Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wap_7.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N VAL 10.A O no hydrogen 2.860 N/A VAL 5.A N LEU 3.A O no hydrogen 2.895 N/A VAL 10.A N LEU 3.A O no hydrogen 2.913 N/A GLN 21.A N TYR 18.A O no hydrogen 2.796 N/A PHE 22.A N TYR 18.A O no hydrogen 3.331 N/A SER 23.A N PRO 19.A O no hydrogen 2.961 N/A TYR 24.A N GLU 20.A O no hydrogen 2.873 N/A TYR 24.A OH THR 443.A OG1 no hydrogen 3.160 N/A MET 25.A N GLN 21.A O no hydrogen 2.892 N/A ARG 26.A N PHE 22.A O no hydrogen 2.946 N/A GLU 27.A N SER 23.A O no hydrogen 2.950 N/A LEU 28.A N TYR 24.A O no hydrogen 2.908 N/A LYS 29.A N MET 25.A O no hydrogen 2.883 N/A LYS 29.A NZ ASP 33.A OD2 no hydrogen 3.267 N/A ARG 30.A N ARG 26.A O no hydrogen 2.909 N/A THR 31.A N GLU 27.A O no hydrogen 2.954 N/A THR 31.A OG1 GLU 27.A O no hydrogen 3.363 N/A THR 31.A OG1 LEU 28.A O no hydrogen 2.469 N/A LEU 32.A N LEU 28.A O no hydrogen 2.935 N/A ASP 33.A N LYS 29.A O no hydrogen 2.856 N/A ALA 34.A N ARG 30.A O no hydrogen 2.925 N/A LYS 35.A N LEU 32.A O no hydrogen 2.910 N/A GLY 38.A N VAL 440.A O no hydrogen 2.953 N/A LEU 40.A N ILE 442.A O no hydrogen 3.475 N/A MET 42.A N SER 444.A O no hydrogen 3.115 N/A SER 44.A OG THR 46.A O no hydrogen 2.163 N/A SER 44.A OG ARG 655.A O no hydrogen 3.379 N/A THR 46.A N ARG 655.A O no hydrogen 3.060 N/A LYS 48.A NZ SER 44.A O no hydrogen 3.110 N/A LYS 48.A NZ GLY 45.A O no hydrogen 2.442 N/A SER 51.A N GLY 47.A O no hydrogen 2.950 N/A SER 51.A OG GLY 47.A O no hydrogen 3.520 N/A SER 51.A OG LYS 48.A O no hydrogen 3.053 N/A LEU 52.A N LYS 48.A O no hydrogen 2.881 N/A LEU 53.A N THR 49.A O no hydrogen 2.895 N/A ALA 54.A N VAL 50.A O no hydrogen 2.890 N/A LEU 55.A N SER 51.A O no hydrogen 2.951 N/A ILE 56.A N LEU 52.A O no hydrogen 2.915 N/A MET 57.A N LEU 53.A O no hydrogen 2.896 N/A ALA 58.A N ALA 54.A O no hydrogen 2.937 N/A TYR 59.A N LEU 55.A O no hydrogen 2.895 N/A GLN 60.A N ILE 56.A O no hydrogen 2.864 N/A ARG 61.A N MET 57.A O no hydrogen 2.929 N/A ALA 62.A N ALA 58.A O no hydrogen 2.921 N/A TYR 63.A N TYR 59.A O no hydrogen 2.862 N/A GLU 66.A N TYR 63.A O no hydrogen 2.985 N/A THR 68.A N LYS 228.A O no hydrogen 2.860 N/A THR 68.A OG1 LYS 228.A O no hydrogen 2.808 N/A LEU 70.A N ASN 203.A O no hydrogen 2.887 N/A ILE 71.A N VAL 230.A O no hydrogen 2.903 N/A TYR 72.A N VAL 205.A O no hydrogen 2.937 N/A CYS 73.A N VAL 232.A O no hydrogen 2.888 N/A SER 74.A OG GLU 79.A OE1 no hydrogen 3.371 N/A SER 74.A OG GLU 235.A OE2 no hydrogen 2.670 N/A ARG 75.A N GLU 235.A OE2 no hydrogen 3.143 N/A ARG 75.A NE GLU 235.A O no hydrogen 2.744 N/A ARG 75.A NH2 GLU 235.A O no hydrogen 2.933 N/A GLU 79.A N THR 76.A OG1 no hydrogen 3.233 N/A ILE 80.A N THR 76.A O no hydrogen 2.875 N/A GLU 81.A N VAL 77.A O no hydrogen 2.956 N/A VAL 83.A N GLU 79.A O no hydrogen 3.355 N/A ILE 84.A N ILE 80.A O no hydrogen 2.930 N/A GLU 85.A N GLU 81.A O no hydrogen 2.948 N/A GLU 86.A N LYS 82.A O no hydrogen 2.948 N/A LEU 87.A N VAL 83.A O no hydrogen 2.895 N/A ARG 88.A N ILE 84.A O no hydrogen 2.873 N/A ARG 88.A NH2 GLU 85.A OE2 no hydrogen 3.301 N/A LYS 89.A N GLU 85.A O no hydrogen 2.976 N/A LEU 90.A N GLU 86.A O no hydrogen 2.939 N/A LEU 91.A N LEU 87.A O no hydrogen 2.872 N/A ASN 92.A N ARG 88.A O no hydrogen 2.922 N/A PHE 93.A N LYS 89.A O no hydrogen 2.964 N/A TYR 94.A N LEU 90.A O no hydrogen 2.919 N/A GLU 95.A N LEU 91.A O no hydrogen 2.831 N/A LYS 96.A N ASN 92.A O no hydrogen 2.927 N/A GLN 97.A N PHE 93.A O no hydrogen 2.942 N/A GLU 98.A N TYR 94.A O no hydrogen 2.901 N/A GLY 99.A N GLU 95.A O no hydrogen 2.865 N/A PHE 104.A N LEU 102.A O no hydrogen 2.649 N/A GLY 106.A N GLY 173.A O no hydrogen 3.283 N/A LEU 107.A N VAL 204.A O no hydrogen 2.912 N/A LEU 109.A N VAL 206.A O no hydrogen 2.911 N/A SER 110.A OG ASN 114.A OD1 no hydrogen 2.780 N/A ASN 114.A N SER 111.A OG no hydrogen 3.151 N/A LEU 115.A N SER 111.A O no hydrogen 2.941 N/A THR 122.A N HIS 118.A O no hydrogen 2.940 N/A THR 122.A N PRO 119.A O no hydrogen 3.308 N/A THR 122.A OG1 HIS 118.A O no hydrogen 2.621 N/A LYS 128.A NZ SER 381.A OG no hydrogen 2.637 N/A VAL 130.A N PHE 126.A O no hydrogen 2.992 N/A ASP 131.A N GLY 127.A O no hydrogen 2.914 N/A GLY 132.A N LYS 128.A O no hydrogen 2.892 N/A LYS 133.A N ASP 129.A O no hydrogen 2.911 N/A CYS 134.A N VAL 130.A O no hydrogen 2.896 N/A HIS 135.A N ASP 131.A O no hydrogen 2.883 N/A SER 136.A N GLY 132.A O no hydrogen 2.897 N/A SER 136.A OG GLY 132.A O no hydrogen 3.013 N/A SER 136.A OG LYS 133.A O no hydrogen 2.424 N/A LEU 137.A N LYS 133.A O no hydrogen 2.934 N/A THR 138.A N CYS 134.A O no hydrogen 2.865 N/A ALA 139.A N SER 136.A O no hydrogen 3.395 N/A TYR 141.A OH HIS 370.A O no hydrogen 2.732 N/A ARG 143.A N ALA 139.A O no hydrogen 2.678 N/A ARG 143.A NH1 GLU 159.A OE1 no hydrogen 2.478 N/A ARG 143.A NH1 ASP 162.A OD2 no hydrogen 3.019 N/A ARG 143.A NH2 ASP 162.A OD2 no hydrogen 2.581 N/A ALA 144.A N SER 140.A O no hydrogen 2.889 N/A GLN 145.A N TYR 141.A O no hydrogen 2.883 N/A TYR 146.A N VAL 142.A O no hydrogen 2.810 N/A GLN 147.A N ARG 143.A O no hydrogen 2.944 N/A HIS 148.A N ALA 144.A O no hydrogen 3.203 N/A ASP 149.A N GLN 145.A O no hydrogen 2.887 N/A GLU 160.A N ARG 156.A O no hydrogen 2.904 N/A PHE 161.A N PHE 157.A O no hydrogen 2.875 N/A ASP 162.A N TYR 158.A O no hydrogen 2.860 N/A ALA 163.A N GLU 159.A O no hydrogen 2.921 N/A HIS 164.A N GLU 160.A O no hydrogen 2.918 N/A HIS 164.A N PHE 161.A O no hydrogen 3.242 N/A GLY 165.A N PHE 161.A O no hydrogen 2.829 N/A VAL 168.A N HIS 164.A O no hydrogen 2.939 N/A ASN 176.A ND2 GLU 81.A OE1 no hydrogen 2.778 N/A ASN 176.A ND2 GLU 85.A OE2 no hydrogen 3.381 N/A LEU 177.A N ASN 176.A OD1 no hydrogen 2.485 N/A LEU 180.A N ASN 176.A O no hydrogen 2.843 N/A LYS 181.A N LEU 177.A O no hydrogen 2.936 N/A LYS 181.A NZ ASP 178.A OD1 no hydrogen 3.316 N/A ALA 182.A N ASP 178.A O no hydrogen 3.214 N/A LEU 183.A N ASP 179.A O no hydrogen 2.901 N/A GLY 184.A N LEU 180.A O no hydrogen 2.882 N/A ARG 185.A N LYS 181.A O no hydrogen 2.936 N/A ARG 186.A N ALA 182.A O no hydrogen 2.895 N/A GLN 187.A N LEU 183.A O no hydrogen 2.920 N/A TRP 189.A N GLY 184.A O no hydrogen 3.050 N/A TRP 189.A NE1 HIS 164.A ND1 no hydrogen 3.273 N/A LEU 194.A N CYS 190.A O no hydrogen 2.911 N/A ARG 196.A N TYR 192.A O no hydrogen 2.905 N/A TYR 197.A N PHE 193.A O no hydrogen 2.872 N/A SER 198.A N LEU 194.A O no hydrogen 2.905 N/A SER 198.A OG LEU 194.A O no hydrogen 2.939 N/A ILE 199.A N ALA 195.A O no hydrogen 2.944 N/A ILE 199.A N ARG 196.A O no hydrogen 3.330 N/A LEU 200.A N TYR 197.A O no hydrogen 3.010 N/A VAL 204.A N LEU 105.A O no hydrogen 2.889 N/A VAL 205.A N LEU 70.A O no hydrogen 2.912 N/A VAL 206.A N LEU 107.A O no hydrogen 2.960 N/A SER 208.A OG HIS 210.A NE2 no hydrogen 2.640 N/A TYR 209.A OH ASP 234.A O no hydrogen 2.876 N/A TYR 211.A N SER 208.A O no hydrogen 3.100 N/A LEU 212.A N TYR 209.A O no hydrogen 2.518 N/A LEU 213.A N TYR 209.A O no hydrogen 2.869 N/A ALA 218.A N ASP 214.A O no hydrogen 2.819 N/A SER 222.A N ALA 218.A O no hydrogen 2.873 N/A SER 222.A OG ALA 218.A O no hydrogen 2.562 N/A ALA 226.A N LYS 223.A O no hydrogen 3.429 N/A ARG 227.A NH2 GLU 224.A OE1 no hydrogen 2.908 N/A LYS 228.A NZ LEU 65.A O no hydrogen 2.929 N/A VAL 230.A N LYS 69.A O no hydrogen 2.914 N/A VAL 232.A N ILE 71.A O no hydrogen 2.864 N/A PHE 233.A N ILE 441.A O no hydrogen 2.926 N/A ASP 234.A N CYS 73.A O no hydrogen 2.927 N/A CYS 243.A N ILE 239.A O no hydrogen 2.876 N/A CYS 243.A SG ALA 426.A O no hydrogen 3.168 N/A ILE 244.A N ASP 240.A O no hydrogen 2.881 N/A ASP 245.A N ASN 241.A O no hydrogen 2.893 N/A SER 246.A N VAL 242.A O no hydrogen 2.919 N/A SER 246.A OG CYS 243.A O no hydrogen 2.370 N/A MET 247.A N ILE 244.A O no hydrogen 2.931 N/A SER 248.A N ILE 244.A O no hydrogen 2.868 N/A LEU 251.A N LEU 419.A O no hydrogen 2.752 N/A THR 252.A OG1 THR 255.A OG1 no hydrogen 2.356 N/A ARG 253.A N PRO 417.A O no hydrogen 3.388 N/A THR 255.A N THR 252.A OG1 no hydrogen 3.155 N/A THR 255.A OG1 THR 252.A OG1 no hydrogen 2.356 N/A LEU 256.A N THR 252.A O no hydrogen 2.870 N/A ASP 257.A N ARG 253.A O no hydrogen 2.907 N/A ARG 258.A N ARG 254.A O no hydrogen 2.939 N/A CYS 259.A N THR 255.A O no hydrogen 2.846 N/A CYS 259.A SG THR 255.A O no hydrogen 3.258 N/A GLN 260.A N LEU 256.A O no hydrogen 2.898 N/A GLN 260.A NE2 GLU 264.A OE2 no hydrogen 3.091 N/A GLY 261.A N ASP 257.A O no hydrogen 2.974 N/A ASN 262.A N ARG 258.A O no hydrogen 2.881 N/A LEU 263.A N CYS 259.A O no hydrogen 2.841 N/A GLU 264.A N GLN 260.A O no hydrogen 2.941 N/A THR 265.A N GLY 261.A O no hydrogen 2.982 N/A THR 265.A OG1 GLY 261.A O no hydrogen 3.047 N/A LEU 266.A N ASN 262.A O no hydrogen 2.819 N/A GLN 267.A N LEU 263.A O no hydrogen 2.914 N/A LYS 268.A N GLU 264.A O no hydrogen 2.993 N/A THR 269.A N THR 265.A O no hydrogen 2.884 N/A THR 269.A OG1 THR 265.A O no hydrogen 3.011 N/A VAL 270.A N LEU 266.A O no hydrogen 2.869 N/A LEU 271.A N GLN 267.A O no hydrogen 2.976 N/A ARG 272.A N LYS 268.A O no hydrogen 2.960 N/A ILE 273.A N THR 269.A O no hydrogen 2.856 N/A LYS 274.A N VAL 270.A O no hydrogen 2.881 N/A LYS 274.A NZ GLU 313.A OE2 no hydrogen 3.272 N/A GLU 275.A N LEU 271.A O no hydrogen 3.004 N/A THR 276.A N ARG 272.A O no hydrogen 2.921 N/A THR 276.A N ILE 273.A O no hydrogen 3.231 N/A THR 276.A OG1 ARG 272.A O no hydrogen 2.697 N/A THR 276.A OG1 ILE 273.A O no hydrogen 3.254 N/A ASP 277.A N ILE 273.A O no hydrogen 2.861 N/A ARG 282.A N GLU 278.A O no hydrogen 2.840 N/A ASP 283.A N GLN 279.A O no hydrogen 3.041 N/A GLU 284.A N LEU 281.A O no hydrogen 3.392 N/A TYR 285.A N ARG 282.A O no hydrogen 2.592 N/A ARG 286.A NH1 ARG 282.A O no hydrogen 3.513 N/A ARG 287.A N ASP 283.A O no hydrogen 3.075 N/A LEU 288.A N GLU 284.A O no hydrogen 2.848 N/A VAL 289.A N TYR 285.A O no hydrogen 2.889 N/A GLU 290.A N ARG 286.A O no hydrogen 2.980 N/A GLY 291.A N ARG 287.A O no hydrogen 2.879 N/A GLU 299.A N GLU 299.A OE1 no hydrogen 2.462 N/A LEU 301.A N PRO 297.A O no hydrogen 2.756 N/A GLU 303.A N GLN 302.A OE1 no hydrogen 3.137 N/A HIS 314.A N THR 311.A OG1 no hydrogen 3.359 N/A PHE 315.A N THR 311.A O no hydrogen 2.913 N/A LEU 316.A N ALA 312.A O no hydrogen 2.884 N/A GLY 317.A N GLU 313.A O no hydrogen 2.904 N/A PHE 318.A N HIS 314.A O no hydrogen 2.923 N/A LEU 319.A N PHE 315.A O no hydrogen 2.932 N/A ARG 320.A N LEU 316.A O no hydrogen 2.875 N/A ARG 321.A N GLY 317.A O no hydrogen 2.908 N/A LEU 322.A N PHE 318.A O no hydrogen 2.975 N/A LEU 323.A N LEU 319.A O no hydrogen 2.854 N/A GLU 324.A N ARG 320.A O no hydrogen 2.915 N/A TYR 325.A N ARG 321.A O no hydrogen 2.973 N/A VAL 326.A N LEU 322.A O no hydrogen 2.917 N/A LYS 327.A N LEU 323.A O no hydrogen 2.840 N/A LYS 327.A NZ ASP 257.A OD1 no hydrogen 2.914 N/A TRP 328.A N GLU 324.A O no hydrogen 2.977 N/A ARG 329.A N TYR 325.A O no hydrogen 2.906 N/A LEU 330.A N VAL 326.A O no hydrogen 2.888 N/A ARG 331.A N LYS 327.A O no hydrogen 2.877 N/A VAL 332.A N TRP 328.A O no hydrogen 2.997 N/A GLN 337.A N ILE 404.A O no hydrogen 3.448 N/A SER 339.A N ILE 402.A O no hydrogen 2.945 N/A PHE 343.A N SER 339.A O no hydrogen 3.245 N/A SER 345.A N PRO 341.A O no hydrogen 2.980 N/A GLY 346.A N ALA 342.A O no hydrogen 2.826 N/A LEU 347.A N PHE 343.A O no hydrogen 2.876 N/A ALA 348.A N LEU 344.A O no hydrogen 2.960 N/A GLN 349.A N SER 345.A O no hydrogen 2.928 N/A ARG 350.A N GLY 346.A O no hydrogen 2.825 N/A VAL 351.A N LEU 347.A O no hydrogen 2.974 N/A LEU 358.A N GLN 354.A O no hydrogen 2.954 N/A ARG 359.A N LYS 356.A O no hydrogen 3.047 N/A ARG 359.A NH1 THR 395.A O no hydrogen 3.415 N/A CYS 361.A N LEU 358.A O no hydrogen 3.234 N/A ARG 364.A N PHE 360.A O no hydrogen 2.933 N/A LEU 365.A N CYS 361.A O no hydrogen 2.845 N/A ARG 366.A N ALA 362.A O no hydrogen 2.922 N/A SER 367.A N GLU 363.A O no hydrogen 3.022 N/A SER 367.A OG GLU 284.A OE2 no hydrogen 2.809 N/A LEU 368.A N ARG 364.A O no hydrogen 2.853 N/A LEU 369.A N LEU 365.A O no hydrogen 2.843 N/A HIS 370.A N ARG 366.A O no hydrogen 2.931 N/A THR 371.A N SER 367.A O no hydrogen 2.989 N/A THR 371.A OG1 LEU 368.A O no hydrogen 2.111 N/A LEU 372.A N LEU 368.A O no hydrogen 3.219 N/A LEU 372.A N LEU 369.A O no hydrogen 3.187 N/A GLU 373.A N HIS 370.A O no hydrogen 3.184 N/A THR 375.A OG1 ASP 376.A OD1 no hydrogen 3.102 N/A SER 381.A N ALA 378.A O no hydrogen 3.329 N/A THR 384.A N PHE 380.A O no hydrogen 3.134 N/A THR 384.A OG1 SER 381.A O no hydrogen 2.419 N/A LEU 385.A N SER 381.A O no hydrogen 2.907 N/A LEU 386.A N PRO 382.A O no hydrogen 2.950 N/A ALA 387.A N LEU 383.A O no hydrogen 2.866 N/A ASN 388.A N THR 384.A O no hydrogen 2.865 N/A PHE 389.A N LEU 385.A O no hydrogen 2.955 N/A ALA 390.A N LEU 386.A O no hydrogen 2.862 N/A THR 391.A N ALA 387.A O no hydrogen 2.885 N/A THR 391.A OG1 ARG 359.A O no hydrogen 2.244 N/A LEU 392.A N ASN 388.A O no hydrogen 2.908 N/A VAL 393.A N PHE 389.A O no hydrogen 2.969 N/A SER 394.A N ALA 390.A O no hydrogen 3.430 N/A SER 394.A OG ALA 390.A O no hydrogen 3.032 N/A SER 394.A OG THR 391.A O no hydrogen 2.888 N/A THR 395.A N THR 391.A O no hydrogen 2.859 N/A THR 395.A N LEU 392.A O no hydrogen 2.932 N/A THR 395.A OG1 THR 391.A O no hydrogen 2.159 N/A TYR 396.A N LEU 392.A O no hydrogen 3.015 N/A PHE 400.A N ALA 397.A O no hydrogen 3.445 N/A ILE 403.A N HIS 420.A O no hydrogen 2.896 N/A ILE 404.A N GLN 337.A O no hydrogen 2.955 N/A GLU 405.A N ILE 418.A O no hydrogen 2.921 N/A ARG 410.A NE ASP 409.A O no hydrogen 3.438 N/A ARG 410.A NE ASP 409.A OD1 no hydrogen 3.289 N/A ARG 410.A NH2 ASP 409.A OD1 no hydrogen 3.482 N/A THR 411.A OG1 ASP 408.A O no hydrogen 2.928 N/A THR 411.A OG1 ASP 409.A O no hydrogen 3.358 N/A ILE 418.A N GLU 405.A O no hydrogen 2.977 N/A LEU 419.A N LEU 251.A O no hydrogen 2.570 N/A HIS 420.A N ILE 403.A O no hydrogen 2.868 N/A HIS 420.A ND1 ASN 250.A OD1 no hydrogen 2.593 N/A CYS 423.A SG GLY 399.A O no hydrogen 3.627 N/A CYS 423.A SG ASP 425.A O no hydrogen 2.941 N/A CYS 423.A SG ASP 425.A OD1 no hydrogen 3.461 N/A ILE 430.A N ALA 426.A O no hydrogen 2.959 N/A LYS 431.A NZ ASP 458.A O no hydrogen 3.336 N/A PHE 434.A N ILE 430.A O no hydrogen 3.465 N/A GLU 435.A N LYS 431.A O no hydrogen 2.929 N/A ARG 436.A N PRO 432.A O no hydrogen 2.852 N/A ARG 436.A NH1 ASP 298.A OD2 no hydrogen 3.484 N/A PHE 437.A N VAL 433.A O no hydrogen 2.947 N/A SER 439.A OG GLY 36.A O no hydrogen 2.782 N/A ILE 441.A N VAL 231.A O no hydrogen 2.922 N/A ILE 442.A N GLY 38.A O no hydrogen 3.307 N/A THR 443.A OG1 TYR 24.A OH no hydrogen 3.160 N/A SER 444.A N LEU 40.A O no hydrogen 3.289 N/A THR 446.A OG1 GLY 445.A O no hydrogen 2.237 N/A LEU 447.A N GLU 41.A OE2 no hydrogen 2.911 N/A ILE 452.A N PRO 449.A O no hydrogen 3.445 N/A TYR 453.A N LEU 450.A O no hydrogen 2.922 N/A TYR 453.A OH HIS 237.A O no hydrogen 2.422 N/A ILE 456.A N ILE 452.A O no hydrogen 3.016 N/A LEU 457.A N TYR 453.A O no hydrogen 2.880 N/A HIS 460.A N HIS 37.A NE2 no hydrogen 3.056 N/A VAL 462.A N HIS 37.A O no hydrogen 3.229 N/A PHE 467.A N GLU 41.A O no hydrogen 3.415 N/A CYS 475.A SG ASP 659.A O no hydrogen 2.926 N/A MET 479.A N MET 663.A O no hydrogen 2.890 N/A ILE 481.A N PHE 665.A O no hydrogen 2.886 N/A GLY 482.A N ASN 693.A OD1 no hydrogen 3.224 N/A GLN 487.A N GLY 484.A O no hydrogen 2.879 N/A SER 492.A OG ASP 667.A OD2 no hydrogen 3.244 N/A GLU 495.A N GLU 495.A OE1 no hydrogen 2.684 N/A ARG 497.A N PHE 494.A O no hydrogen 3.434 N/A ASP 499.A N THR 496.A O no hydrogen 3.173 N/A VAL 502.A N ASP 499.A OD1 no hydrogen 2.289 N/A ILE 503.A N ASP 499.A O no hydrogen 2.990 N/A ARG 504.A N ILE 500.A O no hydrogen 2.844 N/A ASN 505.A N ALA 501.A O no hydrogen 2.890 N/A TYR 506.A N VAL 502.A O no hydrogen 2.952 N/A TYR 506.A OH ALA 666.A O no hydrogen 3.181 N/A GLY 507.A N ILE 503.A O no hydrogen 2.912 N/A ASN 508.A N ARG 504.A O no hydrogen 2.884 N/A LEU 509.A N ASN 505.A O no hydrogen 2.922 N/A LEU 510.A N TYR 506.A O no hydrogen 2.916 N/A LEU 511.A N GLY 507.A O no hydrogen 2.883 N/A GLU 512.A N ASN 508.A O no hydrogen 2.974 N/A MET 513.A N LEU 509.A O no hydrogen 2.882 N/A SER 514.A N LEU 510.A O no hydrogen 2.849 N/A SER 514.A OG LEU 510.A O no hydrogen 3.158 N/A SER 514.A OG LEU 511.A O no hydrogen 2.742 N/A ALA 515.A N LEU 511.A O no hydrogen 2.917 N/A VAL 516.A N GLU 512.A O no hydrogen 2.998 N/A VAL 517.A N MET 513.A O no hydrogen 2.817 N/A ILE 521.A N ALA 580.A O no hydrogen 2.914 N/A ALA 523.A N LEU 582.A O no hydrogen 2.890 N/A PHE 524.A N ILE 605.A O no hydrogen 2.893 N/A PHE 525.A N SER 584.A O no hydrogen 2.877 N/A SER 527.A OG GLN 529.A OE1 no hydrogen 2.531 N/A SER 527.A OG TYR 613.A OH no hydrogen 2.660 N/A GLN 529.A N GLN 529.A OE1 no hydrogen 2.729 N/A MET 531.A N SER 527.A O no hydrogen 2.896 N/A GLU 532.A N TYR 528.A O no hydrogen 2.886 N/A SER 533.A N GLN 529.A O no hydrogen 2.903 N/A THR 534.A N TYR 530.A O no hydrogen 2.942 N/A THR 534.A OG1 TYR 530.A O no hydrogen 3.179 N/A VAL 535.A N MET 531.A O no hydrogen 2.888 N/A ALA 536.A N GLU 532.A O no hydrogen 2.852 N/A SER 537.A N SER 533.A O no hydrogen 2.939 N/A TRP 538.A N THR 534.A O no hydrogen 2.938 N/A TRP 538.A NE1 ILE 503.A O no hydrogen 2.763 N/A TYR 539.A N VAL 535.A O no hydrogen 2.859 N/A GLU 540.A N ALA 536.A O no hydrogen 2.896 N/A GLN 541.A N SER 537.A O no hydrogen 2.958 N/A GLN 541.A NE2 SER 537.A O no hydrogen 3.392 N/A LEU 544.A N TRP 538.A O no hydrogen 3.405 N/A ASN 546.A N GLY 542.A O no hydrogen 3.269 N/A ILE 547.A N ILE 543.A O no hydrogen 2.917 N/A GLN 548.A N LEU 544.A O no hydrogen 2.879 N/A ARG 549.A N GLU 545.A O no hydrogen 2.915 N/A ASN 550.A N ASN 546.A O no hydrogen 2.908 N/A LYS 551.A N ILE 547.A O no hydrogen 2.889 N/A LYS 551.A NZ VAL 517.A O no hydrogen 3.300 N/A LYS 551.A NZ PRO 518.A O no hydrogen 2.813 N/A PHE 554.A N ILE 581.A O no hydrogen 2.887 N/A THR 557.A OG1 GLU 562.A OE1 no hydrogen 2.079 N/A GLN 558.A N GLN 558.A OE1 no hydrogen 2.751 N/A THR 563.A N ASP 559.A O no hydrogen 2.968 N/A THR 563.A OG1 GLU 556.A OE1 no hydrogen 2.430 N/A THR 563.A OG1 ASP 559.A O no hydrogen 3.196 N/A SER 564.A N GLY 560.A O no hydrogen 2.857 N/A VAL 565.A N ALA 561.A O no hydrogen 2.957 N/A ALA 566.A N GLU 562.A O no hydrogen 2.884 N/A LEU 567.A N THR 563.A O no hydrogen 2.926 N/A GLU 568.A N SER 564.A O no hydrogen 2.878 N/A LYS 569.A N VAL 565.A O no hydrogen 2.967 N/A TYR 570.A N ALA 566.A O no hydrogen 2.844 N/A GLN 571.A N LEU 567.A O no hydrogen 2.935 N/A GLU 572.A N GLU 568.A O no hydrogen 3.417 N/A ALA 573.A N LYS 569.A O no hydrogen 2.915 N/A CYS 574.A N TYR 570.A O no hydrogen 2.890 N/A CYS 574.A SG TYR 570.A O no hydrogen 3.332 N/A GLU 575.A N GLN 571.A O no hydrogen 2.933 N/A ASN 576.A N GLU 572.A O no hydrogen 2.906 N/A GLY 579.A N ALA 573.A O no hydrogen 3.261 N/A ILE 581.A N LEU 552.A O no hydrogen 2.873 N/A LEU 582.A N ILE 521.A O no hydrogen 2.912 N/A LEU 583.A N PHE 554.A O no hydrogen 2.889 N/A SER 584.A N ALA 523.A O no hydrogen 2.928 N/A SER 584.A OG VAL 585.A O no hydrogen 3.311 N/A ALA 586.A N PHE 525.A O no hydrogen 3.233 N/A GLY 588.A N VAL 585.A O no hydrogen 2.955 N/A SER 591.A N GLY 588.A O no hydrogen 2.971 N/A SER 591.A OG ALA 586.A O no hydrogen 2.644 N/A SER 591.A OG GLY 588.A O no hydrogen 2.762 N/A GLY 593.A N LYS 589.A O no hydrogen 2.921 N/A ILE 594.A N VAL 590.A O no hydrogen 2.884 N/A TYR 600.A N VAL 597.A O no hydrogen 2.708 N/A ARG 602.A N GLY 520.A O no hydrogen 3.134 N/A ARG 602.A NH1 TYR 660.A O no hydrogen 3.507 N/A VAL 604.A N LEU 662.A O no hydrogen 2.942 N/A ILE 605.A N VAL 522.A O no hydrogen 2.898 N/A MET 606.A N VAL 664.A O no hydrogen 2.934 N/A PHE 607.A N PHE 524.A O no hydrogen 2.907 N/A VAL 609.A N ASP 667.A OD2 no hydrogen 2.947 N/A TYR 613.A OH SER 527.A OG no hydrogen 2.660 N/A TYR 613.A OH GLN 529.A OE1 no hydrogen 2.959 N/A LEU 619.A N SER 616.A O no hydrogen 3.201 N/A LYS 620.A NZ SER 616.A O no hydrogen 3.059 N/A ALA 621.A N ARG 617.A O no hydrogen 3.265 N/A ARG 622.A N ILE 618.A O no hydrogen 2.992 N/A LEU 623.A N LEU 619.A O no hydrogen 2.820 N/A LEU 623.A N LYS 620.A O no hydrogen 3.324 N/A GLU 624.A N LYS 620.A O no hydrogen 2.894 N/A TYR 625.A N ALA 621.A O no hydrogen 2.940 N/A TYR 625.A OH ASP 425.A OD2 no hydrogen 3.223 N/A ARG 627.A N LEU 623.A O no hydrogen 2.925 N/A ASP 628.A N GLU 624.A O no hydrogen 2.902 N/A GLN 629.A N TYR 625.A O no hydrogen 2.853 N/A ILE 632.A N LEU 626.A O no hydrogen 3.330 N/A PHE 637.A N ARG 633.A O no hydrogen 2.905 N/A LEU 638.A N GLU 634.A O no hydrogen 2.910 N/A THR 639.A N ASN 635.A O no hydrogen 2.897 N/A THR 639.A OG1 ASN 635.A O no hydrogen 2.853 N/A PHE 640.A N ASP 636.A O no hydrogen 2.893 N/A ASP 641.A N PHE 637.A O no hydrogen 2.849 N/A ALA 642.A N LEU 638.A O no hydrogen 2.985 N/A MET 643.A N THR 639.A O no hydrogen 2.865 N/A ARG 644.A N PHE 640.A O no hydrogen 2.896 N/A ARG 644.A NH1 ASP 240.A OD2 no hydrogen 2.696 N/A ARG 644.A NH2 ASP 240.A OD2 no hydrogen 3.333 N/A ARG 644.A NH2 ASP 641.A OD1 no hydrogen 3.555 N/A HIS 645.A N ASP 641.A O no hydrogen 3.348 N/A HIS 645.A NE2 ALA 586.A O no hydrogen 2.800 N/A ALA 646.A N ALA 642.A O no hydrogen 2.915 N/A ALA 647.A N MET 643.A O no hydrogen 2.870 N/A GLN 648.A N ARG 644.A O no hydrogen 2.898 N/A CYS 649.A N HIS 645.A O no hydrogen 2.953 N/A CYS 649.A SG ALA 586.A O no hydrogen 3.338 N/A CYS 649.A SG SER 591.A OG no hydrogen 3.617 N/A CYS 649.A SG HIS 645.A O no hydrogen 3.362 N/A VAL 650.A N ALA 647.A O no hydrogen 3.331 N/A GLY 651.A N ALA 647.A O no hydrogen 2.915 N/A ARG 652.A NE ILE 594.A O no hydrogen 3.276 N/A ARG 652.A NH2 SER 591.A O no hydrogen 3.393 N/A ARG 655.A N ARG 652.A O no hydrogen 3.034 N/A GLY 661.A N CYS 475.A O no hydrogen 3.327 N/A LEU 662.A N ARG 602.A O no hydrogen 3.358 N/A VAL 664.A N VAL 604.A O no hydrogen 2.881 N/A PHE 665.A N MET 479.A O no hydrogen 2.933 N/A ALA 666.A N MET 606.A O no hydrogen 2.882 N/A ASP 667.A N PHE 665.A O no hydrogen 2.935 N/A ARG 669.A N ASP 667.A OD1 no hydrogen 2.692 N/A PHE 670.A N ASP 667.A O no hydrogen 3.299 N/A ALA 671.A N LYS 668.A O no hydrogen 3.019 N/A ARG 672.A N ARG 669.A O no hydrogen 2.844 N/A LYS 675.A N ASP 674.A OD1 no hydrogen 2.619 N/A LYS 675.A NZ ASP 674.A OD1 no hydrogen 3.428 N/A LYS 675.A NZ ASP 674.A OD2 no hydrogen 2.943 N/A ARG 676.A N ARG 672.A O no hydrogen 3.075 N/A GLY 677.A N GLY 673.A O no hydrogen 2.710 N/A LYS 678.A N ASP 674.A O no hydrogen 2.922 N/A LYS 678.A NZ ASP 636.A O no hydrogen 3.275 N/A LEU 679.A N LYS 675.A O no hydrogen 2.900 N/A LEU 679.A N ARG 676.A O no hydrogen 3.090 N/A GLN 684.A N PRO 680.A O no hydrogen 2.996 N/A GLU 685.A N ARG 681.A O no hydrogen 2.881 N/A HIS 686.A ND1 TRP 682.A O no hydrogen 3.277 N/A LEU 687.A N ILE 683.A O no hydrogen 2.926 N/A THR 688.A N ASN 691.A OD1 no hydrogen 3.242 N/A LEU 692.A N ASP 689.A O no hydrogen 3.256 N/A GLY 699.A N THR 695.A O no hydrogen 2.838 N/A VAL 700.A N VAL 696.A O no hydrogen 2.933 N/A GLN 701.A N ASP 697.A O no hydrogen 2.922 N/A GLN 701.A NE2 ASP 697.A O no hydrogen 2.633 N/A VAL 702.A N GLU 698.A O no hydrogen 2.924 N/A ALA 703.A N GLY 699.A O no hydrogen 2.879 N/A LYS 704.A N VAL 700.A O no hydrogen 2.930 N/A TYR 705.A N GLN 701.A O no hydrogen 2.954 N/A PHE 706.A N VAL 702.A O no hydrogen 2.859 N/A LEU 707.A N ALA 703.A O no hydrogen 2.907 N/A ARG 708.A N LYS 704.A O no hydrogen 2.925 N/A GLN 709.A N TYR 705.A O no hydrogen 2.937 N/A MET 710.A N PHE 706.A O no hydrogen 2.917 N/A ALA 711.A N LEU 707.A O no hydrogen 2.904 N/A ALA 711.A N ARG 708.A O no hydrogen 3.190 N/A