Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4acx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N ASP 168.A OD2 no hydrogen 3.496 N/A MET 4.A N PHE 1.A O no hydrogen 3.061 N/A VAL 5.A N VAL 2.A O no hydrogen 3.231 N/A ASP 6.A N SER 161.A OG no hydrogen 2.912 N/A ASN 7.A ND2 HIS 91.A O no hydrogen 2.929 N/A ASN 7.A ND2 MET 162.A O no hydrogen 2.958 N/A LEU 8.A N GLY 160.A O no hydrogen 3.006 N/A ARG 9.A N TYR 17.A O no hydrogen 3.229 N/A ARG 9.A NH1 ASP 6.A OD2 no hydrogen 3.567 N/A ARG 9.A NH2 ASP 6.A OD2 no hydrogen 2.714 N/A GLN 14.A NE2 ASN 113.A O no hydrogen 3.242 N/A GLY 15.A N LYS 11.A O no hydrogen 2.787 N/A TYR 16.A OH CYS 157.A O no hydrogen 2.686 N/A TYR 16.A OH GLU 327.A OE2 no hydrogen 2.565 N/A TYR 17.A N ARG 9.A O no hydrogen 2.935 N/A VAL 18.A N ILE 31.A O no hydrogen 2.818 N/A MET 20.A N LEU 29.A O no hydrogen 2.983 N/A THR 21.A N SER 88.A O no hydrogen 2.906 N/A THR 21.A OG1 SER 88.A OG no hydrogen 2.601 N/A VAL 22.A N GLN 27.A O no hydrogen 2.910 N/A GLY 23.A N LEU 86.A O no hydrogen 2.946 N/A SER 24.A N SER 59.A OG no hydrogen 3.345 N/A GLN 27.A N VAL 22.A O no hydrogen 2.886 N/A GLN 27.A NE2 GLN 55.A O no hydrogen 2.774 N/A LEU 29.A N MET 20.A O no hydrogen 2.964 N/A ASN 30.A N GLU 118.A OE1 no hydrogen 2.808 N/A ASN 30.A ND2 ASN 116.A O no hydrogen 2.953 N/A ILE 31.A N VAL 18.A O no hydrogen 2.806 N/A LEU 32.A N GLY 119.A O no hydrogen 2.838 N/A VAL 33.A N TYR 16.A O no hydrogen 2.790 N/A ASP 34.A N LEU 121.A O no hydrogen 3.150 N/A THR 35.A N SER 217.A OG no hydrogen 2.886 N/A THR 35.A OG1 VAL 215.A O no hydrogen 3.025 N/A GLY 36.A N ASP 34.A OD1 no hydrogen 2.955 N/A SER 37.A OG ASP 34.A OD2 no hydrogen 2.598 N/A SER 38.A OG TYR 125.A O no hydrogen 2.593 N/A ASN 39.A ND2 ARG 130.A O no hydrogen 2.812 N/A ALA 41.A N ILE 120.A O no hydrogen 3.144 N/A VAL 42.A N ALA 102.A O no hydrogen 3.017 N/A GLY 43.A N GLU 118.A O no hydrogen 2.890 N/A ALA 44.A N ILE 104.A O no hydrogen 2.880 N/A PHE 49.A N HIS 47.A ND1 no hydrogen 2.996 N/A LEU 50.A N HIS 47.A O no hydrogen 3.016 N/A ARG 52.A NE GLU 118.A OE1 no hydrogen 3.114 N/A TYR 54.A N GLY 43.A O no hydrogen 2.856 N/A TYR 54.A OH ASP 85.A OD2 no hydrogen 2.449 N/A GLN 55.A N GLN 27.A OE1 no hydrogen 2.786 N/A ARG 56.A NH1 GLU 81.A OE1 no hydrogen 3.027 N/A ARG 56.A NH2 GLU 81.A OE1 no hydrogen 3.449 N/A GLN 57.A N GLN 57.A OE1 no hydrogen 2.807 N/A LEU 58.A N GLN 55.A O no hydrogen 3.231 N/A SER 59.A N ARG 56.A O no hydrogen 3.218 N/A SER 59.A OG THR 61.A OG1 no hydrogen 3.298 N/A SER 59.A OG ASP 85.A OD1 no hydrogen 3.147 N/A SER 59.A OG ASP 85.A OD2 no hydrogen 2.646 N/A SER 60.A N SER 24.A O no hydrogen 3.007 N/A SER 60.A OG SER 24.A O no hydrogen 3.265 N/A THR 61.A OG1 SER 59.A OG no hydrogen 3.298 N/A THR 61.A OG1 ASP 85.A OD1 no hydrogen 2.621 N/A ARG 63.A N THR 84.A O no hydrogen 2.893 N/A ARG 63.A NE ASP 64.A O no hydrogen 2.775 N/A LEU 65.A N LEU 82.A O no hydrogen 3.089 N/A ARG 66.A N ASP 64.A OD1 no hydrogen 3.051 N/A VAL 69.A N GLY 80.A O no hydrogen 2.885 N/A VAL 71.A N TRP 78.A O no hydrogen 2.753 N/A TYR 73.A N GLY 76.A O no hydrogen 3.019 N/A LYS 77.A N ASP 108.A O no hydrogen 2.742 N/A TRP 78.A N VAL 71.A O no hydrogen 3.354 N/A GLU 79.A N GLU 106.A O no hydrogen 2.847 N/A GLY 80.A N VAL 69.A O no hydrogen 2.802 N/A GLU 81.A N ALA 103.A O no hydrogen 3.038 N/A LEU 82.A N LYS 67.A O no hydrogen 2.848 N/A GLY 83.A N ILE 101.A O no hydrogen 2.961 N/A THR 84.A N ARG 63.A O no hydrogen 2.865 N/A ASP 85.A N ALA 99.A O no hydrogen 3.190 N/A LEU 86.A N ASP 85.A OD1 no hydrogen 2.794 N/A VAL 87.A N VAL 97.A O no hydrogen 2.704 N/A SER 88.A N THR 21.A O no hydrogen 3.125 N/A SER 88.A OG THR 21.A OG1 no hydrogen 2.601 N/A GLY 92.A N ILE 89.A O no hydrogen 3.022 N/A VAL 95.A N PRO 93.A O no hydrogen 2.811 N/A VAL 97.A N VAL 87.A O no hydrogen 3.007 N/A ARG 98.A N GLN 145.A OE1 no hydrogen 2.932 N/A ARG 98.A NH1 THR 61.A O no hydrogen 2.844 N/A ARG 98.A NH1 THR 84.A OG1 no hydrogen 3.345 N/A ARG 98.A NH2 THR 61.A O no hydrogen 2.855 N/A ALA 99.A N ASP 85.A O no hydrogen 3.067 N/A ASN 100.A ND2 GLU 136.A O no hydrogen 3.105 N/A ILE 101.A N GLY 83.A O no hydrogen 2.743 N/A ALA 102.A N PHE 40.A O no hydrogen 3.017 N/A ALA 103.A N GLU 81.A O no hydrogen 2.807 N/A ILE 104.A N VAL 42.A O no hydrogen 2.862 N/A THR 105.A N GLU 79.A O no hydrogen 3.070 N/A THR 105.A OG1 GLU 79.A O no hydrogen 3.217 N/A GLU 106.A N GLU 79.A O no hydrogen 3.222 N/A ASP 108.A N LYS 77.A O no hydrogen 2.762 N/A SER 115.A N ILE 112.A O no hydrogen 3.297 N/A SER 115.A OG ILE 112.A O no hydrogen 3.011 N/A ASN 116.A ND2 TYR 17.A OH no hydrogen 3.084 N/A TRP 117.A N SER 115.A OG no hydrogen 3.353 N/A TRP 117.A NE1 GLN 14.A O no hydrogen 2.858 N/A GLU 118.A N ASN 30.A O no hydrogen 2.789 N/A ILE 120.A N ALA 41.A O no hydrogen 2.786 N/A LEU 121.A N LEU 32.A O no hydrogen 2.757 N/A GLY 122.A N ASN 39.A O no hydrogen 2.948 N/A LEU 123.A N ASP 34.A O no hydrogen 2.792 N/A ALA 124.A N SER 37.A O no hydrogen 2.802 N/A TYR 125.A N TRP 185.A O no hydrogen 2.992 N/A ILE 128.A N TYR 125.A O no hydrogen 3.280 N/A ALA 129.A N ALA 126.A O no hydrogen 2.871 N/A ARG 130.A N ASN 39.A OD1 no hydrogen 2.797 N/A SER 134.A N ASP 132.A OD1 no hydrogen 3.155 N/A SER 134.A OG ASP 132.A OD1 no hydrogen 2.574 N/A LEU 135.A N ASP 132.A O no hydrogen 3.347 N/A SER 141.A N PRO 137.A O no hydrogen 3.218 N/A SER 141.A OG GLU 136.A OE2 no hydrogen 2.622 N/A SER 141.A OG PRO 137.A O no hydrogen 3.439 N/A LEU 142.A N PHE 138.A O no hydrogen 2.907 N/A VAL 143.A N PHE 139.A O no hydrogen 3.013 N/A LYS 144.A N ASP 140.A O no hydrogen 2.992 N/A LYS 144.A NZ GLU 136.A OE1 no hydrogen 2.761 N/A GLN 145.A N SER 141.A O no hydrogen 2.990 N/A GLN 145.A NE2 ARG 98.A O no hydrogen 2.956 N/A THR 146.A N LEU 142.A O no hydrogen 3.039 N/A THR 146.A OG1 LEU 142.A O no hydrogen 2.547 N/A VAL 148.A N THR 146.A OG1 no hydrogen 3.424 N/A LEU 151.A N PRO 149.A O no hydrogen 2.768 N/A PHE 152.A N PHE 333.A O no hydrogen 3.372 N/A SER 153.A N ILE 163.A O no hydrogen 2.929 N/A SER 153.A OG ILE 163.A O no hydrogen 3.439 N/A SER 153.A OG GLY 166.A O no hydrogen 3.083 N/A SER 153.A OG TYR 330.A OH no hydrogen 2.623 N/A LEU 154.A N VAL 331.A O no hydrogen 2.763 N/A GLN 155.A N SER 161.A O no hydrogen 2.827 N/A GLN 155.A NE2 LEU 171.A O no hydrogen 3.332 N/A GLN 155.A NE2 SER 345.A OG no hydrogen 3.195 N/A CYS 157.A N GLY 159.A O no hydrogen 2.963 N/A GLY 160.A N LEU 8.A O no hydrogen 3.138 N/A SER 161.A N GLN 155.A O no hydrogen 2.824 N/A SER 161.A OG GLN 155.A OE1 no hydrogen 3.537 N/A MET 162.A N ASN 7.A OD1 no hydrogen 2.776 N/A ILE 163.A N SER 153.A O no hydrogen 3.025 N/A GLY 165.A N LEU 151.A O no hydrogen 2.700 N/A ASP 168.A N TYR 330.A OH no hydrogen 2.911 N/A SER 170.A N ASP 168.A OD1 no hydrogen 3.266 N/A SER 170.A OG ASP 168.A OD1 no hydrogen 3.364 N/A LEU 171.A N ASP 168.A O no hydrogen 3.095 N/A THR 173.A N VAL 344.A O no hydrogen 2.865 N/A THR 173.A OG1 VAL 344.A O no hydrogen 3.517 N/A TRP 177.A N PHE 342.A O no hydrogen 2.905 N/A THR 179.A N ILE 340.A O no hydrogen 2.822 N/A THR 179.A OG1 MET 276.A O no hydrogen 2.693 N/A ILE 181.A N LYS 338.A O no hydrogen 2.987 N/A ARG 182.A N GLU 188.A O no hydrogen 2.861 N/A ARG 182.A NH1 GLU 188.A OE2 no hydrogen 3.287 N/A ARG 182.A NH1 TYR 370.A O no hydrogen 2.834 N/A ARG 182.A NH2 TYR 370.A O no hydrogen 3.154 N/A ARG 183.A NH1 GLU 127.A OE2 no hydrogen 2.805 N/A TRP 185.A N ARG 183.A O no hydrogen 3.148 N/A TRP 185.A N TYR 186.A O no hydrogen 3.319 N/A TRP 185.A NE1 GLU 188.A OE1 no hydrogen 2.777 N/A TYR 187.A OH LEU 123.A O no hydrogen 2.727 N/A GLU 188.A N TYR 186.A O no hydrogen 2.856 N/A VAL 189.A N SER 213.A O no hydrogen 2.735 N/A ILE 191.A N ASN 209.A OD1 no hydrogen 2.758 N/A VAL 192.A N TYR 274.A O no hydrogen 2.820 N/A GLU 195.A N SER 272.A O no hydrogen 2.948 N/A ILE 196.A N GLN 199.A O no hydrogen 2.894 N/A ASN 197.A N VAL 270.A O no hydrogen 2.921 N/A GLN 199.A N ILE 196.A O no hydrogen 3.004 N/A GLN 199.A NE2 ASN 197.A O no hydrogen 3.433 N/A LEU 201.A N VAL 194.A O no hydrogen 3.026 N/A LYS 202.A N ASP 200.A OD1 no hydrogen 2.941 N/A LYS 206.A N ASP 204.A OD1 no hydrogen 3.236 N/A LYS 206.A NZ ASP 367.A O no hydrogen 2.756 N/A GLU 207.A N ASP 204.A O no hydrogen 2.958 N/A TYR 208.A N CYS 205.A O no hydrogen 3.337 N/A ASN 209.A N LYS 206.A O no hydrogen 2.899 N/A ASN 209.A ND2 ILE 191.A O no hydrogen 2.796 N/A ASN 209.A ND2 CYS 368.A O no hydrogen 2.759 N/A LYS 212.A NZ THR 317.A O no hydrogen 2.865 N/A SER 213.A OG ASN 209.A OD1 no hydrogen 2.723 N/A ILE 214.A N THR 319.A O no hydrogen 2.948 N/A VAL 215.A N TYR 187.A O no hydrogen 3.065 N/A ASP 216.A N MET 321.A O no hydrogen 3.056 N/A SER 217.A N THR 35.A OG1 no hydrogen 3.008 N/A SER 217.A OG VAL 33.A O no hydrogen 2.772 N/A GLY 218.A N ASP 216.A OD1 no hydrogen 2.800 N/A THR 219.A N ASP 216.A O no hydrogen 3.421 N/A THR 219.A OG1 ASP 216.A OD2 no hydrogen 2.668 N/A THR 220.A OG1 SER 12.A O no hydrogen 2.641 N/A THR 220.A OG1 GLY 13.A O no hydrogen 3.533 N/A ASN 221.A ND2 SER 313.A OG no hydrogen 2.956 N/A LEU 222.A N ALA 311.A O no hydrogen 2.926 N/A ARG 223.A N VAL 320.A O no hydrogen 2.818 N/A LEU 224.A N SER 313.A O no hydrogen 2.980 N/A LYS 226.A NZ GLU 230.A OE1 no hydrogen 3.545 N/A LYS 226.A NZ GLU 230.A OE2 no hydrogen 2.800 N/A PHE 229.A N PRO 225.A O no hydrogen 2.866 N/A GLU 230.A N LYS 226.A O no hydrogen 3.054 N/A ALA 231.A N LYS 227.A O no hydrogen 3.396 N/A ALA 232.A N VAL 228.A O no hydrogen 2.966 N/A VAL 233.A N PHE 229.A O no hydrogen 2.899 N/A LYS 234.A N GLU 230.A O no hydrogen 3.036 N/A SER 235.A N ALA 231.A O no hydrogen 3.117 N/A ILE 236.A N ALA 232.A O no hydrogen 2.932 N/A LYS 237.A N VAL 233.A O no hydrogen 2.820 N/A ALA 238.A N LYS 234.A O no hydrogen 3.102 N/A ALA 239.A N SER 235.A O no hydrogen 3.165 N/A SER 240.A N ILE 236.A O no hydrogen 2.997 N/A SER 240.A OG ILE 236.A O no hydrogen 2.753 N/A SER 241.A OG ALA 238.A O no hydrogen 3.006 N/A GLU 243.A N SER 240.A O no hydrogen 3.324 N/A PHE 249.A N PRO 246.A O no hydrogen 2.982 N/A LEU 251.A N ASP 247.A O no hydrogen 3.093 N/A GLY 252.A N PHE 249.A O no hydrogen 3.097 N/A GLU 253.A N GLY 248.A O no hydrogen 2.884 N/A GLN 254.A N GLY 248.A O no hydrogen 3.195 N/A VAL 256.A N TYR 308.A O no hydrogen 2.963 N/A TRP 258.A N ASP 306.A O no hydrogen 3.303 N/A TRP 258.A NE1 GLU 243.A OE1 no hydrogen 2.816 N/A ALA 260.A N GLN 304.A O no hydrogen 3.295 N/A GLY 261.A N ASP 306.A OD2 no hydrogen 2.903 N/A THR 262.A N GLN 259.A O no hydrogen 2.983 N/A THR 262.A OG1 GLN 259.A O no hydrogen 2.575 N/A THR 263.A OG1 TYR 308.A OH no hydrogen 2.898 N/A TRP 265.A N THR 263.A O no hydrogen 2.936 N/A ILE 267.A N PRO 264.A O no hydrogen 3.040 N/A VAL 270.A N ASN 197.A OD1 no hydrogen 3.197 N/A ILE 271.A N ILE 288.A O no hydrogen 2.846 N/A SER 272.A N GLU 195.A O no hydrogen 2.948 N/A LEU 273.A N ILE 286.A O no hydrogen 3.003 N/A TYR 274.A N ARG 193.A O no hydrogen 2.706 N/A TYR 274.A OH GLU 195.A OE1 no hydrogen 2.782 N/A TYR 274.A OH GLU 195.A OE2 no hydrogen 3.228 N/A LEU 275.A N PHE 284.A O no hydrogen 2.862 N/A MET 276.A N ILE 190.A O no hydrogen 2.857 N/A GLY 277.A N GLN 282.A O no hydrogen 2.886 N/A GLN 282.A N VAL 279.A O no hydrogen 3.204 N/A SER 283.A N PHE 362.A O no hydrogen 2.881 N/A SER 283.A OG PHE 362.A O no hydrogen 3.393 N/A PHE 284.A N LEU 275.A O no hydrogen 3.323 N/A ARG 285.A N GLU 359.A O no hydrogen 2.757 N/A ARG 285.A NE GLU 359.A OE1 no hydrogen 2.803 N/A ARG 285.A NH1 TYR 274.A OH no hydrogen 2.858 N/A ARG 285.A NH2 GLU 359.A OE1 no hydrogen 2.967 N/A ILE 286.A N LEU 273.A O no hydrogen 2.989 N/A THR 287.A N ALA 357.A O no hydrogen 2.877 N/A ILE 288.A N ILE 271.A O no hydrogen 2.723 N/A LEU 289.A N GLN 292.A OE1 no hydrogen 2.957 N/A GLN 291.A N GLN 291.A OE1 no hydrogen 3.080 N/A GLN 291.A NE2 ASP 351.A OD2 no hydrogen 2.922 N/A GLN 292.A N LEU 289.A O no hydrogen 2.952 N/A GLN 292.A NE2 GLU 327.A O no hydrogen 2.759 N/A TYR 293.A N LEU 289.A O no hydrogen 3.467 N/A TYR 293.A OH PRO 269.A O no hydrogen 2.569 N/A LEU 294.A N PRO 290.A O no hydrogen 2.766 N/A ARG 295.A N LYS 309.A O no hydrogen 2.965 N/A VAL 297.A N CYS 307.A O no hydrogen 2.862 N/A GLU 298.A N GLU 298.A OE1 no hydrogen 2.954 N/A ALA 301.A N ASP 299.A OD1 no hydrogen 3.179 N/A THR 302.A N ASP 299.A O no hydrogen 3.242 N/A THR 302.A OG1 ASP 299.A O no hydrogen 3.335 N/A SER 303.A N VAL 300.A O no hydrogen 3.194 N/A SER 303.A OG VAL 300.A O no hydrogen 2.500 N/A ASP 305.A N THR 302.A O no hydrogen 3.001 N/A ASP 306.A N TRP 258.A O no hydrogen 2.926 N/A TYR 308.A N VAL 256.A O no hydrogen 2.855 N/A TYR 308.A OH THR 263.A OG1 no hydrogen 2.898 N/A LYS 309.A N ARG 295.A O no hydrogen 2.905 N/A ALA 311.A N TYR 293.A O no hydrogen 2.674 N/A SER 313.A N LEU 222.A O no hydrogen 3.072 N/A SER 315.A N LEU 224.A O no hydrogen 2.891 N/A SER 315.A OG GLY 318.A O no hydrogen 2.669 N/A THR 317.A N SER 315.A OG no hydrogen 3.127 N/A THR 319.A N LYS 212.A O no hydrogen 2.905 N/A THR 319.A OG1 TYR 208.A O no hydrogen 2.661 N/A VAL 320.A N ARG 223.A O no hydrogen 2.833 N/A MET 321.A N ILE 214.A O no hydrogen 2.829 N/A ALA 323.A N THR 219.A O no hydrogen 2.763 N/A VAL 324.A N THR 220.A O no hydrogen 2.986 N/A ILE 325.A N GLY 322.A O no hydrogen 3.014 N/A MET 326.A N GLY 322.A O no hydrogen 3.116 N/A GLU 327.A N ALA 323.A O no hydrogen 2.915 N/A GLY 328.A N LEU 156.A O no hydrogen 3.464 N/A PHE 329.A N MET 326.A O no hydrogen 3.150 N/A TYR 330.A N ALA 343.A O no hydrogen 2.767 N/A VAL 331.A N LEU 154.A O no hydrogen 2.910 N/A VAL 332.A N GLY 341.A O no hydrogen 2.843 N/A PHE 333.A N PHE 152.A O no hydrogen 2.706 N/A ARG 335.A NE ASN 150.A OD1 no hydrogen 2.856 N/A ARG 335.A NH1 TYR 187.A OH no hydrogen 2.996 N/A ARG 335.A NH2 ASP 140.A OD1 no hydrogen 3.276 N/A ALA 336.A N ASN 150.A O no hydrogen 2.987 N/A ARG 337.A N ASP 334.A OD1 no hydrogen 3.029 N/A LYS 338.A N ARG 335.A O no hydrogen 3.221 N/A ARG 339.A N ASP 334.A O no hydrogen 3.051 N/A ARG 339.A NE ASP 334.A OD2 no hydrogen 3.052 N/A ARG 339.A NH1 GLU 278.A OE2 no hydrogen 2.747 N/A ARG 339.A NH2 ASP 334.A OD2 no hydrogen 3.514 N/A ILE 340.A N THR 179.A O no hydrogen 2.800 N/A GLY 341.A N VAL 332.A O no hydrogen 2.787 N/A PHE 342.A N TRP 177.A O no hydrogen 2.833 N/A ALA 343.A N TYR 330.A O no hydrogen 3.207 N/A ALA 346.A N LEU 171.A O no hydrogen 3.063 N/A CYS 347.A N SER 345.A OG no hydrogen 3.240 N/A CYS 347.A SG LEU 156.A O no hydrogen 3.974 N/A CYS 347.A SG SER 345.A OG no hydrogen 3.248 N/A HIS 348.A N SER 345.A O no hydrogen 3.154 N/A ASP 351.A N ARG 354.A O no hydrogen 3.125 N/A GLU 352.A N GLU 352.A OE1 no hydrogen 2.709 N/A PHE 353.A N ASP 351.A OD1 no hydrogen 3.107 N/A ARG 354.A N ASP 351.A OD1 no hydrogen 2.767 N/A ARG 354.A NH1 PHE 268.A O no hydrogen 2.987 N/A ARG 354.A NH2 PHE 268.A O no hydrogen 3.055 N/A ALA 356.A N VAL 349.A O no hydrogen 3.378 N/A ALA 357.A N THR 287.A OG1 no hydrogen 2.726 N/A GLU 359.A N ARG 285.A O no hydrogen 3.038 N/A PHE 362.A N SER 283.A O no hydrogen 2.852 N/A THR 364.A N ASN 281.A O no hydrogen 3.180 N/A CYS 368.A SG GLU 366.A O no hydrogen 4.009 N/A