Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xkm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A N VAL 24.A O no hydrogen 2.633 N/A CYS 4.A SG VAL 24.A O no hydrogen 3.119 N/A MET 7.A N HIS 28.A O no hydrogen 2.662 N/A LEU 16.A N LEU 13.A O no hydrogen 3.107 N/A HIS 17.A N THR 14.A O no hydrogen 2.917 N/A GLU 18.A N ARG 15.A O no hydrogen 2.937 N/A LEU 19.A N LEU 16.A O no hydrogen 2.950 N/A GLU 20.A N HIS 17.A O no hydrogen 3.348 N/A CYS 22.A SG LEU 19.A O no hydrogen 3.988 N/A SER 23.A N GLU 2.A O no hydrogen 2.884 N/A SER 23.A OG LYS 49.A O no hydrogen 2.278 N/A VAL 24.A N GLU 2.A O no hydrogen 3.209 N/A ILE 25.A N MET 52.A O no hydrogen 2.839 N/A GLU 26.A N CYS 4.A O no hydrogen 2.690 N/A LEU 29.A N TYR 56.A O no hydrogen 2.804 N/A GLN 30.A N MET 7.A O no hydrogen 3.006 N/A ILE 31.A N LEU 58.A O no hydrogen 2.896 N/A LEU 32.A N ILE 9.A O no hydrogen 2.916 N/A LEU 33.A N PHE 60.A O no hydrogen 3.043 N/A THR 37.A OG1 TYR 63.A O no hydrogen 3.561 N/A ARG 38.A N ASP 41.A OD2 no hydrogen 3.185 N/A ASP 41.A N ARG 38.A O no hydrogen 2.820 N/A PHE 42.A N PRO 39.A O no hydrogen 3.058 N/A ARG 43.A N PRO 39.A O no hydrogen 3.038 N/A LEU 45.A N PHE 42.A O no hydrogen 2.997 N/A SER 46.A OG ASP 70.A O no hydrogen 2.703 N/A PHE 47.A N ASP 70.A O no hydrogen 3.396 N/A LYS 49.A NZ GLU 20.A O no hydrogen 3.174 N/A ILE 51.A N SER 23.A O no hydrogen 2.305 N/A ILE 53.A N VAL 77.A O no hydrogen 3.159 N/A THR 54.A OG1 GLY 27.A O no hydrogen 3.393 N/A ASP 55.A N GLY 27.A O no hydrogen 2.885 N/A LEU 57.A N ALA 86.A O no hydrogen 2.760 N/A LEU 58.A N LEU 29.A O no hydrogen 2.926 N/A LEU 59.A N VAL 88.A O no hydrogen 2.905 N/A PHE 60.A N ILE 31.A O no hydrogen 2.960 N/A ARG 61.A N PHE 90.A O no hydrogen 3.367 N/A ARG 61.A N GLU 91.A O no hydrogen 3.062 N/A ARG 61.A NE GLU 91.A OE1 no hydrogen 2.687 N/A ARG 61.A NH1 TYR 63.A OH no hydrogen 3.018 N/A TYR 63.A N MET 34.A O no hydrogen 2.745 N/A GLY 64.A N HIS 94.A ND1 no hydrogen 2.960 N/A SER 67.A OG GLU 66.A O no hydrogen 2.544 N/A SER 67.A OG GLU 97.A O no hydrogen 3.048 N/A SER 67.A OG GLU 97.A OE1 no hydrogen 3.123 N/A LEU 68.A N LEU 98.A O no hydrogen 3.330 N/A PHE 72.A N LEU 68.A O no hydrogen 3.133 N/A ASN 74.A ND2 PRO 48.A O no hydrogen 3.522 N/A THR 76.A N ILE 51.A O no hydrogen 2.877 N/A THR 76.A OG1 ASN 74.A O no hydrogen 3.002 N/A VAL 77.A N ILE 51.A O no hydrogen 3.260 N/A ARG 80.A NE ASP 55.A OD2 no hydrogen 3.099 N/A ARG 80.A NH2 ASP 55.A OD2 no hydrogen 3.165 N/A ARG 80.A NH2 TYR 268.A OH no hydrogen 3.428 N/A TYR 85.A OH ASP 135.A O no hydrogen 2.386 N/A ALA 86.A N SER 110.A O no hydrogen 2.374 N/A VAL 88.A N LEU 57.A O no hydrogen 2.942 N/A PHE 90.A N LEU 59.A O no hydrogen 2.952 N/A GLU 91.A N GLU 113.A O no hydrogen 2.739 N/A MET 92.A N ASN 115.A OD1 no hydrogen 2.564 N/A LYS 96.A N GLU 66.A O no hydrogen 2.691 N/A LYS 96.A NZ GLU 97.A OE2 no hydrogen 3.011 N/A GLU 97.A N SER 67.A OG no hydrogen 3.016 N/A LEU 103.A N LEU 100.A O no hydrogen 3.105 N/A MET 104.A N THR 76.A O no hydrogen 2.852 N/A ILE 106.A N ILE 129.A O no hydrogen 2.304 N/A ARG 108.A NH1 GLN 318.A OE1 no hydrogen 2.407 N/A ARG 108.A NH1 ASN 346.A OD1 no hydrogen 3.562 N/A LYS 114.A N LEU 140.A O no hydrogen 2.521 N/A LYS 114.A NZ GLU 91.A OE2 no hydrogen 2.373 N/A ASN 115.A N ASN 141.A OD1 no hydrogen 2.515 N/A ASN 115.A ND2 ILE 89.A O no hydrogen 2.416 N/A ASN 116.A N MET 92.A O no hydrogen 3.169 N/A CYS 119.A N LYS 96.A O no hydrogen 2.484 N/A ARG 128.A NE ARG 128.A O no hydrogen 2.474 N/A LEU 130.A N TRP 126.A O no hydrogen 3.106 N/A SER 132.A N ASP 131.A OD1 no hydrogen 2.670 N/A ASP 135.A N SER 132.A O no hydrogen 3.451 N/A ASN 136.A N VAL 133.A O no hydrogen 2.798 N/A ASN 141.A ND2 ILE 112.A O no hydrogen 2.616 N/A ASN 141.A ND2 VAL 139.A O no hydrogen 2.747 N/A LYS 142.A N ASN 115.A O no hydrogen 2.709 N/A LYS 142.A NZ GLU 147.A OE1 no hydrogen 3.503 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.533 N/A THR 155.A N CYS 152.A O no hydrogen 3.125 N/A THR 155.A OG1 CYS 152.A O no hydrogen 2.397 N/A GLY 158.A N THR 155.A O no hydrogen 3.175 N/A LYS 159.A N GLY 154.A O no hydrogen 2.658 N/A ASN 161.A N LYS 159.A O no hydrogen 2.896 N/A THR 165.A N VAL 172.A O no hydrogen 2.917 N/A ILE 167.A N GLN 170.A O no hydrogen 2.889 N/A GLN 170.A N ILE 167.A O no hydrogen 2.915 N/A VAL 172.A N THR 165.A O no hydrogen 2.914 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.718 N/A ARG 174.A N PRO 163.A O no hydrogen 3.350 N/A ARG 174.A NH1 THR 123.A O no hydrogen 3.190 N/A TRP 176.A N HIS 180.A O no hydrogen 3.291 N/A THR 177.A OG1 SER 179.A OG no hydrogen 3.245 N/A SER 179.A OG THR 177.A OG1 no hydrogen 3.245 N/A SER 179.A OG HIS 180.A ND1 no hydrogen 3.132 N/A GLN 182.A NE2 ASP 125.A OD1 no hydrogen 2.900 N/A LYS 183.A NZ GLY 207.A O no hydrogen 2.625 N/A LYS 190.A N PRO 186.A O no hydrogen 2.493 N/A HIS 192.A NE2 CYS 189.A O no hydrogen 3.110 N/A GLY 193.A N HIS 192.A ND1 no hydrogen 2.881 N/A CYS 194.A SG THR 160.A O no hydrogen 4.019 N/A CYS 194.A SG ASN 161.A O no hydrogen 3.294 N/A THR 195.A OG1 CYS 194.A O no hydrogen 2.494 N/A THR 195.A OG1 LEU 199.A O no hydrogen 2.569 N/A THR 195.A OG1 CYS 209.A O no hydrogen 2.555 N/A ALA 196.A N CYS 209.A O no hydrogen 3.225 N/A LEU 199.A N CYS 194.A O no hydrogen 3.193 N/A CYS 200.A SG CYS 201.A O no hydrogen 3.082 N/A HIS 202.A ND1 PRO 212.A O no hydrogen 2.535 N/A CYS 205.A SG HIS 202.A O no hydrogen 3.456 N/A ASN 208.A ND2 GLN 182.A O no hydrogen 2.595 N/A CYS 209.A SG CYS 200.A O no hydrogen 2.968 N/A SER 210.A N LYS 217.A O no hydrogen 3.069 N/A SER 210.A OG LYS 217.A O no hydrogen 3.225 N/A ASP 214.A N GLN 211.A OE1 no hydrogen 2.449 N/A THR 216.A OG1 ASP 214.A OD2 no hydrogen 3.029 N/A CYS 218.A N PRO 215.A O no hydrogen 3.029 N/A CYS 218.A SG HIS 202.A ND1 no hydrogen 3.373 N/A CYS 218.A SG GLN 211.A O no hydrogen 3.636 N/A CYS 218.A SG PRO 212.A O no hydrogen 4.034 N/A CYS 218.A SG ASP 214.A O no hydrogen 3.923 N/A ARG 222.A N GLU 204.A O no hydrogen 2.474 N/A ARG 222.A NE ASN 223.A OD1 no hydrogen 2.972 N/A ASN 223.A N GLU 204.A OE2 no hydrogen 3.204 N/A PHE 224.A N GLU 204.A OE2 no hydrogen 2.939 N/A ARG 229.A N LEU 226.A O no hydrogen 3.018 N/A CYS 230.A SG ALA 220.A O no hydrogen 3.092 N/A VAL 231.A N PHE 224.A O no hydrogen 3.065 N/A THR 233.A OG1 GLU 232.A O no hydrogen 2.568 N/A CYS 234.A SG ARG 243.A O no hydrogen 3.010 N/A ARG 243.A NH2 ASP 227.A OD1 no hydrogen 3.332 N/A SER 248.A OG ASP 252.A OD1 no hydrogen 3.529 N/A PHE 249.A N ASN 246.A OD1 no hydrogen 2.705 N/A CYS 250.A N ASN 246.A O no hydrogen 3.463 N/A CYS 250.A SG ASN 246.A O no hydrogen 3.956 N/A GLN 251.A N PHE 247.A O no hydrogen 2.982 N/A ASP 252.A N SER 248.A O no hydrogen 2.486 N/A LEU 253.A N PHE 249.A O no hydrogen 2.896 N/A HIS 254.A N CYS 250.A O no hydrogen 2.885 N/A HIS 255.A N GLN 251.A O no hydrogen 2.881 N/A LYS 256.A N ASP 252.A O no hydrogen 2.894 N/A CYS 257.A SG GLU 26.A OE1 no hydrogen 3.647 N/A CYS 257.A SG GLU 26.A OE2 no hydrogen 3.336 N/A CYS 257.A SG HIS 266.A O no hydrogen 4.038 N/A LYS 258.A N HIS 254.A O no hydrogen 2.895 N/A ASN 259.A N HIS 255.A O no hydrogen 2.935 N/A SER 260.A N LYS 256.A O no hydrogen 3.015 N/A SER 260.A OG LYS 256.A O no hydrogen 3.136 N/A ARG 262.A NE GLY 6.A O no hydrogen 2.763 N/A ARG 262.A NH2 GLY 6.A O no hydrogen 2.542 N/A CYS 265.A SG ARG 262.A O no hydrogen 3.786 N/A VAL 269.A N ILE 276.A O no hydrogen 2.882 N/A ILE 270.A N LEU 290.A O no hydrogen 2.961 N/A HIS 271.A N LYS 274.A O no hydrogen 2.860 N/A LYS 274.A N HIS 271.A O no hydrogen 2.873 N/A CYS 279.A N GLU 278.A OE1 no hydrogen 2.939 N/A CYS 279.A SG THR 284.A O no hydrogen 3.806 N/A TYR 283.A N PRO 280.A O no hydrogen 3.147 N/A THR 284.A N THR 293.A O no hydrogen 3.106 N/A MET 285.A N THR 284.A OG1 no hydrogen 2.616 N/A SER 287.A OG ASN 286.A O no hydrogen 2.478 N/A SER 288.A N SER 287.A OG no hydrogen 2.661 N/A SER 288.A OG SER 287.A O no hydrogen 2.556 N/A SER 288.A OG ASN 289.A OD1 no hydrogen 3.188 N/A LEU 290.A N SER 287.A O no hydrogen 2.916 N/A CYS 292.A N ILE 270.A O no hydrogen 2.525 N/A CYS 292.A SG ILE 270.A O no hydrogen 3.264 N/A CYS 299.A SG GLY 297.A O no hydrogen 3.751 N/A LYS 301.A N THR 324.A OG1 no hydrogen 2.370 N/A CYS 303.A N VAL 325.A O no hydrogen 2.846 N/A CYS 303.A SG GLU 319.A O no hydrogen 3.169 N/A CYS 303.A SG LEU 320.A O no hydrogen 3.405 N/A GLU 307.A N GLU 307.A OE1 no hydrogen 2.903 N/A LYS 310.A NZ GLU 319.A OE1 no hydrogen 2.464 N/A THR 311.A OG1 GLU 309.A O no hydrogen 3.500 N/A ILE 312.A N ILE 330.A O no hydrogen 2.547 N/A ASP 313.A N THR 311.A O no hydrogen 2.993 N/A VAL 314.A N PHE 83.A O no hydrogen 3.114 N/A THR 315.A N PHE 83.A O no hydrogen 2.689 N/A THR 315.A OG1 LEU 81.A O no hydrogen 2.333 N/A GLN 318.A N VAL 314.A O no hydrogen 2.874 N/A GLU 319.A N THR 315.A O no hydrogen 2.805 N/A LEU 320.A N SER 316.A O no hydrogen 2.956 N/A ARG 321.A N GLN 318.A O no hydrogen 2.929 N/A CYS 323.A N LEU 320.A O no hydrogen 3.258 N/A THR 324.A OG1 LYS 301.A O no hydrogen 3.235 N/A VAL 325.A N LYS 301.A O no hydrogen 2.522 N/A ILE 326.A N GLU 352.A O no hydrogen 2.881 N/A ASN 327.A N CYS 303.A O no hydrogen 2.916 N/A LEU 329.A N TYR 356.A O no hydrogen 2.787 N/A ILE 331.A N LYS 358.A O no hydrogen 2.876 N/A ASN 332.A N ILE 312.A O no hydrogen 3.004 N/A ASN 332.A ND2 ARG 360.A O no hydrogen 2.795 N/A ARG 334.A NE ASN 332.A O no hydrogen 2.508 N/A LEU 339.A N ASN 337.A O no hydrogen 2.876 N/A ALA 340.A N ASN 338.A OD1 no hydrogen 3.154 N/A LEU 343.A N LEU 339.A O no hydrogen 3.187 N/A GLU 344.A N ALA 340.A O no hydrogen 2.926 N/A ALA 345.A N ALA 341.A O no hydrogen 3.115 N/A ASN 346.A N GLU 342.A O no hydrogen 2.904 N/A ASN 346.A N LEU 343.A O no hydrogen 2.892 N/A LEU 347.A N LEU 343.A O no hydrogen 2.393 N/A GLY 348.A N GLU 344.A O no hydrogen 2.707 N/A ILE 350.A N LEU 347.A O no hydrogen 2.770 N/A GLU 351.A N THR 324.A O no hydrogen 2.753 N/A SER 354.A N ILE 326.A O no hydrogen 2.763 N/A SER 354.A OG ILE 326.A O no hydrogen 3.409 N/A SER 354.A OG ASN 327.A OD1 no hydrogen 3.268 N/A GLY 355.A N GLY 328.A O no hydrogen 3.216 N/A LEU 357.A N SER 388.A O no hydrogen 2.921 N/A LYS 358.A N LEU 329.A O no hydrogen 2.873 N/A LYS 358.A NZ GLU 383.A OE2 no hydrogen 2.530 N/A ILE 359.A N TYR 390.A O no hydrogen 2.832 N/A ARG 360.A N ILE 331.A O no hydrogen 2.980 N/A ARG 361.A N LEU 392.A O no hydrogen 3.121 N/A SER 362.A OG ILE 331.A O no hydrogen 3.198 N/A SER 362.A OG ARG 360.A O no hydrogen 3.351 N/A TYR 363.A N ILE 333.A O no hydrogen 3.033 N/A SER 367.A OG SER 369.A OG no hydrogen 3.104 N/A SER 367.A OG GLN 399.A OE1 no hydrogen 3.366 N/A LEU 368.A N GLN 399.A O no hydrogen 3.415 N/A SER 369.A N SER 367.A OG no hydrogen 3.280 N/A SER 369.A OG SER 367.A OG no hydrogen 3.104 N/A PHE 371.A N LEU 368.A O no hydrogen 3.521 N/A ARG 372.A NE GLU 344.A OE2 no hydrogen 2.367 N/A ARG 372.A NH2 GLU 344.A OE2 no hydrogen 2.999 N/A LEU 374.A N PHE 371.A O no hydrogen 3.184 N/A ARG 375.A NH1 ARG 375.A O no hydrogen 2.285 N/A ARG 375.A NH1 THR 409.A OG1 no hydrogen 2.601 N/A ILE 377.A N THR 409.A O no hydrogen 3.314 N/A ARG 378.A N ILE 353.A O no hydrogen 2.637 N/A ARG 378.A NE GLU 380.A OE2 no hydrogen 2.643 N/A ARG 378.A NH2 GLU 380.A OE2 no hydrogen 2.766 N/A GLY 379.A N GLY 355.A O no hydrogen 2.988 N/A GLU 380.A N SER 354.A O no hydrogen 2.346 N/A ASN 386.A N GLU 383.A O no hydrogen 2.707 N/A SER 388.A OG LYS 414.A O no hydrogen 2.804 N/A PHE 389.A N LYS 414.A O no hydrogen 2.731 N/A ALA 391.A N PHE 416.A O no hydrogen 2.510 N/A LEU 392.A N ILE 359.A O no hydrogen 2.958 N/A ASN 394.A N TYR 419.A O no hydrogen 3.259 N/A ASN 394.A ND2 ILE 359.A O no hydrogen 2.791 N/A GLN 395.A NE2 ASP 393.A OD1 no hydrogen 2.223 N/A ASN 396.A ND2 TYR 363.A O no hydrogen 2.577 N/A LYS 405.A N ASP 402.A O no hydrogen 3.405 N/A LYS 405.A NZ ASP 402.A OD2 no hydrogen 2.790 N/A LYS 405.A NZ SER 404.A OG no hydrogen 2.720 N/A THR 409.A OG1 ARG 375.A O no hydrogen 3.317 N/A THR 411.A N ILE 377.A O no hydrogen 3.279 N/A LYS 414.A N ASN 386.A O no hydrogen 2.709 N/A LYS 414.A NZ GLU 441.A OE1 no hydrogen 2.776 N/A LEU 415.A N ASP 444.A OD1 no hydrogen 3.144 N/A PHE 417.A N ASP 444.A O no hydrogen 2.733 N/A HIS 418.A N ALA 391.A O no hydrogen 3.116 N/A ASN 420.A N ASN 450.A OD1 no hydrogen 3.206 N/A LEU 423.A N ASN 420.A O no hydrogen 3.243 N/A CYS 424.A SG ARG 398.A O no hydrogen 3.841 N/A CYS 424.A SG SER 455.A O no hydrogen 3.250 N/A GLU 427.A N CYS 424.A O no hydrogen 2.799 N/A ILE 428.A N CYS 424.A O no hydrogen 3.440 N/A HIS 429.A N LEU 425.A O no hydrogen 2.910 N/A LYS 430.A N GLU 427.A O no hydrogen 2.973 N/A LYS 430.A NZ TRP 401.A O no hydrogen 3.339 N/A LYS 430.A NZ GLU 427.A OE1 no hydrogen 2.654 N/A MET 431.A N GLU 427.A O no hydrogen 3.162 N/A MET 431.A N ILE 428.A O no hydrogen 3.339 N/A SER 434.A OG MET 431.A O no hydrogen 3.338 N/A THR 436.A OG1 MET 431.A O no hydrogen 3.277 N/A ARG 439.A NE THR 436.A O no hydrogen 3.066 N/A ARG 439.A NH2 ASP 444.A OD1 no hydrogen 3.023 N/A ALA 446.A N PHE 417.A O no hydrogen 2.728 N/A THR 449.A OG1 ASP 452.A OD2 no hydrogen 3.370 N/A ASN 450.A N LEU 447.A O no hydrogen 3.369 N/A ASN 450.A ND2 PHE 417.A O no hydrogen 3.262 N/A GLY 451.A N ASN 420.A O no hydrogen 2.621 N/A ASP 452.A N PRO 421.A O no hydrogen 2.345 N/A GLN 453.A N PRO 421.A O no hydrogen 2.951 N/A SER 455.A OG GLU 457.A OE1 no hydrogen 2.818 N/A GLU 457.A N GLU 457.A OE1 no hydrogen 2.791 N/A LEU 461.A N LYS 568.A O no hydrogen 2.826 N/A LYS 462.A NZ LEU 460.A O no hydrogen 3.412 N/A SER 464.A N ARG 476.A O no hydrogen 3.357 N/A SER 464.A OG ARG 476.A O no hydrogen 2.730 N/A TYR 465.A N ARG 476.A O no hydrogen 2.902 N/A ARG 467.A N LEU 474.A O no hydrogen 2.931 N/A THR 468.A OG1 THR 468.A O no hydrogen 2.556 N/A LEU 474.A N ARG 467.A O no hydrogen 2.871 N/A LEU 475.A N TRP 539.A O no hydrogen 2.870 N/A ARG 476.A N TYR 465.A O no hydrogen 2.893 N/A ARG 486.A N ASP 484.A OD1 no hydrogen 3.137 N/A ASP 487.A N ASP 484.A O no hydrogen 2.979 N/A LEU 489.A N LEU 555.A O no hydrogen 2.919 N/A PHE 491.A N ILE 522.A O no hydrogen 2.837 N/A MET 492.A N LYS 553.A O no hydrogen 2.318 N/A LEU 493.A N VAL 520.A O no hydrogen 2.910 N/A PHE 494.A N PHE 551.A O no hydrogen 3.051 N/A TYR 495.A N THR 518.A O no hydrogen 2.933 N/A LYS 496.A N ALA 549.A O no hydrogen 3.352 N/A LYS 496.A NZ GLU 497.A O no hydrogen 3.443 N/A ASN 502.A N TYR 500.A O no hydrogen 2.933 N/A THR 504.A N ASP 507.A OD1 no hydrogen 3.365 N/A THR 504.A OG1 GLU 505.A OE1 no hydrogen 2.334 N/A GLU 505.A N THR 504.A OG1 no hydrogen 2.576 N/A GLU 505.A N GLU 505.A OE1 no hydrogen 2.681 N/A SER 514.A OG ASP 510.A OD2 no hydrogen 3.196 N/A SER 516.A OG ASP 507.A O no hydrogen 3.194 N/A SER 516.A OG GLY 508.A O no hydrogen 3.207 N/A TRP 517.A N ASN 515.A OD1 no hydrogen 3.254 N/A THR 518.A N TYR 495.A O no hydrogen 2.920 N/A VAL 520.A N LEU 493.A O no hydrogen 2.953 N/A ILE 522.A N PHE 491.A O no hydrogen 2.920 N/A SER 528.A OG ASP 530.A O no hydrogen 3.203 N/A SER 528.A OG ASP 530.A OD1 no hydrogen 2.602 N/A SER 528.A OG SER 533.A O no hydrogen 3.462 N/A LYS 532.A NZ SER 533.A OG no hydrogen 3.383 N/A TRP 539.A N LEU 475.A O no hydrogen 2.950 N/A MET 541.A N ILE 473.A O no hydrogen 3.055 N/A TYR 548.A N VAL 574.A O no hydrogen 2.931 N/A ILE 550.A N ILE 572.A O no hydrogen 2.928 N/A PHE 551.A N PHE 494.A O no hydrogen 2.846 N/A LYS 553.A N MET 492.A O no hydrogen 2.719 N/A THR 554.A N ALA 567.A O no hydrogen 3.066 N/A THR 554.A OG1 ALA 567.A O no hydrogen 2.724 N/A ARG 562.A N SER 559.A O no hydrogen 3.423 N/A ARG 562.A NH1 ASP 484.A OD2 no hydrogen 3.097 N/A ARG 562.A NH1 ASP 487.A OD2 no hydrogen 3.455 N/A THR 564.A OG1 ASP 487.A OD2 no hydrogen 3.430 N/A ALA 567.A N THR 554.A OG1 no hydrogen 2.339 N/A LYS 568.A N GLU 459.A O no hydrogen 2.745 N/A LYS 568.A NZ VAL 552.A O no hydrogen 2.525 N/A LYS 568.A NZ SER 569.A O no hydrogen 2.209 N/A SER 569.A N VAL 552.A O no hydrogen 2.618 N/A ILE 572.A N ILE 550.A O no hydrogen 2.872 N/A TYR 573.A OH TYR 500.A O no hydrogen 2.427 N/A VAL 574.A N TYR 548.A O no hydrogen 2.870 N/A GLN 575.A NE2 TRP 545.A O no hydrogen 2.338 N/A THR 576.A OG1 THR 468.A O no hydrogen 3.308 N/A THR 576.A OG1 PHE 470.A O no hydrogen 2.456 N/A ASP 577.A N THR 576.A OG1 no hydrogen 2.722 N/A ALA 578.A N ASP 577.A OD1 no hydrogen 2.752 N/A SER 582.A OG VAL 583.A O no hydrogen 3.536 N/A LEU 585.A N LYS 602.A O no hydrogen 2.993 N/A ILE 588.A N LYS 600.A O no hydrogen 2.880 N/A VAL 590.A N ILE 598.A O no hydrogen 2.908 N/A ASN 592.A ND2 GLN 596.A OE1 no hydrogen 2.478 N/A SER 593.A N GLN 596.A O no hydrogen 3.250 N/A SER 594.A OG MET 708.A O no hydrogen 2.858 N/A SER 595.A N SER 593.A OG no hydrogen 2.992 N/A SER 595.A OG SER 595.A O no hydrogen 2.503 N/A SER 595.A OG LEU 676.A O no hydrogen 3.015 N/A ILE 597.A N ILE 673.A O no hydrogen 2.865 N/A ILE 598.A N VAL 590.A O no hydrogen 2.856 N/A LEU 599.A N LEU 671.A O no hydrogen 2.878 N/A LYS 600.A N ILE 588.A O no hydrogen 2.918 N/A TRP 601.A N GLU 669.A O no hydrogen 2.959 N/A LYS 602.A NZ ASP 586.A O no hydrogen 2.964 N/A TYR 613.A N VAL 665.A O no hydrogen 2.871 N/A LEU 614.A N GLN 687.A O no hydrogen 2.856 N/A PHE 616.A N GLU 685.A O no hydrogen 2.878 N/A TRP 617.A N PRO 661.A O no hydrogen 2.946 N/A GLU 618.A N ARG 683.A O no hydrogen 2.900 N/A ARG 619.A NH2 GLU 622.A OE2 no hydrogen 3.508 N/A GLN 620.A N GLY 681.A O no hydrogen 2.944 N/A PHE 627.A N SER 624.A O no hydrogen 2.910 N/A GLU 628.A N GLU 625.A O no hydrogen 3.287 N/A LEU 629.A N GLU 625.A O no hydrogen 3.008 N/A TYR 631.A OH LEU 626.A O no hydrogen 3.164 N/A CYS 632.A N ASP 630.A OD1 no hydrogen 3.207 N/A GLN 636.A N THR 633.A O no hydrogen 3.206 N/A ILE 637.A N THR 633.A O no hydrogen 3.184 N/A LEU 638.A N ASP 634.A O no hydrogen 2.928 N/A GLU 640.A N GLN 636.A O no hydrogen 2.882 N/A LEU 641.A N ILE 637.A O no hydrogen 2.935 N/A GLU 642.A N LEU 638.A O no hydrogen 2.967 N/A GLU 643.A N LYS 639.A O no hydrogen 2.902 N/A GLU 643.A N GLU 643.A OE1 no hydrogen 3.052 N/A SER 644.A N GLU 640.A O no hydrogen 2.893 N/A SER 644.A OG GLU 640.A O no hydrogen 3.298 N/A SER 644.A OG LEU 641.A O no hydrogen 2.577 N/A SER 645.A N LEU 641.A O no hydrogen 2.929 N/A SER 645.A OG LEU 641.A O no hydrogen 2.898 N/A PHE 646.A N GLU 642.A O no hydrogen 2.838 N/A ARG 647.A N GLU 643.A O no hydrogen 2.833 N/A ARG 647.A NH2 GLU 651.A OE1 no hydrogen 3.429 N/A LYS 648.A N SER 644.A O no hydrogen 3.003 N/A LYS 648.A NZ ASP 652.A OD1 no hydrogen 3.495 N/A THR 649.A N SER 645.A O no hydrogen 2.881 N/A THR 649.A OG1 SER 645.A O no hydrogen 3.053 N/A THR 649.A OG1 PHE 646.A O no hydrogen 2.752 N/A PHE 650.A N PHE 646.A O no hydrogen 2.829 N/A GLU 651.A N ARG 647.A O no hydrogen 2.938 N/A ASP 652.A N LYS 648.A O no hydrogen 2.936 N/A TYR 653.A N THR 649.A O no hydrogen 2.768 N/A LEU 654.A N PHE 650.A O no hydrogen 2.850 N/A HIS 655.A N GLU 651.A O no hydrogen 2.940 N/A ASN 656.A N ASP 652.A O no hydrogen 2.846 N/A VAL 657.A N TYR 653.A O no hydrogen 2.914 N/A VAL 658.A N LEU 654.A O no hydrogen 2.923 N/A VAL 658.A N HIS 655.A O no hydrogen 3.123 N/A PHE 659.A N HIS 655.A O no hydrogen 2.791 N/A GLU 663.A N VAL 615.A O no hydrogen 2.875 N/A LYS 664.A N GLU 663.A OE1 no hydrogen 2.519 N/A VAL 665.A N TYR 613.A O no hydrogen 2.964 N/A LEU 671.A N LEU 599.A O no hydrogen 2.881 N/A ILE 673.A N ILE 597.A O no hydrogen 2.881 N/A LEU 676.A N SER 595.A OG no hydrogen 2.706 N/A HIS 678.A NE2 PRO 740.A O no hydrogen 2.974 N/A THR 680.A OG1 GLU 622.A OE2 no hydrogen 3.025 N/A TYR 682.A N ALA 705.A O no hydrogen 2.890 N/A ARG 683.A N GLU 618.A O no hydrogen 2.853 N/A ILE 684.A N VAL 703.A O no hydrogen 2.834 N/A GLU 685.A N PHE 616.A O no hydrogen 2.850 N/A LEU 686.A N ALA 701.A O no hydrogen 2.870 N/A GLN 687.A N LEU 614.A O no hydrogen 2.944 N/A CYS 689.A N HIS 612.A O no hydrogen 2.922 N/A CYS 689.A SG GLN 687.A O no hydrogen 3.061 N/A ASN 690.A ND2 THR 579.A O no hydrogen 2.444 N/A GLN 691.A N ARG 696.A O no hydrogen 3.492 N/A ARG 696.A N GLN 691.A O no hydrogen 3.007 N/A ARG 696.A NH1 ASN 690.A OD1 no hydrogen 3.359 N/A ARG 696.A NH1 GLN 691.A OE1 no hydrogen 2.436 N/A CYS 697.A SG GLN 687.A OE1 no hydrogen 3.428 N/A CYS 697.A SG GLU 695.A OE1 no hydrogen 2.858 N/A CYS 697.A SG GLU 695.A OE2 no hydrogen 3.206 N/A SER 698.A N ALA 688.A O no hydrogen 2.761 N/A SER 698.A OG SER 582.A O no hydrogen 2.627 N/A SER 698.A OG ALA 688.A O no hydrogen 2.853 N/A SER 698.A OG VAL 699.A O no hydrogen 3.110 N/A ALA 701.A N LEU 686.A O no hydrogen 2.910 N/A VAL 703.A N ILE 684.A O no hydrogen 2.901 N/A SER 704.A OG TYR 682.A O no hydrogen 3.525 N/A SER 704.A OG VAL 703.A O no hydrogen 2.638 N/A ALA 705.A N TYR 682.A O no hydrogen 2.923 N/A THR 707.A N THR 680.A O no hydrogen 3.274 N/A THR 707.A OG1 SER 594.A O no hydrogen 3.325 N/A THR 707.A OG1 ARG 677.A O no hydrogen 2.276 N/A THR 707.A OG1 HIS 678.A O no hydrogen 2.652 N/A GLU 710.A N ASN 741.A OD1 no hydrogen 2.488 N/A ALA 713.A N GLU 710.A O no hydrogen 3.117 N/A ASP 714.A N ALA 711.A O no hydrogen 2.917 N/A ASP 715.A N LYS 712.A O no hydrogen 3.387 N/A THR 721.A N MET 733.A O no hydrogen 2.920 N/A THR 721.A OG1 MET 733.A O no hydrogen 2.970 N/A GLU 723.A N HIS 731.A O no hydrogen 2.893 N/A PHE 725.A N VAL 729.A O no hydrogen 2.908 N/A VAL 730.A N LEU 776.A O no hydrogen 2.924 N/A HIS 731.A N GLU 723.A O no hydrogen 2.893 N/A HIS 731.A NE2 GLU 771.A O no hydrogen 3.103 N/A LEU 732.A N CYS 774.A O no hydrogen 2.872 N/A MET 733.A N THR 721.A O no hydrogen 2.896 N/A GLN 735.A NE2 GLU 736.A O no hydrogen 2.768 N/A ASN 741.A N ASP 714.A OD1 no hydrogen 2.862 N/A ASN 741.A ND2 GLU 710.A O no hydrogen 2.307 N/A ASN 741.A ND2 ASP 714.A OD1 no hydrogen 2.686 N/A ASN 741.A ND2 ASP 714.A OD2 no hydrogen 3.058 N/A LEU 743.A N ASN 741.A O no hydrogen 3.049 N/A VAL 745.A N THR 791.A O no hydrogen 2.905 N/A LEU 746.A N THR 791.A O no hydrogen 3.330 N/A TYR 747.A N VAL 763.A O no hydrogen 2.871 N/A GLU 748.A N ARG 789.A O no hydrogen 2.856 N/A VAL 749.A N LEU 761.A O no hydrogen 2.908 N/A SER 750.A N ARG 787.A O no hydrogen 2.878 N/A SER 750.A OG GLU 758.A OE2 no hydrogen 2.303 N/A SER 750.A OG HIS 760.A ND1 no hydrogen 3.243 N/A TYR 751.A N LEU 759.A O no hydrogen 2.926 N/A ARG 752.A N SER 785.A O no hydrogen 2.988 N/A ARG 752.A NE ASP 756.A O no hydrogen 3.202 N/A ARG 753.A NE ASP 756.A OD2 no hydrogen 2.365 N/A ARG 753.A NH1 PRO 781.A O no hydrogen 3.085 N/A TYR 754.A N ASN 783.A O no hydrogen 2.992 N/A ASP 756.A N ARG 753.A O no hydrogen 3.011 N/A LEU 759.A N TYR 751.A O no hydrogen 2.886 N/A LEU 761.A N VAL 749.A O no hydrogen 2.878 N/A VAL 763.A N TYR 747.A O no hydrogen 2.915 N/A SER 764.A OG ASP 630.A OD1 no hydrogen 3.445 N/A ARG 765.A N VAL 745.A O no hydrogen 3.047 N/A ARG 765.A NH1 GLU 736.A OE2 no hydrogen 3.211 N/A ARG 765.A NH2 GLU 736.A OE2 no hydrogen 2.814 N/A LYS 766.A NZ GLU 628.A O no hydrogen 3.247 N/A HIS 767.A N SER 764.A OG no hydrogen 2.965 N/A PHE 768.A N SER 764.A O no hydrogen 2.577 N/A ALA 769.A N ARG 765.A O no hydrogen 2.908 N/A LEU 770.A N LYS 766.A O no hydrogen 2.893 N/A GLU 771.A N HIS 767.A O no hydrogen 3.108 N/A GLY 773.A N PHE 768.A O no hydrogen 3.211 N/A CYS 774.A N LEU 732.A O no hydrogen 2.935 N/A ARG 775.A N GLU 771.A OE1 no hydrogen 3.336 N/A LEU 776.A N VAL 730.A O no hydrogen 2.872 N/A SER 780.A OG TYR 784.A OH no hydrogen 2.265 N/A GLY 782.A N VAL 807.A O no hydrogen 2.930 N/A TYR 784.A N PHE 805.A O no hydrogen 2.887 N/A TYR 784.A OH SER 780.A O no hydrogen 2.668 N/A SER 785.A N ARG 752.A O no hydrogen 3.103 N/A SER 785.A OG ARG 752.A O no hydrogen 3.401 N/A VAL 786.A N THR 803.A O no hydrogen 2.881 N/A ARG 787.A N SER 750.A O no hydrogen 2.871 N/A ARG 787.A NE THR 800.A O no hydrogen 2.683 N/A ARG 787.A NH2 THR 800.A O no hydrogen 2.941 N/A ILE 788.A N THR 800.A OG1 no hydrogen 3.356 N/A ARG 789.A N GLU 748.A O no hydrogen 2.885 N/A ARG 789.A NE GLU 748.A OE1 no hydrogen 3.102 N/A ARG 789.A NH2 GLU 748.A OE1 no hydrogen 2.601 N/A THR 791.A N LEU 746.A O no hydrogen 2.977 N/A THR 791.A OG1 ASN 796.A OD1 no hydrogen 2.633 N/A SER 792.A N GLY 795.A O no hydrogen 2.887 N/A SER 792.A OG ASP 714.A OD2 no hydrogen 2.506 N/A LEU 793.A N LEU 743.A O no hydrogen 3.020 N/A GLY 797.A N ALA 790.A O no hydrogen 2.683 N/A SER 798.A OG ASP 715.A OD1 no hydrogen 2.974 N/A SER 798.A OG ASP 715.A OD2 no hydrogen 2.907 N/A THR 800.A N ILE 788.A O no hydrogen 3.136 N/A THR 800.A OG1 ILE 788.A O no hydrogen 3.182 N/A THR 803.A N VAL 786.A O no hydrogen 2.910 N/A THR 803.A OG1 VAL 720.A O no hydrogen 3.429 N/A PHE 805.A N TYR 784.A O no hydrogen 2.927 N/A VAL 807.A N GLY 782.A O no hydrogen 2.874 N/A