Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lfe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 PRO 86.A O no hydrogen 3.042 N/A TYR 6.A N VAL 17.A O no hydrogen 2.904 N/A TYR 6.A OH TYR 21.A O no hydrogen 2.630 N/A GLN 8.A N TRP 15.A O no hydrogen 3.055 N/A LEU 10.A N THR 13.A O no hydrogen 3.156 N/A THR 13.A N LEU 10.A O no hydrogen 2.868 N/A TRP 15.A N THR 13.A O no hydrogen 2.979 N/A GLU 16.A N TYR 97.A OH no hydrogen 3.046 N/A VAL 17.A N TYR 6.A O no hydrogen 3.201 N/A GLU 19.A N THR 4.A O no hydrogen 3.085 N/A ARG 20.A NE ASP 37.A OD1 no hydrogen 2.827 N/A ARG 20.A NH2 ASP 37.A OD2 no hydrogen 3.087 N/A TYR 21.A N PRO 18.A O no hydrogen 3.028 N/A TYR 21.A OH ASP 82.A OD1 no hydrogen 2.650 N/A GLN 22.A N PHE 36.A O no hydrogen 2.877 N/A GLN 22.A NE2 GLU 19.A O no hydrogen 2.483 N/A SER 25.A N ALA 34.A O no hydrogen 2.684 N/A VAL 27.A N VAL 32.A O no hydrogen 3.005 N/A VAL 32.A N GLY 28.A O no hydrogen 3.416 N/A CYS 33.A N VAL 46.A O no hydrogen 2.805 N/A ALA 34.A N SER 25.A O no hydrogen 2.582 N/A ALA 35.A N VAL 44.A O no hydrogen 2.800 N/A PHE 36.A N GLN 22.A O no hydrogen 2.785 N/A ASP 37.A N LEU 42.A O no hydrogen 2.811 N/A THR 38.A N ARG 20.A O no hydrogen 2.858 N/A THR 38.A OG1 ARG 20.A O no hydrogen 3.027 N/A LYS 39.A N ASP 37.A OD1 no hydrogen 3.135 N/A THR 40.A OG1 ASP 37.A OD2 no hydrogen 2.724 N/A GLY 41.A N ASP 37.A O no hydrogen 2.724 N/A LEU 42.A N THR 40.A OG1 no hydrogen 3.355 N/A VAL 44.A N ALA 35.A O no hydrogen 2.861 N/A ALA 45.A N THR 100.A O no hydrogen 2.837 N/A VAL 46.A N CYS 33.A O no hydrogen 2.774 N/A LYS 47.A N LEU 98.A O no hydrogen 2.666 N/A LYS 47.A NZ GLU 65.A OE1 no hydrogen 3.220 N/A LYS 47.A NZ GLU 65.A OE2 no hydrogen 2.999 N/A LYS 48.A N SER 31.A O no hydrogen 3.119 N/A LYS 48.A NZ ILE 14.A O no hydrogen 3.551 N/A LEU 49.A N VAL 96.A O no hydrogen 2.969 N/A ARG 51.A NH1 GLN 54.A OE1 no hydrogen 3.561 N/A GLN 54.A N ARG 51.A O no hydrogen 3.377 N/A HIS 58.A N SER 55.A OG no hydrogen 3.120 N/A HIS 58.A ND1 ARG 51.A O no hydrogen 2.615 N/A ALA 59.A N SER 55.A O no hydrogen 2.974 N/A LYS 60.A N ILE 56.A O no hydrogen 2.985 N/A LYS 60.A NZ GLU 309.A O no hydrogen 2.868 N/A LYS 60.A NZ ARG 311.A O no hydrogen 2.900 N/A ARG 61.A N ILE 57.A O no hydrogen 3.140 N/A THR 62.A N HIS 58.A O no hydrogen 2.950 N/A THR 62.A OG1 PRO 52.A O no hydrogen 3.245 N/A THR 62.A OG1 HIS 58.A O no hydrogen 2.600 N/A TYR 63.A N ALA 59.A O no hydrogen 3.243 N/A ARG 64.A N LYS 60.A O no hydrogen 2.725 N/A GLU 65.A N ARG 61.A O no hydrogen 2.752 N/A LEU 66.A N THR 62.A O no hydrogen 2.951 N/A ARG 67.A N TYR 63.A O no hydrogen 2.913 N/A LEU 68.A N ARG 64.A O no hydrogen 3.168 N/A LEU 69.A N GLU 65.A O no hydrogen 3.090 N/A LYS 70.A N LEU 66.A O no hydrogen 3.033 N/A LYS 70.A NZ GLU 325.A O no hydrogen 2.995 N/A LYS 70.A NZ GLU 325.A OE1 no hydrogen 2.714 N/A HIS 71.A N ARG 67.A O no hydrogen 3.158 N/A HIS 71.A NE2 ASP 302.A O no hydrogen 2.857 N/A MET 72.A N LEU 69.A O no hydrogen 3.186 N/A LYS 73.A N TYR 134.A OH no hydrogen 2.907 N/A LYS 73.A NZ LYS 70.A O no hydrogen 3.158 N/A ASN 76.A N HIS 74.A ND1 no hydrogen 3.109 N/A ASN 76.A ND2 LEU 158.A O no hydrogen 3.095 N/A VAL 77.A N HIS 74.A O no hydrogen 3.238 N/A ILE 78.A N ILE 160.A O no hydrogen 2.880 N/A LEU 81.A N VAL 99.A O no hydrogen 2.791 N/A ASP 82.A N VAL 99.A O no hydrogen 3.264 N/A PHE 84.A N TYR 97.A O no hydrogen 2.992 N/A THR 85.A OG1 ASP 95.A O no hydrogen 2.814 N/A ALA 87.A N THR 85.A OG1 no hydrogen 3.242 N/A ARG 88.A N GLU 92.A OE1 no hydrogen 2.438 N/A SER 89.A OG GLU 91.A OE2 no hydrogen 3.358 N/A GLU 92.A N SER 89.A O no hydrogen 3.397 N/A PHE 93.A N LEU 90.A O no hydrogen 3.022 N/A TYR 97.A N PHE 84.A O no hydrogen 2.929 N/A LEU 98.A N LYS 47.A O no hydrogen 2.807 N/A VAL 99.A N ASP 82.A O no hydrogen 2.834 N/A THR 100.A N ALA 45.A O no hydrogen 3.023 N/A THR 100.A OG1 HIS 101.A O no hydrogen 3.301 N/A LEU 102.A N ARG 43.A O no hydrogen 2.986 N/A LEU 107.A N PRO 147.A O no hydrogen 3.334 N/A ASN 109.A N ASP 106.A OD2 no hydrogen 2.973 N/A ILE 110.A N ASP 106.A O no hydrogen 3.294 N/A VAL 111.A N LEU 107.A O no hydrogen 2.737 N/A LYS 112.A N ASN 108.A O no hydrogen 2.734 N/A GLN 114.A N VAL 111.A O no hydrogen 2.815 N/A LEU 116.A N LEU 197.A O no hydrogen 3.024 N/A HIS 120.A N THR 117.A OG1 no hydrogen 3.411 N/A HIS 120.A NE2 SER 156.A OG no hydrogen 2.709 N/A VAL 121.A N THR 117.A O no hydrogen 3.151 N/A GLN 122.A N ASP 118.A O no hydrogen 3.069 N/A GLN 122.A NE2 GLN 291.A OE1 no hydrogen 2.652 N/A PHE 123.A N ASP 119.A O no hydrogen 3.149 N/A LEU 124.A N HIS 120.A O no hydrogen 3.009 N/A ILE 125.A N VAL 121.A O no hydrogen 2.837 N/A TYR 126.A N GLN 122.A O no hydrogen 2.909 N/A TYR 126.A OH GLU 298.A OE1 no hydrogen 2.477 N/A GLN 127.A N PHE 123.A O no hydrogen 3.246 N/A GLN 127.A NE2 PHE 123.A O no hydrogen 3.187 N/A GLN 127.A NE2 SER 156.A O no hydrogen 2.737 N/A ILE 128.A N LEU 124.A O no hydrogen 3.210 N/A LEU 129.A N ILE 125.A O no hydrogen 2.866 N/A ARG 130.A N TYR 126.A O no hydrogen 2.813 N/A ARG 130.A NE ASP 297.A O no hydrogen 2.994 N/A ARG 130.A NH1 ASN 76.A OD1 no hydrogen 2.740 N/A ARG 130.A NH2 GLU 75.A OE1 no hydrogen 3.552 N/A ARG 130.A NH2 GLU 75.A OE2 no hydrogen 3.354 N/A ARG 130.A NH2 ASP 297.A O no hydrogen 3.309 N/A ARG 130.A NH2 ASP 297.A OD2 no hydrogen 3.508 N/A GLY 131.A N GLN 127.A O no hydrogen 2.923 N/A LEU 132.A N ILE 128.A O no hydrogen 2.778 N/A LYS 133.A N LEU 129.A O no hydrogen 2.861 N/A LYS 133.A NZ GLU 298.A O no hydrogen 2.619 N/A TYR 134.A N ARG 130.A O no hydrogen 3.502 N/A TYR 134.A OH HIS 71.A O no hydrogen 3.210 N/A ILE 135.A N GLY 131.A O no hydrogen 3.172 N/A HIS 136.A N LEU 132.A O no hydrogen 2.781 N/A HIS 136.A NE2 ASP 186.A OD1 no hydrogen 2.814 N/A SER 137.A N LYS 133.A O no hydrogen 2.978 N/A SER 137.A OG LYS 133.A O no hydrogen 3.340 N/A SER 137.A OG TYR 134.A O no hydrogen 2.524 N/A ALA 138.A N TYR 134.A O no hydrogen 3.159 N/A ALA 138.A N ILE 135.A O no hydrogen 2.986 N/A ASP 139.A N HIS 136.A O no hydrogen 2.835 N/A ILE 140.A N ILE 135.A O no hydrogen 3.343 N/A HIS 142.A N ASP 186.A OD1 no hydrogen 2.893 N/A HIS 142.A NE2 LEU 161.A O no hydrogen 2.803 N/A ARG 143.A N ASP 186.A OD2 no hydrogen 2.844 N/A ASP 144.A N HIS 142.A ND1 no hydrogen 3.051 N/A LYS 146.A NZ ASP 144.A OD2 no hydrogen 3.161 N/A LYS 146.A NZ THR 166.A OG1 no hydrogen 3.039 N/A ASN 149.A N LYS 146.A O no hydrogen 2.910 N/A LEU 150.A N PRO 147.A O no hydrogen 3.027 N/A ALA 151.A N LYS 159.A O no hydrogen 2.798 N/A VAL 152.A N ALA 105.A O no hydrogen 2.957 N/A ASN 153.A N GLU 157.A O no hydrogen 3.035 N/A ASN 153.A ND2 GLU 157.A OE2 no hydrogen 2.841 N/A SER 156.A N ASN 153.A O no hydrogen 3.265 N/A SER 156.A OG HIS 120.A NE2 no hydrogen 2.709 N/A GLU 157.A N ASN 153.A OD1 no hydrogen 2.993 N/A LEU 158.A N GLN 127.A OE1 no hydrogen 2.884 N/A LYS 159.A N ALA 151.A O no hydrogen 2.730 N/A LYS 159.A NZ GLU 75.A O no hydrogen 2.703 N/A ILE 160.A N ASN 76.A O no hydrogen 2.892 N/A LEU 161.A N ASN 149.A O no hydrogen 2.974 N/A GLY 164.A N ASP 162.A OD2 no hydrogen 3.035 N/A ARG 167.A NH1 GLY 206.A O no hydrogen 2.562 N/A TRP 168.A NE1 GLY 206.A O no hydrogen 3.146 N/A TYR 169.A N THR 166.A O no hydrogen 3.479 N/A TYR 169.A OH GLU 196.A OE1 no hydrogen 2.493 N/A TYR 169.A OH GLU 196.A OE2 no hydrogen 3.314 N/A ARG 170.A N ARG 167.A O no hydrogen 3.107 N/A GLU 173.A N GLU 173.A OE2 no hydrogen 2.778 N/A ILE 174.A N ALA 171.A O no hydrogen 3.079 N/A MET 175.A N ALA 171.A O no hydrogen 3.281 N/A LEU 176.A N PRO 172.A O no hydrogen 3.232 N/A ASN 177.A N ILE 174.A O no hydrogen 3.056 N/A TRP 178.A N GLU 173.A O no hydrogen 3.147 N/A THR 184.A OG1 ASN 182.A OD1 no hydrogen 2.312 N/A THR 184.A OG1 SER 274.A O no hydrogen 2.743 N/A VAL 185.A N ASN 182.A O no hydrogen 3.067 N/A ASP 186.A N GLN 183.A O no hydrogen 3.013 N/A TRP 188.A N THR 184.A O no hydrogen 3.082 N/A SER 189.A N VAL 185.A O no hydrogen 3.411 N/A SER 189.A OG TYR 169.A O no hydrogen 2.696 N/A SER 189.A OG VAL 185.A O no hydrogen 3.262 N/A VAL 190.A N ASP 186.A O no hydrogen 3.017 N/A GLY 191.A N ILE 187.A O no hydrogen 2.981 N/A CYS 192.A N TRP 188.A O no hydrogen 3.138 N/A CYS 192.A SG TRP 168.A O no hydrogen 3.978 N/A CYS 192.A SG TRP 188.A O no hydrogen 3.545 N/A ILE 193.A N SER 189.A O no hydrogen 3.000 N/A MET 194.A N VAL 190.A O no hydrogen 2.848 N/A ALA 195.A N GLY 191.A O no hydrogen 3.042 N/A GLU 196.A N CYS 192.A O no hydrogen 3.344 N/A LEU 197.A N ILE 193.A O no hydrogen 3.086 N/A LEU 197.A N MET 194.A O no hydrogen 3.167 N/A LEU 198.A N MET 194.A O no hydrogen 3.034 N/A THR 199.A N ALA 195.A O no hydrogen 2.889 N/A THR 199.A OG1 ALA 195.A O no hydrogen 3.152 N/A GLY 200.A N GLU 196.A O no hydrogen 2.891 N/A ARG 201.A N THR 199.A OG1 no hydrogen 3.007 N/A GLY 206.A N PHE 204.A O no hydrogen 2.966 N/A THR 207.A N ASP 211.A OD1 no hydrogen 2.882 N/A ASP 211.A N ASP 208.A OD1 no hydrogen 2.726 N/A GLN 212.A N ASP 208.A O no hydrogen 3.017 N/A GLN 212.A NE2 TRP 168.A O no hydrogen 3.648 N/A GLN 212.A NE2 PHE 204.A O no hydrogen 2.845 N/A LEU 213.A N HIS 209.A O no hydrogen 3.243 N/A LYS 214.A N ILE 210.A O no hydrogen 2.868 N/A LEU 215.A N ASP 211.A O no hydrogen 2.793 N/A ILE 216.A N GLN 212.A O no hydrogen 2.994 N/A LEU 217.A N LEU 213.A O no hydrogen 3.028 N/A ARG 218.A N LYS 214.A O no hydrogen 3.033 N/A LEU 219.A N LEU 215.A O no hydrogen 3.233 N/A VAL 220.A N ILE 216.A O no hydrogen 2.990 N/A GLY 221.A N LEU 217.A O no hydrogen 2.748 N/A THR 222.A N MET 246.A O no hydrogen 3.134 N/A THR 222.A OG1 GLN 245.A OE1 no hydrogen 2.429 N/A THR 222.A OG1 MET 246.A O no hydrogen 3.436 N/A LEU 228.A N GLY 224.A O no hydrogen 3.028 N/A LYS 229.A N ALA 225.A O no hydrogen 3.051 N/A LYS 230.A N LEU 227.A O no hydrogen 2.857 N/A LYS 230.A NZ ASP 273.A OD1 no hydrogen 3.258 N/A LYS 230.A NZ ASP 273.A OD2 no hydrogen 2.779 N/A LYS 230.A NZ ASP 275.A OD1 no hydrogen 2.772 N/A ILE 231.A N LEU 228.A O no hydrogen 3.271 N/A ALA 236.A N SER 233.A OG no hydrogen 3.301 N/A ARG 237.A N SER 233.A O no hydrogen 2.732 N/A ARG 237.A NH1 LEU 228.A O no hydrogen 2.676 N/A ARG 237.A NH1 ILE 231.A O no hydrogen 3.514 N/A ASN 238.A N GLU 234.A O no hydrogen 2.811 N/A TYR 239.A N SER 235.A O no hydrogen 3.092 N/A ILE 240.A N ALA 236.A O no hydrogen 3.080 N/A GLN 241.A N ARG 237.A O no hydrogen 2.968 N/A SER 242.A N ASN 238.A O no hydrogen 3.103 N/A SER 242.A N TYR 239.A O no hydrogen 3.181 N/A SER 242.A OG ASN 238.A O no hydrogen 2.811 N/A LEU 243.A N ILE 240.A O no hydrogen 2.959 N/A MET 246.A N THR 222.A OG1 no hydrogen 2.947 N/A LYS 248.A NZ MET 249.A O no hydrogen 3.272 N/A LYS 248.A NZ GLU 267.A OE1 no hydrogen 3.239 N/A LYS 248.A NZ GLU 267.A OE2 no hydrogen 2.659 N/A MET 249.A N LEU 219.A O no hydrogen 2.846 N/A PHE 251.A N GLU 267.A OE1 no hydrogen 3.429 N/A ASN 253.A N ASN 250.A O no hydrogen 2.998 N/A VAL 254.A N PHE 251.A O no hydrogen 2.792 N/A PHE 255.A N PHE 251.A O no hydrogen 2.695 N/A ALA 258.A N PHE 255.A O no hydrogen 3.363 N/A ASN 259.A ND2 ASP 118.A OD2 no hydrogen 2.826 N/A LEU 261.A N ASN 259.A OD1 no hydrogen 3.131 N/A ALA 262.A N ASN 259.A O no hydrogen 2.947 N/A VAL 263.A N ASN 259.A O no hydrogen 3.052 N/A ASP 264.A N PRO 260.A O no hydrogen 2.884 N/A LEU 265.A N LEU 261.A O no hydrogen 2.946 N/A LEU 266.A N ALA 262.A O no hydrogen 2.893 N/A GLU 267.A N VAL 263.A O no hydrogen 3.033 N/A LYS 268.A N ASP 264.A O no hydrogen 3.179 N/A LYS 268.A NZ ASP 264.A OD1 no hydrogen 3.085 N/A LYS 268.A NZ ASP 264.A OD2 no hydrogen 3.199 N/A MET 269.A N LEU 265.A O no hydrogen 2.902 N/A MET 269.A N LEU 266.A O no hydrogen 3.089 N/A LEU 270.A N LEU 266.A O no hydrogen 3.045 N/A SER 274.A OG ASN 182.A OD1 no hydrogen 3.268 N/A ASP 275.A N ASP 273.A OD1 no hydrogen 3.031 N/A LYS 276.A N ASP 273.A O no hydrogen 2.988 N/A LYS 276.A NZ GLU 226.A OE2 no hydrogen 3.511 N/A ARG 277.A N SER 274.A O no hydrogen 3.432 N/A ARG 277.A NE VAL 271.A O no hydrogen 2.690 N/A ARG 277.A NH1 GLU 173.A OE1 no hydrogen 2.716 N/A ARG 277.A NH1 THR 184.A O no hydrogen 3.194 N/A ARG 277.A NH2 GLU 173.A OE2 no hydrogen 2.777 N/A ARG 277.A NH2 VAL 271.A O no hydrogen 3.468 N/A ARG 277.A NH2 LEU 272.A O no hydrogen 2.852 N/A ILE 278.A N LYS 268.A O no hydrogen 3.091 N/A THR 279.A N GLN 282.A OE1 no hydrogen 3.105 N/A GLN 282.A N THR 279.A OG1 no hydrogen 3.064 N/A ALA 283.A N THR 279.A O no hydrogen 2.917 N/A LEU 284.A N ALA 280.A O no hydrogen 3.109 N/A ALA 285.A N GLN 282.A O no hydrogen 3.046 N/A HIS 286.A N ALA 283.A O no hydrogen 3.130 N/A HIS 286.A NE2 ASP 264.A OD2 no hydrogen 2.572 N/A TYR 288.A N HIS 286.A ND1 no hydrogen 3.024 N/A TYR 288.A OH ASP 118.A OD1 no hydrogen 2.547 N/A PHE 289.A N HIS 286.A O no hydrogen 3.009 N/A ALA 290.A N ALA 287.A O no hydrogen 3.023 N/A TYR 292.A N PHE 289.A O no hydrogen 2.843 N/A HIS 293.A N PHE 289.A O no hydrogen 2.867 N/A HIS 293.A ND1 GLU 298.A OE1 no hydrogen 2.906 N/A ASP 294.A N GLU 298.A OE1 no hydrogen 3.294 N/A ASP 296.A N ASP 294.A OD1 no hydrogen 2.912 N/A ASP 297.A N ASP 294.A O no hydrogen 2.868 N/A ALA 301.A N SER 137.A OG no hydrogen 2.961 N/A TYR 304.A N ALA 138.A O no hydrogen 3.421 N/A TYR 304.A OH GLU 309.A OE1 no hydrogen 2.855 N/A GLN 306.A NE2 ALA 138.A O no hydrogen 3.619 N/A GLN 306.A NE2 ASP 139.A O no hydrogen 3.139 N/A GLN 306.A NE2 TYR 304.A O no hydrogen 3.270 N/A SER 307.A N ASP 305.A OD1 no hydrogen 2.807 N/A SER 307.A OG ASP 305.A OD1 no hydrogen 2.624 N/A SER 307.A OG ASP 305.A OD2 no hydrogen 3.331 N/A SER 310.A N SER 307.A O no hydrogen 3.177 N/A SER 310.A OG GLN 306.A O no hydrogen 3.064 N/A ARG 311.A NE LEU 308.A O no hydrogen 2.769 N/A ARG 311.A NH2 LEU 308.A O no hydrogen 3.335 N/A LEU 314.A N GLU 317.A OE1 no hydrogen 2.767 N/A GLU 317.A N LEU 314.A O no hydrogen 3.109 N/A TRP 318.A N LEU 314.A O no hydrogen 3.195 N/A LYS 319.A N ILE 315.A O no hydrogen 2.954 N/A LYS 319.A NZ PHE 93.A O no hydrogen 3.235 N/A SER 320.A N ASP 316.A O no hydrogen 2.994 N/A LEU 321.A N GLU 317.A O no hydrogen 2.936 N/A THR 322.A N TRP 318.A O no hydrogen 2.777 N/A THR 322.A OG1 TRP 318.A O no hydrogen 2.708 N/A TYR 323.A N LYS 319.A O no hydrogen 2.781 N/A ASP 324.A N SER 320.A O no hydrogen 3.138 N/A GLU 325.A N LEU 321.A O no hydrogen 3.271 N/A VAL 326.A N THR 322.A O no hydrogen 2.988 N/A ILE 327.A N TYR 323.A O no hydrogen 3.084 N/A ILE 327.A N ASP 324.A O no hydrogen 3.197 N/A SER 328.A N ASP 324.A O no hydrogen 2.961 N/A SER 328.A OG ASP 324.A O no hydrogen 3.001 N/A