Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2whx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N GLY 19.A O no hydrogen 2.806 N/A ARG 4.A NH1 GLN 15.A OE1 no hydrogen 2.808 N/A ARG 4.A NH1 GLU 79.A O no hydrogen 3.051 N/A ARG 4.A NH2 LYS 82.A O no hydrogen 2.765 N/A ILE 5.A N GLY 17.A O no hydrogen 3.199 N/A GLN 7.A N THR 14.A O no hydrogen 2.705 N/A GLY 9.A N GLY 12.A O no hydrogen 3.108 N/A THR 14.A N GLN 7.A O no hydrogen 3.169 N/A GLN 15.A NE2 GLY 17.A O no hydrogen 3.491 N/A GLN 15.A NE2 ILE 78.A O no hydrogen 2.850 N/A GLN 15.A NE2 GLY 106.A O no hydrogen 2.735 N/A VAL 16.A N ILE 5.A O no hydrogen 2.967 N/A VAL 18.A N SER 108.A O no hydrogen 2.853 N/A GLY 19.A N TYR 3.A O no hydrogen 2.893 N/A ILE 20.A N HIS 27.A O no hydrogen 2.711 N/A HIS 21.A N GLY 1.A O no hydrogen 2.759 N/A PHE 26.A N TYR 57.A O no hydrogen 2.804 N/A HIS 27.A N ILE 20.A O no hydrogen 2.732 N/A THR 28.A N ILE 55.A O no hydrogen 3.136 N/A THR 28.A OG1 VAL 18.A O no hydrogen 2.860 N/A MET 29.A N THR 28.A OG1 no hydrogen 2.680 N/A HIS 31.A N ASP 53.A OD1 no hydrogen 2.798 N/A HIS 31.A ND1 ASP 53.A OD2 no hydrogen 2.850 N/A VAL 32.A N MET 29.A O no hydrogen 3.156 N/A THR 33.A N TRP 30.A O no hydrogen 3.214 N/A THR 33.A OG1 TYR 57.A OH no hydrogen 2.751 N/A ARG 34.A N TRP 30.A O no hydrogen 2.789 N/A GLY 35.A N THR 33.A OG1 no hydrogen 3.340 N/A SER 36.A N THR 33.A O no hydrogen 3.239 N/A SER 36.A OG THR 33.A O no hydrogen 3.132 N/A LEU 43.A N ILE 38.A O no hydrogen 2.738 N/A SER 46.A N SER 56.A O no hydrogen 3.208 N/A SER 46.A OG GLY 59.A O no hydrogen 3.272 N/A ASP 49.A N MET 54.A O no hydrogen 2.628 N/A MET 54.A N ASP 49.A O no hydrogen 2.838 N/A ILE 55.A N THR 28.A O no hydrogen 3.026 N/A SER 56.A N TRP 47.A O no hydrogen 2.829 N/A SER 56.A OG TRP 47.A O no hydrogen 3.471 N/A SER 56.A OG GLY 59.A O no hydrogen 3.405 N/A TYR 57.A N PHE 26.A O no hydrogen 2.755 N/A TYR 57.A OH THR 33.A OG1 no hydrogen 2.751 N/A TYR 57.A OH SER 36.A O no hydrogen 2.940 N/A TRP 61.A N GLY 136.A O no hydrogen 3.139 N/A TRP 61.A NE1 GLN 131.A OE1 no hydrogen 2.744 N/A TRP 67.A NE1 GLU 71.A O no hydrogen 2.914 N/A GLU 70.A N ASP 68.A OD2 no hydrogen 3.304 N/A GLU 71.A N ASP 68.A OD2 no hydrogen 3.160 N/A VAL 73.A N THR 89.A O no hydrogen 3.064 N/A GLN 74.A N ILE 113.A O no hydrogen 3.117 N/A GLN 74.A NE2 GLN 88.A OE1 no hydrogen 3.052 N/A VAL 75.A N VAL 87.A O no hydrogen 2.935 N/A LEU 76.A N PRO 111.A O no hydrogen 2.778 N/A ALA 77.A N LYS 85.A O no hydrogen 3.036 N/A ILE 78.A N SER 110.A OG no hydrogen 2.979 N/A LYS 82.A N GLU 79.A O no hydrogen 3.178 N/A LYS 85.A N ALA 77.A O no hydrogen 3.195 N/A VAL 87.A N VAL 75.A O no hydrogen 3.027 N/A GLN 88.A NE2 ASP 72.A OD2 no hydrogen 3.084 N/A THR 89.A N VAL 73.A O no hydrogen 3.013 N/A GLY 92.A N ALA 98.A O no hydrogen 3.107 N/A PHE 94.A N ILE 96.A O no hydrogen 3.387 N/A ALA 98.A N GLY 92.A O no hydrogen 3.265 N/A VAL 99.A N SER 127.A O no hydrogen 2.797 N/A PHE 103.A N TYR 123.A OH no hydrogen 2.672 N/A THR 107.A OG1 LYS 104.A O no hydrogen 2.695 N/A GLY 109.A N TYR 123.A O no hydrogen 2.810 N/A SER 110.A N THR 107.A O no hydrogen 3.151 N/A SER 110.A OG THR 107.A O no hydrogen 2.981 N/A ILE 112.A N GLY 121.A O no hydrogen 2.790 N/A ILE 113.A N GLN 74.A O no hydrogen 2.608 N/A ASN 114.A N LYS 118.A O no hydrogen 2.450 N/A ILE 120.A N ILE 112.A O no hydrogen 2.808 N/A LEU 122.A N THR 130.A O no hydrogen 2.945 N/A TYR 123.A N SER 110.A O no hydrogen 2.658 N/A TYR 123.A OH PHE 103.A O no hydrogen 2.903 N/A ASN 125.A ND2 ASP 53.A OD2 no hydrogen 3.548 N/A SER 127.A N VAL 99.A O no hydrogen 3.268 N/A ILE 129.A N GLY 97.A O no hydrogen 2.819 N/A THR 130.A N LEU 122.A O no hydrogen 3.248 N/A GLN 131.A NE2 LEU 63.A O no hydrogen 3.247 N/A GLN 131.A NE2 ASP 65.A O no hydrogen 2.684 N/A ALA 132.A N GLN 131.A OE1 no hydrogen 2.928 N/A GLU 137.A N PRO 138.A O no hydrogen 3.063 N/A ILE 146.A N ASP 143.A O no hydrogen 3.208 N/A PHE 147.A N GLU 144.A O no hydrogen 3.291 N/A LYS 150.A N ALA 273.A O no hydrogen 3.036 N/A LYS 150.A NZ GLU 269.A OE2 no hydrogen 3.458 N/A ARG 151.A N ARG 148.A O no hydrogen 3.280 N/A THR 153.A N ALA 275.A O no hydrogen 2.845 N/A MET 155.A N PHE 277.A O no hydrogen 2.806 N/A ALA 161.A N HIS 158.A O no hydrogen 3.106 N/A LYS 163.A NZ LEU 157.A O no hydrogen 2.946 N/A LYS 163.A NZ HIS 158.A O no hydrogen 3.295 N/A THR 164.A OG1 ASP 248.A OD1 no hydrogen 2.478 N/A THR 164.A OG1 ASP 248.A OD2 no hydrogen 3.221 N/A THR 164.A OG1 GLU 249.A OE2 no hydrogen 3.020 N/A ARG 166.A N GLY 162.A O no hydrogen 2.884 N/A ILE 167.A N GLY 162.A O no hydrogen 3.045 N/A LEU 168.A N LYS 163.A O no hydrogen 2.917 N/A ILE 171.A N ILE 167.A O no hydrogen 2.971 N/A VAL 172.A N LEU 168.A O no hydrogen 2.989 N/A ARG 173.A N PRO 169.A O no hydrogen 2.801 N/A GLU 174.A N SER 170.A O no hydrogen 2.913 N/A ALA 175.A N ILE 171.A O no hydrogen 2.718 N/A LEU 176.A N VAL 172.A O no hydrogen 2.928 N/A LYS 177.A N ARG 173.A O no hydrogen 3.346 N/A ARG 178.A N GLU 174.A O no hydrogen 3.160 N/A ARG 179.A N LEU 176.A O no hydrogen 3.351 N/A LEU 180.A N ALA 175.A O no hydrogen 2.994 N/A ARG 181.A NH1 ASN 241.A O no hydrogen 2.653 N/A THR 182.A OG1 LEU 180.A O no hydrogen 3.348 N/A LEU 183.A N LEU 244.A O no hydrogen 2.901 N/A ILE 184.A N ASP 222.A O no hydrogen 2.779 N/A LEU 185.A N VAL 246.A O no hydrogen 2.696 N/A ALA 186.A N MET 224.A O no hydrogen 2.853 N/A ALA 192.A N THR 188.A O no hydrogen 2.925 N/A ALA 193.A N ARG 189.A O no hydrogen 2.693 N/A GLU 194.A N VAL 190.A O no hydrogen 2.921 N/A MET 195.A N VAL 191.A O no hydrogen 2.908 N/A GLU 196.A N ALA 192.A O no hydrogen 2.821 N/A GLU 197.A N GLU 194.A O no hydrogen 3.157 N/A ALA 198.A N GLU 194.A O no hydrogen 3.308 N/A LEU 199.A N MET 195.A O no hydrogen 3.057 N/A LEU 202.A N LEU 199.A O no hydrogen 3.303 N/A ARG 205.A N VAL 221.A O no hydrogen 2.701 N/A ARG 205.A NE ASP 214.A OD1 no hydrogen 2.986 N/A GLN 207.A N LEU 223.A O no hydrogen 2.727 N/A GLN 207.A NE2 ASP 214.A OD1 no hydrogen 2.821 N/A GLN 207.A NE2 ASP 222.A OD2 no hydrogen 3.029 N/A VAL 211.A N THR 208.A O no hydrogen 3.338 N/A ARG 218.A N THR 216.A OG1 no hydrogen 3.059 N/A VAL 221.A N PRO 203.A O no hydrogen 2.949 N/A ASP 222.A N THR 182.A O no hydrogen 3.148 N/A LEU 223.A N ARG 205.A O no hydrogen 2.852 N/A MET 224.A N ILE 184.A O no hydrogen 3.078 N/A CYS 225.A SG TYR 206.A OH no hydrogen 3.661 N/A HIS 226.A N ALA 186.A O no hydrogen 2.784 N/A HIS 226.A ND1 SER 257.A OG no hydrogen 3.153 N/A HIS 226.A NE2 ASP 248.A O no hydrogen 2.826 N/A THR 228.A N CYS 225.A O no hydrogen 3.124 N/A PHE 229.A N CYS 225.A O no hydrogen 3.328 N/A THR 230.A N HIS 226.A O no hydrogen 3.369 N/A THR 230.A OG1 CYS 256.A O no hydrogen 2.820 N/A THR 231.A N ALA 227.A O no hydrogen 3.008 N/A THR 231.A OG1 ALA 227.A O no hydrogen 3.304 N/A ARG 232.A N THR 228.A O no hydrogen 2.998 N/A ARG 232.A NE VAL 211.A O no hydrogen 2.860 N/A ARG 232.A NH1 GLN 207.A OE1 no hydrogen 3.381 N/A ARG 232.A NH2 GLN 207.A OE1 no hydrogen 2.842 N/A ARG 232.A NH2 THR 208.A O no hydrogen 3.159 N/A LEU 233.A N PHE 229.A O no hydrogen 3.100 N/A LEU 234.A N THR 230.A O no hydrogen 3.125 N/A SER 235.A OG THR 231.A O no hydrogen 2.610 N/A SER 236.A N ARG 232.A O no hydrogen 2.752 N/A SER 236.A OG ARG 238.A O no hydrogen 3.483 N/A ARG 238.A N SER 236.A OG no hydrogen 2.993 N/A TYR 242.A N PRO 240.A O no hydrogen 2.860 N/A TYR 242.A OH ASP 222.A OD1 no hydrogen 2.523 N/A LEU 244.A N ARG 181.A O no hydrogen 3.411 N/A ILE 245.A N ALA 274.A O no hydrogen 3.058 N/A VAL 246.A N LEU 183.A O no hydrogen 2.759 N/A MET 247.A N ILE 276.A O no hydrogen 2.875 N/A ASP 248.A N LEU 185.A O no hydrogen 2.819 N/A GLU 249.A N ASP 248.A OD2 no hydrogen 2.822 N/A ALA 250.A N MET 278.A O no hydrogen 3.006 N/A HIS 251.A NE2 GLU 249.A OE1 no hydrogen 3.265 N/A PHE 252.A N GLU 249.A O no hydrogen 3.352 N/A SER 257.A N ASP 254.A O no hydrogen 2.774 N/A SER 257.A OG HIS 226.A ND1 no hydrogen 3.153 N/A SER 257.A OG ASP 254.A O no hydrogen 3.541 N/A VAL 258.A N ASP 254.A O no hydrogen 3.101 N/A ALA 259.A N PRO 255.A O no hydrogen 2.823 N/A ALA 260.A N CYS 256.A O no hydrogen 3.070 N/A ARG 261.A N SER 257.A O no hydrogen 3.049 N/A ARG 261.A NE GLU 476.A OE1 no hydrogen 3.432 N/A ARG 261.A NE GLU 476.A OE2 no hydrogen 2.839 N/A ARG 261.A NH1 PHE 252.A O no hydrogen 2.844 N/A ARG 261.A NH2 PHE 252.A O no hydrogen 2.820 N/A ARG 261.A NH2 GLU 476.A OE1 no hydrogen 2.763 N/A GLY 262.A N VAL 258.A O no hydrogen 3.180 N/A TYR 263.A N ALA 259.A O no hydrogen 2.982 N/A ILE 264.A N ALA 260.A O no hydrogen 2.860 N/A SER 265.A N ARG 261.A O no hydrogen 2.856 N/A THR 266.A N GLY 262.A O no hydrogen 2.922 N/A THR 266.A OG1 GLY 262.A O no hydrogen 2.767 N/A ARG 267.A N TYR 263.A O no hydrogen 2.883 N/A ARG 267.A NH1 ASN 241.A OD1 no hydrogen 2.774 N/A VAL 268.A N ILE 264.A O no hydrogen 2.898 N/A GLU 269.A N SER 265.A O no hydrogen 2.929 N/A MET 270.A N THR 266.A O no hydrogen 2.882 N/A GLY 271.A N VAL 268.A O no hydrogen 2.992 N/A GLU 272.A N ARG 267.A O no hydrogen 3.213 N/A ALA 274.A N ASN 243.A O no hydrogen 2.800 N/A ALA 275.A N ARG 151.A O no hydrogen 2.988 N/A ILE 276.A N ILE 245.A O no hydrogen 2.884 N/A PHE 277.A N THR 153.A O no hydrogen 2.852 N/A MET 278.A N MET 247.A O no hydrogen 2.872 N/A THR 279.A N MET 155.A O no hydrogen 3.078 N/A THR 281.A N THR 279.A OG1 no hydrogen 2.925 N/A THR 281.A OG1 THR 279.A OG1 no hydrogen 3.324 N/A THR 281.A OG1 GLN 420.A OE1 no hydrogen 2.843 N/A SER 285.A N PRO 282.A O no hydrogen 3.100 N/A SER 285.A OG PRO 282.A O no hydrogen 2.962 N/A PHE 289.A N ASP 287.A OD2 no hydrogen 3.072 N/A SER 292.A OG SER 294.A O no hydrogen 2.567 N/A ASN 293.A ND2 GLY 160.A O no hydrogen 3.303 N/A SER 294.A N GLY 426.A O no hydrogen 2.822 N/A SER 294.A OG ASN 428.A O no hydrogen 2.563 N/A SER 294.A OG GLN 431.A O no hydrogen 3.476 N/A GLU 297.A N ASP 434.A O no hydrogen 3.024 N/A ILE 299.A N TYR 436.A O no hydrogen 2.699 N/A ARG 301.A N PHE 438.A O no hydrogen 3.095 N/A ILE 315.A N PHE 312.A O no hydrogen 2.955 N/A ASP 317.A N ASP 313.A O no hydrogen 2.838 N/A LYS 321.A NZ ASP 365.A OD1 no hydrogen 2.772 N/A THR 322.A N ASP 367.A O no hydrogen 2.997 N/A VAL 323.A N ARG 385.A O no hydrogen 2.810 N/A TRP 324.A N VAL 369.A O no hydrogen 2.734 N/A PHE 325.A N ILE 387.A O no hydrogen 3.011 N/A VAL 326.A N THR 371.A O no hydrogen 2.750 N/A LYS 330.A NZ ASP 334.A OD1 no hydrogen 2.771 N/A LYS 330.A NZ ASP 334.A OD2 no hydrogen 3.432 N/A ALA 331.A N SER 328.A OG no hydrogen 3.085 N/A GLY 332.A N SER 328.A O no hydrogen 2.901 N/A ASN 333.A N ILE 329.A O no hydrogen 2.719 N/A ASP 334.A N LYS 330.A O no hydrogen 3.134 N/A ILE 335.A N ALA 331.A O no hydrogen 3.029 N/A ALA 336.A N GLY 332.A O no hydrogen 2.866 N/A ASN 337.A N ASN 333.A O no hydrogen 3.096 N/A CYS 338.A N ASP 334.A O no hydrogen 3.158 N/A CYS 338.A SG TRP 308.A O no hydrogen 3.501 N/A LEU 339.A N ILE 335.A O no hydrogen 2.973 N/A ARG 340.A N ALA 336.A O no hydrogen 3.021 N/A ARG 340.A NH1 VAL 346.A O no hydrogen 3.059 N/A LYS 341.A N ASN 337.A O no hydrogen 3.210 N/A LYS 341.A NZ TRP 308.A O no hydrogen 3.188 N/A SER 342.A N LEU 339.A O no hydrogen 3.077 N/A GLY 343.A N ARG 340.A O no hydrogen 2.919 N/A LYS 344.A N LEU 339.A O no hydrogen 3.062 N/A LYS 344.A NZ THR 316.A O no hydrogen 2.885 N/A ARG 345.A N ASP 367.A OD2 no hydrogen 2.749 N/A ARG 345.A NE ASP 367.A OD2 no hydrogen 3.344 N/A ARG 345.A NH2 ASP 367.A OD1 no hydrogen 3.234 N/A ILE 347.A N PHE 368.A O no hydrogen 2.924 N/A LEU 349.A N VAL 370.A O no hydrogen 2.916 N/A SER 350.A N THR 353.A OG1 no hydrogen 3.252 N/A SER 350.A OG THR 353.A OG1 no hydrogen 2.837 N/A ARG 351.A NE ASP 254.A OD2 no hydrogen 2.969 N/A ARG 351.A NH1 ASP 373.A OD1 no hydrogen 2.859 N/A ARG 351.A NH2 ASP 254.A OD1 no hydrogen 3.049 N/A ARG 351.A NH2 ASP 373.A OD1 no hydrogen 3.393 N/A ARG 351.A NH2 ASP 373.A OD2 no hydrogen 2.653 N/A THR 353.A N SER 350.A O no hydrogen 3.258 N/A THR 353.A OG1 SER 350.A OG no hydrogen 2.837 N/A THR 356.A OG1 THR 353.A O no hydrogen 3.314 N/A GLU 357.A N THR 353.A O no hydrogen 2.865 N/A TYR 358.A N PHE 354.A O no hydrogen 2.875 N/A TYR 358.A OH GLU 194.A OE1 no hydrogen 3.119 N/A TYR 358.A OH ASN 380.A O no hydrogen 3.025 N/A LYS 360.A N GLU 357.A O no hydrogen 2.949 N/A LYS 360.A NZ GLU 357.A OE1 no hydrogen 3.169 N/A THR 361.A N TYR 358.A O no hydrogen 3.082 N/A THR 361.A OG1 TYR 358.A O no hydrogen 2.629 N/A LYS 362.A N PRO 359.A O no hydrogen 3.102 N/A LYS 362.A NZ THR 361.A OG1 no hydrogen 2.736 N/A LYS 362.A NZ ASN 380.A O no hydrogen 2.887 N/A LEU 363.A N PRO 359.A O no hydrogen 3.417 N/A THR 364.A N LYS 360.A O no hydrogen 3.092 N/A THR 364.A OG1 LYS 360.A O no hydrogen 2.530 N/A TRP 366.A N ASP 365.A OD1 no hydrogen 3.016 N/A TRP 366.A NE1 THR 361.A O no hydrogen 2.798 N/A ASP 367.A N ARG 345.A O no hydrogen 2.795 N/A PHE 368.A N ARG 345.A O no hydrogen 3.121 N/A VAL 369.A N THR 322.A O no hydrogen 2.840 N/A VAL 370.A N ILE 347.A O no hydrogen 2.848 N/A THR 371.A N TRP 324.A O no hydrogen 2.888 N/A THR 371.A OG1 THR 372.A O no hydrogen 2.728 N/A THR 371.A OG1 SER 375.A OG no hydrogen 2.709 N/A THR 372.A N LEU 349.A O no hydrogen 3.218 N/A SER 375.A N THR 372.A O no hydrogen 3.356 N/A SER 375.A OG THR 371.A OG1 no hydrogen 2.709 N/A GLU 376.A N ASP 373.A O no hydrogen 2.786 N/A MET 377.A N ILE 374.A O no hydrogen 3.341 N/A ASN 380.A N TYR 358.A OH no hydrogen 2.964 N/A GLY 384.A N LYS 321.A O no hydrogen 3.049 N/A ARG 385.A N LYS 321.A O no hydrogen 3.132 N/A ARG 385.A NE THR 322.A OG1 no hydrogen 2.918 N/A ARG 385.A NH1 TRP 314.A O no hydrogen 3.006 N/A ARG 385.A NH2 ILE 315.A O no hydrogen 2.810 N/A ARG 385.A NH2 THR 322.A OG1 no hydrogen 3.012 N/A VAL 386.A N GLN 435.A O no hydrogen 2.933 N/A ILE 387.A N VAL 323.A O no hydrogen 2.808 N/A ASP 388.A N VAL 437.A O no hydrogen 2.657 N/A ARG 390.A N ASP 388.A OD1 no hydrogen 2.788 N/A ARG 390.A NE GLY 440.A O no hydrogen 3.095 N/A ARG 390.A NH1 TYR 436.A OH no hydrogen 3.427 N/A ARG 390.A NH2 GLY 440.A O no hydrogen 2.750 N/A CYS 392.A N ILE 411.A O no hydrogen 2.792 N/A CYS 392.A SG ILE 411.A O no hydrogen 3.859 N/A LYS 394.A N ALA 408.A O no hydrogen 2.862 N/A LYS 394.A NZ ASP 448.A OD1 no hydrogen 3.213 N/A LYS 394.A NZ ASP 448.A OD2 no hydrogen 2.801 N/A VAL 396.A N ILE 406.A O no hydrogen 2.908 N/A LEU 398.A N ARG 404.A O no hydrogen 2.884 N/A ARG 404.A N LEU 398.A O no hydrogen 3.386 N/A ARG 404.A NH1 ASP 400.A O no hydrogen 3.324 N/A ARG 404.A NH2 ASP 400.A O no hydrogen 3.260 N/A VAL 405.A N LEU 560.A O no hydrogen 2.957 N/A ILE 406.A N VAL 396.A O no hydrogen 3.080 N/A ALA 408.A N LYS 394.A O no hydrogen 2.732 N/A ILE 411.A N CYS 392.A O no hydrogen 2.719 N/A VAL 413.A N ARG 390.A O no hydrogen 3.254 N/A THR 414.A OG1 SER 417.A OG no hydrogen 3.035 N/A SER 417.A N THR 414.A OG1 no hydrogen 2.956 N/A SER 417.A OG GLU 376.A OE2 no hydrogen 3.218 N/A SER 417.A OG THR 414.A OG1 no hydrogen 3.035 N/A ALA 418.A N THR 414.A O no hydrogen 3.124 N/A ALA 419.A N PRO 415.A O no hydrogen 3.050 N/A GLN 420.A N ALA 416.A O no hydrogen 3.062 N/A ARG 421.A N SER 417.A O no hydrogen 2.859 N/A ARG 421.A NE GLU 376.A OE1 no hydrogen 2.746 N/A ARG 421.A NH1 ASP 388.A OD1 no hydrogen 2.841 N/A ARG 421.A NH1 ARG 391.A O no hydrogen 3.296 N/A ARG 421.A NH2 ARG 391.A O no hydrogen 3.237 N/A ARG 422.A N ALA 418.A O no hydrogen 2.919 N/A ARG 422.A NE ASP 298.A OD1 no hydrogen 2.871 N/A ARG 422.A NH1 PRO 290.A O no hydrogen 2.789 N/A ARG 422.A NH2 ASP 298.A OD2 no hydrogen 3.269 N/A GLY 423.A N ALA 419.A O no hydrogen 2.766 N/A ARG 424.A N ARG 421.A O no hydrogen 3.195 N/A ARG 424.A NE GLN 420.A O no hydrogen 2.738 N/A ARG 424.A NH1 ALA 379.A O no hydrogen 2.916 N/A ARG 424.A NH2 GLN 420.A O no hydrogen 2.887 N/A ILE 425.A N ARG 422.A O no hydrogen 3.231 N/A GLY 426.A N ASP 434.A OD1 no hydrogen 2.674 N/A ARG 427.A NH1 GLY 423.A O no hydrogen 3.232 N/A GLN 431.A N ASN 428.A O no hydrogen 2.925 N/A GLN 435.A N GLY 384.A O no hydrogen 2.755 N/A TYR 436.A N GLU 297.A O no hydrogen 2.742 N/A TYR 436.A OH ASP 388.A OD2 no hydrogen 2.637 N/A VAL 437.A N VAL 386.A O no hydrogen 2.839 N/A PHE 438.A N ILE 299.A O no hydrogen 2.809 N/A SER 439.A N ASP 388.A O no hydrogen 3.221 N/A LEU 443.A N VAL 413.A O no hydrogen 2.824 N/A HIS 449.A N ASP 446.A O no hydrogen 3.178 N/A ALA 450.A N PRO 395.A O no hydrogen 2.818 N/A HIS 451.A ND1 THR 253.A O no hydrogen 2.811 N/A TRP 452.A N HIS 449.A O no hydrogen 3.428 N/A TRP 452.A NE1 ASP 446.A O no hydrogen 3.180 N/A GLU 454.A N ALA 450.A O no hydrogen 2.938 N/A ALA 455.A N HIS 451.A O no hydrogen 2.835 N/A LYS 456.A N TRP 452.A O no hydrogen 3.154 N/A LYS 456.A NZ ASP 484.A OD1 no hydrogen 3.507 N/A MET 457.A N THR 453.A O no hydrogen 2.993 N/A LEU 458.A N GLU 454.A O no hydrogen 3.111 N/A LEU 459.A N ALA 455.A O no hydrogen 2.950 N/A ASP 460.A N LYS 456.A O no hydrogen 2.802 N/A ASN 461.A N LEU 458.A O no hydrogen 3.043 N/A ASN 461.A ND2 MET 457.A O no hydrogen 3.040 N/A ASN 461.A ND2 PHE 487.A O no hydrogen 2.915 N/A ILE 462.A N LEU 459.A O no hydrogen 3.123 N/A TYR 463.A OH LEU 489.A O no hydrogen 2.848 N/A THR 464.A OG1 ILE 468.A O no hydrogen 2.689 N/A GLU 466.A N GLU 466.A OE1 no hydrogen 2.864 N/A GLY 467.A N THR 464.A O no hydrogen 3.056 N/A THR 471.A N THR 266.A OG1 no hydrogen 3.399 N/A GLU 476.A N PHE 473.A O no hydrogen 2.785 N/A ARG 477.A N GLY 474.A O no hydrogen 3.227 N/A LYS 479.A N GLU 476.A O no hydrogen 3.306 N/A LYS 479.A NZ ASP 446.A OD2 no hydrogen 2.962 N/A ALA 482.A N THR 480.A OG1 no hydrogen 3.164 N/A ILE 483.A N GLU 486.A OE1 no hydrogen 2.818 N/A GLY 485.A N ASP 460.A OD2 no hydrogen 3.166 N/A GLU 486.A N ILE 483.A O no hydrogen 3.124 N/A PHE 487.A N ASP 460.A OD1 no hydrogen 2.841 N/A ARG 488.A N GLY 485.A O no hydrogen 3.123 N/A ARG 488.A NE ASP 460.A O no hydrogen 2.811 N/A ARG 488.A NH2 ASP 460.A O no hydrogen 3.509 N/A LEU 489.A N ASN 461.A OD1 no hydrogen 2.747 N/A ARG 494.A N ARG 490.A O no hydrogen 3.341 N/A ARG 494.A NE ASN 461.A O no hydrogen 2.880 N/A ARG 494.A NH2 ASN 461.A O no hydrogen 2.864 N/A LYS 495.A N GLY 491.A O no hydrogen 3.220 N/A THR 496.A N GLU 492.A O no hydrogen 2.933 N/A THR 496.A OG1 GLU 492.A O no hydrogen 2.644 N/A PHE 497.A N GLN 493.A O no hydrogen 2.913 N/A VAL 498.A N ARG 494.A O no hydrogen 3.090 N/A GLU 499.A N LYS 495.A O no hydrogen 3.146 N/A LEU 500.A N THR 496.A O no hydrogen 2.861 N/A MET 501.A N PHE 497.A O no hydrogen 3.398 N/A MET 501.A N VAL 498.A O no hydrogen 3.203 N/A ARG 502.A N VAL 498.A O no hydrogen 2.853 N/A ARG 503.A N GLU 499.A O no hydrogen 2.863 N/A GLY 504.A N GLU 499.A O no hydrogen 3.105 N/A ASP 505.A N MET 501.A O no hydrogen 3.165 N/A LEU 506.A N LEU 500.A O no hydrogen 3.082 N/A TRP 509.A N GLU 454.A OE2 no hydrogen 2.888 N/A TRP 509.A NE1 GLU 403.A OE2 no hydrogen 3.226 N/A SER 511.A N PRO 507.A O no hydrogen 2.961 N/A SER 511.A OG LEU 506.A O no hydrogen 3.476 N/A SER 511.A OG PRO 507.A O no hydrogen 2.861 N/A TYR 512.A N VAL 508.A O no hydrogen 2.792 N/A LYS 513.A N TRP 509.A O no hydrogen 2.887 N/A VAL 514.A N LEU 510.A O no hydrogen 2.917 N/A ALA 515.A N SER 511.A O no hydrogen 3.067 N/A SER 516.A N TYR 512.A O no hydrogen 2.973 N/A SER 516.A OG TYR 512.A O no hydrogen 2.721 N/A ALA 517.A N LYS 513.A O no hydrogen 3.279 N/A ALA 517.A N VAL 514.A O no hydrogen 3.195 N/A GLY 518.A N ALA 515.A O no hydrogen 3.076 N/A ILE 519.A N VAL 514.A O no hydrogen 3.405 N/A TYR 521.A OH LYS 582.A O no hydrogen 2.822 N/A ASP 523.A N SER 520.A O no hydrogen 3.376 N/A ARG 524.A NE TYR 521.A O no hydrogen 3.100 N/A ARG 524.A NH1 PHE 577.A O no hydrogen 2.739 N/A ARG 524.A NH1 LYS 582.A OXT no hydrogen 2.918 N/A ARG 524.A NH2 TYR 521.A O no hydrogen 2.835 N/A ARG 524.A NH2 LYS 582.A OXT no hydrogen 3.047 N/A GLU 525.A N ASP 523.A OD2 no hydrogen 3.146 N/A CYS 527.A N ARG 524.A O no hydrogen 2.866 N/A PHE 528.A N GLU 525.A O no hydrogen 3.078 N/A THR 529.A OG1 GLU 525.A O no hydrogen 3.035 N/A GLY 530.A N ARG 556.A O no hydrogen 2.741 N/A ASN 534.A N GLU 531.A O no hydrogen 2.851 N/A ASN 534.A ND2 PRO 557.A O no hydrogen 2.797 N/A GLN 535.A N ARG 532.A O no hydrogen 3.356 N/A GLN 535.A NE2 ILE 536.A O no hydrogen 2.933 N/A GLN 535.A NE2 VAL 543.A O no hydrogen 3.191 N/A ILE 536.A N LEU 555.A O no hydrogen 2.921 N/A GLU 538.A N MET 541.A O no hydrogen 2.733 N/A MET 541.A N GLU 538.A O no hydrogen 2.718 N/A VAL 543.A N ILE 536.A O no hydrogen 2.979 N/A ILE 545.A N LYS 553.A O no hydrogen 2.571 N/A THR 547.A N GLU 551.A O no hydrogen 2.726 N/A THR 547.A OG1 GLU 549.A OE1 no hydrogen 3.000 N/A THR 547.A OG1 GLU 551.A O no hydrogen 3.061 N/A GLY 550.A N THR 547.A O no hydrogen 3.413 N/A GLU 551.A N THR 547.A OG1 no hydrogen 2.898 N/A LYS 553.A N ILE 545.A O no hydrogen 2.788 N/A LYS 554.A NZ GLU 542.A OE1 no hydrogen 2.842 N/A LEU 555.A N VAL 543.A O no hydrogen 2.803 N/A ARG 556.A N CYS 527.A O no hydrogen 2.917 N/A ARG 556.A NE GLN 535.A OE1 no hydrogen 3.055 N/A ARG 556.A NH2 GLN 535.A OE1 no hydrogen 2.787 N/A LYS 558.A N TRP 526.A O no hydrogen 2.651 N/A ALA 562.A N VAL 405.A O no hydrogen 2.929 N/A ARG 563.A N ASP 561.A OD2 no hydrogen 3.274 N/A ARG 563.A NE ASP 561.A OD2 no hydrogen 2.897 N/A ARG 563.A NH1 GLU 454.A OE1 no hydrogen 2.804 N/A ARG 563.A NH2 GLU 454.A OE2 no hydrogen 2.711 N/A ARG 563.A NH2 ASP 561.A OD1 no hydrogen 3.025 N/A ARG 563.A NH2 ASP 561.A OD2 no hydrogen 3.428 N/A VAL 564.A N ASP 561.A O no hydrogen 3.104 N/A TYR 565.A N ALA 562.A O no hydrogen 3.028 N/A ALA 566.A N ALA 562.A O no hydrogen 2.795 N/A MET 569.A N ASP 567.A OD1 no hydrogen 3.205 N/A LEU 571.A N ASP 567.A O no hydrogen 2.849 N/A LYS 572.A N PRO 568.A O no hydrogen 3.249 N/A ASP 573.A N MET 569.A O no hydrogen 2.933 N/A PHE 574.A N ALA 570.A O no hydrogen 2.739 N/A LYS 575.A N LEU 571.A O no hydrogen 2.810 N/A LYS 575.A NZ GLU 538.A OE1 no hydrogen 2.737 N/A GLU 576.A N LYS 572.A O no hydrogen 3.308 N/A PHE 577.A N ASP 573.A O no hydrogen 3.040 N/A ALA 578.A N PHE 574.A O no hydrogen 2.768 N/A SER 579.A N LYS 575.A O no hydrogen 2.962 N/A SER 579.A OG LYS 575.A O no hydrogen 2.865 N/A GLY 580.A N PHE 577.A O no hydrogen 3.149 N/A ARG 581.A N GLU 576.A O no hydrogen 3.279 N/A LYS 582.A NZ GLY 504.A O no hydrogen 3.129 N/A LYS 582.A NZ ASP 573.A OD1 no hydrogen 3.559 N/A