hydrogen 3.323 N/A MET 259.A N TYR 256.A O no hydrogen 2.904 N/A LYS 260.A N TYR 256.A O no hydrogen 2.689 N/A THR 264.A OG1 ASP 303.A O no hydrogen 3.341 N/A ARG 265.A N ALA 258.A O no hydrogen 2.658 N/A LEU 269.A N ARG 265.A O no hydrogen 3.095 N/A ILE 270.A N ASP 266.A O no hydrogen 2.762 N/A ARG 271.A N GLY 267.A O no hydrogen 2.966 N/A ARG 271.A NE GLU 111.A OE2 no hydrogen 2.562 N/A ARG 271.A NH1 GLU 94.A OE2 no hydrogen 2.937 N/A ARG 271.A NH2 GLU 111.A OE1 no hydrogen 3.131 N/A ARG 271.A NH2 GLU 111.A OE2 no hydrogen 3.355 N/A ASN 272.A N THR 268.A O no hydrogen 3.262 N/A ASN 272.A ND2 GLU 111.A OE1 no hydrogen 3.151 N/A ASN 272.A ND2 GLU 111.A OE2 no hydrogen 3.530 N/A ASN 272.A ND2 THR 268.A O no hydrogen 2.732 N/A ILE 273.A N LEU 269.A O no hydrogen 3.149 N/A VAL 274.A N ILE 270.A O no hydrogen 2.863 N/A SER 275.A N ARG 271.A O no hydrogen 3.020 N/A SER 275.A OG ARG 271.A O no hydrogen 2.610 N/A ARG 276.A N ASN 272.A O no hydrogen 3.264 N/A ARG 276.A NE ASP 280.A OD2 no hydrogen 3.018 N/A ARG 276.A NH2 ASP 280.A OD1 no hydrogen 2.640 N/A ARG 276.A NH2 ASP 280.A OD2 no hydrogen 3.430 N/A SER 277.A OG ILE 273.A O no hydrogen 2.560 N/A SER 277.A OG VAL 274.A O no hydrogen 2.884 N/A ILE 279.A N ARG 276.A O no hydrogen 3.055 N/A ASP 280.A N ARG 276.A O no hydrogen 2.988 N/A LEU 283.A N ASP 280.A O no hydrogen 3.026 N/A ILE 284.A N ASP 280.A O no hydrogen 3.055 N/A LYS 285.A N LEU 281.A O no hydrogen 2.957 N/A LYS 285.A NZ VAL 316.A O no hydrogen 3.111 N/A LYS 285.A NZ SER 318.A O no hydrogen 2.784 N/A HIS 287.A N LEU 283.A O no hydrogen 2.903 N/A HIS 287.A ND1 LEU 283.A O no hydrogen 3.224 N/A PHE 288.A N ILE 284.A O no hydrogen 2.735 N/A LYS 289.A N LYS 285.A O no hydrogen 3.104 N/A LYS 290.A N CYS 286.A O no hydrogen 3.271 N/A MET 291.A N HIS 287.A O no hydrogen 3.022 N/A TYR 292.A N PHE 288.A O no hydrogen 3.047 N/A TYR 292.A N LYS 289.A O no hydrogen 3.363 N/A GLY 293.A N LYS 289.A O no hydrogen 2.869 N/A LYS 294.A N TYR 292.A O no hydrogen 2.837 N/A THR 295.A OG1 SER 297.A OG no hydrogen 3.275 N/A SER 297.A N ASP 319.A OD2 no hydrogen 3.024 N/A SER 297.A OG THR 295.A OG1 no hydrogen 3.275 N/A SER 297.A OG ASP 319.A OD2 no hydrogen 2.904 N/A SER 298.A N THR 295.A OG1 no hydrogen 3.242 N/A MET 299.A N THR 295.A O no hydrogen 3.149 N/A ILE 300.A N LEU 296.A O no hydrogen 2.860 N/A MET 301.A N SER 297.A O no hydrogen 2.753 N/A GLU 302.A N MET 299.A O no hydrogen 3.303 N/A ASP 303.A N MET 299.A O no hydrogen 3.163 N/A THR 304.A OG1 ILE 300.A O no hydrogen 2.836 N/A TYR 308.A OH ASP 266.A OD1 no hydrogen 3.206 N/A LYS 309.A N SER 305.A O no hydrogen 2.921 N/A ASN 310.A N GLY 306.A O no hydrogen 3.388 N/A ALA 311.A N ASP 307.A O no hydrogen 3.115 N/A ALA 311.A N TYR 308.A O no hydrogen 3.252 N/A LEU 312.A N TYR 308.A O no hydrogen 3.197 N/A LEU 313.A N LYS 309.A O no hydrogen 3.089 N/A SER 314.A N ASN 310.A O no hydrogen 2.999 N/A SER 314.A OG THR 42.A OG1 no hydrogen 2.892 N/A LEU 315.A N ALA 311.A O no hydrogen 2.800 N/A VAL 316.A N LEU 312.A O no hydrogen 2.701 N/A GLY 317.A N LEU 313.A O no hydrogen 2.947 N/A