Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8kg9_M.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A N THR 120.A O no hydrogen 3.079 N/A SER 5.A OG ALA 3.A O no hydrogen 3.378 N/A SER 5.A OG THR 26.A O no hydrogen 2.283 N/A SER 15.A OG ASP 14.A OD2 no hydrogen 3.463 N/A GLY 16.A N ASP 14.A OD2 no hydrogen 2.745 N/A PHE 24.A N VAL 9.A O no hydrogen 3.079 N/A ILE 27.A N VAL 31.A O no hydrogen 3.145 N/A ILE 34.A N ASN 33.A OD1 no hydrogen 2.713 N/A THR 35.A OG1 ILE 34.A O no hydrogen 3.265 N/A ILE 38.A N GLY 19.A O no hydrogen 2.358 N/A LYS 45.A NZ ASN 96.A OD1 no hydrogen 2.715 N/A THR 50.A N LYS 47.A O no hydrogen 3.348 N/A THR 50.A OG1 PHE 46.A O no hydrogen 2.478 N/A LEU 53.A N GLN 49.A O no hydrogen 3.288 N/A GLN 54.A N THR 50.A O no hydrogen 2.689 N/A LYS 57.A NZ LYS 55.A O no hydrogen 2.665 N/A LYS 63.A NZ ASN 328.A O no hydrogen 2.879 N/A LYS 63.A NZ ASN 328.A OD1 no hydrogen 3.269 N/A SER 64.A OG LEU 60.A O no hydrogen 2.570 N/A ASN 70.A N ASN 76.A OD1 no hydrogen 2.977 N/A ASN 76.A N LYS 73.A O no hydrogen 3.234 N/A ASN 76.A ND2 ASN 70.A O no hydrogen 2.871 N/A SER 79.A OG LYS 40.A O no hydrogen 3.069 N/A VAL 80.A N LYS 40.A O no hydrogen 3.005 N/A PHE 81.A N ILE 56.A O no hydrogen 2.962 N/A LYS 85.A NZ GLU 86.A O no hydrogen 2.761 N/A GLU 86.A N GLU 86.A OE2 no hydrogen 2.699 N/A ASN 96.A N ASP 94.A OD1 no hydrogen 2.840 N/A GLY 99.A N SER 90.A O no hydrogen 2.838 N/A GLU 102.A N GLY 343.A O no hydrogen 3.043 N/A THR 104.A OG1 LEU 331.A O no hydrogen 2.666 N/A ALA 111.A N PRO 107.A O no hydrogen 2.598 N/A ILE 112.A N HIS 108.A O no hydrogen 2.638 N/A MET 113.A N GLN 109.A O no hydrogen 3.213 N/A ASP 114.A N ARG 110.A O no hydrogen 2.713 N/A LEU 115.A N ALA 111.A O no hydrogen 2.500 N/A GLY 116.A N ILE 112.A O no hydrogen 2.714 N/A THR 120.A N SER 5.A O no hydrogen 2.810 N/A THR 120.A OG1 SER 5.A O no hydrogen 3.315 N/A SER 123.A OG LEU 122.A O no hydrogen 2.762 N/A SER 126.A OG SER 126.A O no hydrogen 2.573 N/A GLY 130.A N LEU 234.A O no hydrogen 2.535 N/A TYR 131.A OH SER 285.A OG no hydrogen 2.899 N/A HIS 134.A N SER 239.A OG no hydrogen 2.991 N/A SER 138.A OG VAL 265.A O no hydrogen 3.451 N/A SER 138.A OG LEU 267.A O no hydrogen 3.412 N/A SER 145.A N LEU 133.A O no hydrogen 3.108 N/A SER 145.A OG ILE 154.A O no hydrogen 3.356 N/A LEU 146.A N THR 155.A O no hydrogen 3.131 N/A SER 149.A OG ILE 129.A O no hydrogen 2.785 N/A ASP 152.A N LYS 148.A O no hydrogen 2.886 N/A THR 153.A OG1 THR 155.A OG1 no hydrogen 2.943 N/A ILE 154.A N ASN 202.A OD1 no hydrogen 3.260 N/A THR 155.A N GLU 204.A OE2 no hydrogen 2.892 N/A THR 155.A OG1 THR 153.A OG1 no hydrogen 2.943 N/A GLN 164.A NE2 ALA 165.A O no hydrogen 3.639 N/A GLY 174.A N ALA 170.A O no hydrogen 2.902 N/A GLN 175.A N SER 171.A O no hydrogen 2.931 N/A ILE 176.A N SER 172.A O no hydrogen 2.959 N/A TYR 177.A N LEU 173.A O no hydrogen 2.801 N/A TYR 177.A OH LEU 279.A O no hydrogen 2.568 N/A LYS 178.A N GLY 174.A O no hydrogen 2.934 N/A GLN 179.A N GLN 175.A O no hydrogen 2.912 N/A GLN 179.A NE2 ILE 176.A O no hydrogen 3.264 N/A MET 180.A N ILE 176.A O no hydrogen 2.952 N/A PHE 181.A N TYR 177.A O no hydrogen 2.867 N/A GLU 182.A N LYS 178.A O no hydrogen 2.940 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 3.134 N/A LYS 183.A N GLN 179.A O no hydrogen 2.920 N/A LYS 184.A N MET 180.A O no hydrogen 2.425 N/A LYS 185.A N GLU 182.A O no hydrogen 3.403 N/A GLU 189.A N LYS 185.A O no hydrogen 3.017 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.842 N/A THR 190.A OG1 LYS 187.A O no hydrogen 2.310 N/A TYR 191.A N LYS 187.A O no hydrogen 2.912 N/A SER 192.A N ILE 188.A O no hydrogen 2.297 N/A SER 192.A OG ILE 188.A O no hydrogen 2.770 N/A ASP 196.A N ASP 128.A OD1 no hydrogen 2.892 N/A PHE 208.A N LYS 160.A O no hydrogen 2.918 N/A SER 212.A N ASP 210.A OD1 no hydrogen 3.339 N/A TYR 215.A N ILE 211.A O no hydrogen 2.898 N/A ARG 216.A N SER 212.A O no hydrogen 2.907 N/A ARG 216.A NE SER 212.A O no hydrogen 2.413 N/A ARG 217.A N LYS 213.A O no hydrogen 2.885 N/A LEU 218.A N LEU 214.A O no hydrogen 2.929 N/A SER 219.A N TYR 215.A O no hydrogen 2.886 N/A SER 219.A OG TYR 215.A O no hydrogen 3.539 N/A SER 219.A OG ARG 216.A O no hydrogen 2.399 N/A GLN 220.A N ARG 216.A O no hydrogen 2.910 N/A GLU 221.A N ARG 217.A O no hydrogen 2.854 N/A THR 222.A N LEU 218.A O no hydrogen 2.889 N/A THR 222.A OG1 LEU 218.A O no hydrogen 3.427 N/A THR 222.A OG1 SER 219.A O no hydrogen 2.262 N/A THR 223.A N SER 219.A O no hydrogen 2.914 N/A THR 223.A OG1 GLN 220.A O no hydrogen 2.250 N/A LYS 224.A N GLN 220.A O no hydrogen 2.955 N/A LYS 224.A NZ GLN 220.A OE1 no hydrogen 2.204 N/A LEU 225.A N GLU 221.A O no hydrogen 2.874 N/A LYS 226.A NZ GLN 254.A OE1 no hydrogen 2.841 N/A GLU 227.A N LYS 224.A O no hydrogen 2.968 N/A GLU 228.A N LYS 224.A O no hydrogen 2.872 N/A ARG 229.A NE GLN 232.A O no hydrogen 2.617 N/A ARG 229.A NH2 GLN 232.A O no hydrogen 2.988 N/A LEU 231.A N ARG 229.A O no hydrogen 2.638 N/A LEU 235.A N GLN 254.A O no hydrogen 3.108 N/A LEU 236.A N GLY 130.A O no hydrogen 2.698 N/A THR 243.A N PRO 240.A O no hydrogen 3.384 N/A THR 243.A OG1 SER 239.A O no hydrogen 2.274 N/A LYS 244.A NZ PRO 240.A O no hydrogen 3.214 N/A LEU 246.A N ILE 242.A O no hydrogen 3.067 N/A THR 248.A N LYS 244.A O no hydrogen 3.486 N/A THR 248.A OG1 LEU 245.A O no hydrogen 2.421 N/A ILE 249.A N LEU 245.A O no hydrogen 2.914 N/A ARG 250.A N LEU 246.A O no hydrogen 2.458 N/A LYS 259.A NZ LEU 260.A O no hydrogen 2.636 N/A LEU 260.A N GLN 238.A O no hydrogen 2.879 N/A LEU 267.A N VAL 265.A O no hydrogen 2.882 N/A GLN 268.A NE2 SER 138.A OG no hydrogen 3.166 N/A GLN 272.A NE2 SER 172.A OG no hydrogen 2.928 N/A THR 274.A OG1 VAL 265.A O no hydrogen 2.609 N/A LEU 275.A N TRP 271.A O no hydrogen 2.606 N/A LEU 276.A N GLN 272.A O no hydrogen 2.908 N/A LYS 278.A N THR 274.A O no hydrogen 2.874 N/A LEU 279.A N LEU 275.A O no hydrogen 2.889 N/A VAL 280.A N LEU 276.A O no hydrogen 2.933 N/A ASN 281.A N LYS 277.A O no hydrogen 2.886 N/A ASN 281.A ND2 LYS 277.A O no hydrogen 3.037 N/A HIS 282.A N LYS 278.A O no hydrogen 2.863 N/A HIS 282.A ND1 LYS 278.A O no hydrogen 2.650 N/A VAL 283.A N LEU 279.A O no hydrogen 2.953 N/A LEU 284.A N VAL 280.A O no hydrogen 2.982 N/A SER 285.A N ASN 281.A O no hydrogen 2.793 N/A SER 285.A OG ASN 281.A O no hydrogen 2.894 N/A SER 285.A OG HIS 282.A O no hydrogen 2.840 N/A SER 286.A N HIS 282.A O no hydrogen 2.932 N/A SER 286.A OG VAL 283.A O no hydrogen 2.544 N/A SER 288.A N LEU 284.A O no hydrogen 2.919 N/A SER 288.A OG SER 285.A O no hydrogen 3.114 N/A TRP 289.A N SER 285.A O no hydrogen 2.754 N/A ILE 290.A N SER 286.A O no hydrogen 2.987 N/A SER 291.A N GLY 287.A O no hydrogen 2.895 N/A SER 291.A OG GLY 287.A O no hydrogen 3.291 N/A SER 291.A OG SER 288.A O no hydrogen 2.977 N/A HIS 292.A N SER 288.A O no hydrogen 2.859 N/A HIS 292.A ND1 SER 288.A O no hydrogen 2.336 N/A LEU 293.A N TRP 289.A O no hydrogen 2.849 N/A ILE 294.A N ILE 290.A O no hydrogen 2.937 N/A LYS 295.A N SER 291.A O no hydrogen 2.919 N/A LEU 296.A N HIS 292.A O no hydrogen 2.857 N/A SER 297.A N LEU 293.A O no hydrogen 2.859 N/A SER 297.A OG LEU 293.A O no hydrogen 3.279 N/A SER 297.A OG ILE 302.A O no hydrogen 2.353 N/A GLN 298.A N ILE 294.A O no hydrogen 2.915 N/A TYR 299.A N LYS 295.A O no hydrogen 2.920 N/A TYR 299.A OH GLU 411.A OE1 no hydrogen 2.420 N/A SER 300.A N SER 297.A O no hydrogen 3.056 N/A SER 300.A OG LEU 296.A O no hydrogen 2.644 N/A ASN 301.A N SER 297.A O no hydrogen 2.365 N/A ASN 306.A N PRO 303.A O no hydrogen 3.259 N/A SER 311.A OG ASP 313.A OD2 no hydrogen 2.891 N/A TYR 314.A OH GLU 335.A OE1 no hydrogen 2.889 N/A ILE 316.A N MET 312.A O no hydrogen 3.097 N/A ASP 317.A N ASP 313.A O no hydrogen 2.873 N/A VAL 318.A N TYR 314.A O no hydrogen 2.921 N/A LEU 319.A N ILE 315.A O no hydrogen 2.914 N/A TYR 320.A N ILE 316.A O no hydrogen 2.905 N/A TYR 320.A OH ALA 397.A O no hydrogen 3.408 N/A ALA 321.A N ASP 317.A O no hydrogen 2.875 N/A ARG 322.A N VAL 318.A O no hydrogen 2.927 N/A ARG 322.A NH2 MET 113.A O no hydrogen 2.943 N/A LYS 323.A N LEU 319.A O no hydrogen 2.887 N/A LYS 323.A NZ GLU 407.A OE1 no hydrogen 3.066 N/A LEU 324.A N TYR 320.A O no hydrogen 2.894 N/A LYS 325.A N ALA 321.A O no hydrogen 2.901 N/A LYS 326.A N ARG 322.A O no hydrogen 3.208 N/A LYS 326.A N LYS 323.A O no hydrogen 3.239 N/A ASN 334.A ND2 ILE 105.A O no hydrogen 3.056 N/A LYS 336.A NZ LYS 336.A O no hydrogen 2.955 N/A ALA 337.A N ASN 334.A OD1 no hydrogen 3.050 N/A ASP 341.A N TRP 332.A O no hydrogen 3.359 N/A GLN 346.A NE2 ASN 334.A OD1 no hydrogen 2.967 N/A GLN 346.A NE2 LEU 339.A O no hydrogen 3.094 N/A ASP 350.A N THR 353.A OG1 no hydrogen 3.319 N/A THR 353.A N ASP 350.A OD1 no hydrogen 2.772 N/A THR 353.A OG1 ASN 71.A OD1 no hydrogen 2.466 N/A THR 353.A OG1 ASP 348.A O no hydrogen 3.339 N/A THR 353.A OG1 ASP 350.A OD1 no hydrogen 2.328 N/A SER 354.A N ASP 350.A O no hydrogen 3.495 N/A SER 354.A OG LEU 351.A O no hydrogen 3.100 N/A TRP 355.A N LEU 351.A O no hydrogen 2.970 N/A ILE 356.A N ASN 352.A O no hydrogen 3.025 N/A ASN 358.A N SER 354.A O no hydrogen 3.042 N/A SER 360.A OG ASP 695.A OD2 no hydrogen 3.472 N/A LYS 364.A NZ PHE 362.A O no hydrogen 2.355 N/A LYS 364.A NZ ASP 706.A OD2 no hydrogen 2.358 N/A ILE 365.A N ALA 471.A O no hydrogen 3.185 N/A ASN 366.A ND2 MET 522.A O no hydrogen 3.278 N/A ASN 367.A N VAL 469.A O no hydrogen 2.353 N/A ASN 373.A N ASP 372.A OD1 no hydrogen 2.594 N/A VAL 374.A N TRP 516.A O no hydrogen 2.842 N/A VAL 375.A N ILE 478.A O no hydrogen 2.893 N/A LEU 376.A N ARG 514.A O no hydrogen 3.125 N/A ASN 386.A N ASN 382.A O no hydrogen 3.461 N/A THR 387.A N LEU 383.A O no hydrogen 2.845 N/A THR 387.A OG1 LEU 383.A O no hydrogen 2.457 N/A ILE 388.A N THR 384.A O no hydrogen 2.938 N/A LEU 389.A N VAL 385.A O no hydrogen 2.940 N/A THR 390.A N ASN 386.A O no hydrogen 2.891 N/A THR 390.A OG1 ASN 386.A O no hydrogen 2.489 N/A SER 391.A N THR 387.A O no hydrogen 2.871 N/A SER 391.A OG THR 387.A O no hydrogen 2.597 N/A LEU 393.A N THR 390.A O no hydrogen 2.849 N/A SER 394.A OG ASP 396.A OD1 no hydrogen 2.154 N/A ALA 397.A N ASP 396.A OD1 no hydrogen 2.549 N/A LEU 398.A N SER 394.A O no hydrogen 2.989 N/A ASN 399.A N ASN 395.A O no hydrogen 2.857 N/A VAL 400.A N ASP 396.A O no hydrogen 2.937 N/A LEU 401.A N ALA 397.A O no hydrogen 2.904 N/A ARG 402.A N LEU 398.A O no hydrogen 2.857 N/A ARG 402.A NE LEU 398.A O no hydrogen 3.438 N/A GLY 403.A N ASN 399.A O no hydrogen 2.906 N/A MET 404.A N VAL 400.A O no hydrogen 2.935 N/A LEU 405.A N LEU 401.A O no hydrogen 2.832 N/A LYS 406.A N ARG 402.A O no hydrogen 2.890 N/A LYS 406.A NZ TYR 507.A OH no hydrogen 2.736 N/A GLU 407.A N GLY 403.A O no hydrogen 2.921 N/A TRP 408.A N MET 404.A O no hydrogen 2.888 N/A TRP 409.A N LEU 405.A O no hydrogen 2.836 N/A ASP 410.A N LYS 406.A O no hydrogen 2.923 N/A GLU 411.A N GLU 407.A O no hydrogen 2.898 N/A ALA 419.A N ASN 416.A O no hydrogen 3.236 N/A LEU 421.A N SER 417.A O no hydrogen 2.902 N/A LEU 422.A N THR 418.A O no hydrogen 2.878 N/A VAL 423.A N ALA 419.A O no hydrogen 2.900 N/A ASN 424.A N ASP 420.A O no hydrogen 2.910 N/A SER 425.A N LEU 421.A O no hydrogen 2.897 N/A SER 425.A OG LEU 421.A O no hydrogen 2.985 N/A SER 425.A OG LEU 422.A O no hydrogen 3.116 N/A LEU 426.A N VAL 423.A O no hydrogen 3.295 N/A SER 428.A OG ASP 313.A OD1 no hydrogen 3.307 N/A SER 428.A OG SER 425.A O no hydrogen 2.511 N/A TRP 429.A N SER 425.A O no hydrogen 2.889 N/A TRP 429.A NE1 LYS 436.A O no hydrogen 2.795 N/A VAL 430.A N LEU 426.A O no hydrogen 2.914 N/A GLN 431.A N ALA 427.A O no hydrogen 3.341 N/A GLN 431.A N SER 428.A O no hydrogen 3.032 N/A GLN 431.A NE2 ASP 695.A O no hydrogen 3.427 N/A ASN 432.A N TRP 429.A O no hydrogen 3.334 N/A ASN 432.A ND2 ASP 313.A OD2 no hydrogen 3.449 N/A ASN 434.A N ASN 432.A OD1 no hydrogen 2.985 N/A LYS 436.A NZ GLU 335.A OE2 no hydrogen 3.459 N/A LEU 441.A N ASP 439.A OD1 no hydrogen 2.935 N/A ARG 443.A N ASP 439.A O no hydrogen 2.906 N/A TYR 444.A N GLY 440.A O no hydrogen 2.906 N/A HIS 445.A N LEU 441.A O no hydrogen 2.856 N/A VAL 446.A N LEU 442.A O no hydrogen 2.905 N/A HIS 447.A N ARG 443.A O no hydrogen 2.929 N/A HIS 447.A NE2 GLU 361.A O no hydrogen 2.492 N/A ASN 448.A N TYR 444.A O no hydrogen 2.873 N/A LEU 449.A N HIS 445.A O no hydrogen 2.840 N/A THR 450.A N VAL 446.A O no hydrogen 2.911 N/A THR 450.A OG1 VAL 446.A O no hydrogen 3.040 N/A THR 450.A OG1 HIS 447.A O no hydrogen 2.347 N/A LYS 451.A N HIS 447.A O no hydrogen 2.923 N/A LYS 451.A NZ ASN 448.A OD1 no hydrogen 2.667 N/A LYS 452.A N ASN 448.A O no hydrogen 2.927 N/A LYS 452.A NZ ASN 448.A O no hydrogen 3.020 N/A ALA 453.A N LEU 449.A O no hydrogen 2.856 N/A LEU 454.A N THR 450.A O no hydrogen 2.906 N/A LEU 455.A N LYS 451.A O no hydrogen 2.918 N/A GLN 456.A N LYS 452.A O no hydrogen 2.859 N/A LEU 457.A N ALA 453.A O no hydrogen 2.913 N/A VAL 458.A N LEU 454.A O no hydrogen 2.889 N/A ASN 459.A N LEU 455.A O no hydrogen 2.899 N/A GLU 460.A N GLN 456.A O no hydrogen 2.884 N/A PHE 461.A N LEU 457.A O no hydrogen 2.911 N/A SER 462.A N VAL 458.A O no hydrogen 2.797 N/A SER 462.A OG VAL 458.A O no hydrogen 2.524 N/A ALA 463.A N ASN 459.A O no hydrogen 3.354 N/A SER 466.A N LEU 464.A O no hydrogen 2.611 N/A THR 467.A N LYS 479.A O no hydrogen 2.961 N/A TYR 470.A N LEU 477.A O no hydrogen 3.184 N/A TYR 470.A OH ASP 472.A OD1 no hydrogen 3.379 N/A ALA 471.A N ILE 365.A O no hydrogen 2.481 N/A ASP 472.A N GLN 475.A O no hydrogen 3.251 N/A LEU 477.A N TYR 470.A O no hydrogen 3.005 N/A ILE 478.A N VAL 375.A O no hydrogen 3.195 N/A LYS 479.A N THR 467.A O no hydrogen 2.926 N/A LYS 479.A NZ ASN 481.A OD1 no hydrogen 2.602 N/A THR 480.A N ASN 373.A O no hydrogen 2.678 N/A THR 480.A OG1 ASN 373.A O no hydrogen 3.541 N/A ASN 481.A N GLY 465.A O no hydrogen 3.363 N/A CYS 488.A N PRO 485.A O no hydrogen 2.639 N/A CYS 488.A SG SER 484.A OG no hydrogen 3.070 N/A TYR 489.A N GLU 486.A O no hydrogen 2.774 N/A TYR 489.A OH ASP 517.A OD1 no hydrogen 2.163 N/A TYR 491.A N ASN 487.A O no hydrogen 2.913 N/A SER 492.A N CYS 488.A O no hydrogen 2.169 N/A SER 492.A OG TYR 489.A O no hydrogen 2.378 N/A GLN 493.A N TYR 489.A O no hydrogen 2.909 N/A TYR 494.A N ALA 490.A O no hydrogen 2.937 N/A MET 495.A N TYR 491.A O no hydrogen 2.862 N/A MET 496.A N SER 492.A O no hydrogen 2.924 N/A LYS 497.A N GLN 493.A O no hydrogen 2.944 N/A ALA 498.A N TYR 494.A O no hydrogen 2.957 N/A VAL 499.A N MET 495.A O no hydrogen 2.820 N/A ARG 500.A N MET 496.A O no hydrogen 2.895 N/A THR 501.A N LYS 497.A O no hydrogen 2.942 N/A THR 501.A OG1 LYS 497.A O no hydrogen 2.926 N/A THR 501.A OG1 ALA 498.A O no hydrogen 2.680 N/A ASN 502.A N VAL 499.A O no hydrogen 3.335 N/A LYS 513.A N ASP 377.A O no hydrogen 3.231 N/A LYS 513.A NZ VAL 378.A O no hydrogen 2.771 N/A LYS 513.A NZ ASP 509.A OD2 no hydrogen 3.218 N/A LYS 513.A NZ ASN 511.A O no hydrogen 2.549 N/A TRP 516.A N VAL 374.A O no hydrogen 2.393 N/A ASP 517.A N LEU 530.A O no hydrogen 3.072 N/A TRP 521.A N GLY 369.A O no hydrogen 3.043 N/A MET 522.A N ASN 526.A O no hydrogen 3.009 N/A ASP 523.A N ASN 526.A O no hydrogen 3.406 N/A LYS 524.A NZ TYR 470.A OH no hydrogen 2.837 N/A LYS 524.A NZ ASP 472.A OD1 no hydrogen 2.204 N/A PHE 525.A N ASP 523.A OD1 no hydrogen 3.030 N/A ALA 531.A N TYR 543.A O no hydrogen 3.507 N/A SER 547.A OG ALA 545.A O no hydrogen 3.445 N/A SER 547.A OG GLU 564.A OE2 no hydrogen 3.492 N/A GLN 550.A N PHE 525.A O no hydrogen 3.339 N/A LEU 551.A N ASN 526.A OD1 no hydrogen 3.329 N/A LYS 552.A NZ GLN 560.A O no hydrogen 2.940 N/A LYS 553.A N TRP 549.A O no hydrogen 2.793 N/A PHE 554.A N GLN 550.A O no hydrogen 3.346 N/A LEU 555.A N LEU 551.A O no hydrogen 3.025 N/A SER 556.A OG ASP 624.A O no hydrogen 2.533 N/A ILE 558.A N SER 556.A OG no hydrogen 3.400 N/A GLN 560.A N SER 556.A O no hydrogen 2.836 N/A GLN 560.A NE2 LEU 555.A O no hydrogen 2.919 N/A PHE 563.A N TYR 559.A O no hydrogen 2.924 N/A GLU 564.A N GLN 560.A O no hydrogen 2.915 N/A ASP 565.A N PRO 561.A O no hydrogen 2.843 N/A TRP 566.A N GLU 562.A O no hydrogen 2.922 N/A MET 567.A N PHE 563.A O no hydrogen 2.909 N/A MET 568.A N GLU 564.A O no hydrogen 2.940 N/A ILE 569.A N ASP 565.A O no hydrogen 2.936 N/A ILE 570.A N TRP 566.A O no hydrogen 2.848 N/A LEU 571.A N MET 567.A O no hydrogen 2.860 N/A ASP 572.A N MET 568.A O no hydrogen 2.890 N/A SER 573.A N ILE 569.A O no hydrogen 2.947 N/A SER 573.A OG ILE 569.A O no hydrogen 2.900 N/A MET 574.A N ILE 570.A O no hydrogen 2.940 N/A LEU 575.A N LEU 571.A O no hydrogen 2.911 N/A LYS 576.A N ASP 572.A O no hydrogen 2.935 N/A LYS 576.A NZ ASP 572.A OD2 no hydrogen 3.131 N/A THR 577.A N SER 573.A O no hydrogen 2.975 N/A THR 577.A OG1 SER 573.A O no hydrogen 3.142 N/A THR 577.A OG1 MET 574.A O no hydrogen 2.737 N/A THR 577.A OG1 SER 589.A O no hydrogen 3.069 N/A LYS 578.A N MET 574.A O no hydrogen 2.811 N/A LYS 578.A NZ ASP 517.A O no hydrogen 3.347 N/A GLN 579.A N LEU 575.A O no hydrogen 2.959 N/A SER 580.A N LYS 576.A O no hydrogen 2.940 N/A SER 580.A OG LYS 576.A O no hydrogen 2.767 N/A TYR 581.A N THR 577.A O no hydrogen 2.858 N/A LEU 582.A N LYS 578.A O no hydrogen 2.897 N/A LYS 583.A N GLN 579.A O no hydrogen 2.878 N/A LEU 584.A N SER 580.A O no hydrogen 2.927 N/A ASN 585.A N TYR 581.A O no hydrogen 2.879 N/A SER 586.A N LEU 582.A O no hydrogen 2.622 N/A SER 586.A OG LYS 583.A O no hydrogen 2.341 N/A ASN 591.A N GLU 587.A O no hydrogen 2.922 N/A GLY 592.A N ASN 588.A O no hydrogen 2.933 N/A PHE 593.A N SER 589.A O no hydrogen 2.875 N/A SER 594.A N LEU 590.A O no hydrogen 2.892 N/A SER 594.A OG ASN 591.A O no hydrogen 2.287 N/A HIS 595.A N ASN 591.A O no hydrogen 3.519 N/A HIS 595.A NE2 GLU 661.A OE2 no hydrogen 3.234 N/A LEU 596.A N GLY 592.A O no hydrogen 2.906 N/A PHE 597.A N PHE 593.A O no hydrogen 2.940 N/A SER 598.A OG HIS 595.A O no hydrogen 2.835 N/A LEU 601.A N PHE 597.A O no hydrogen 2.945 N/A MET 602.A N SER 598.A O no hydrogen 2.882 N/A LYS 603.A N LYS 599.A O no hydrogen 2.944 N/A ARG 604.A N PRO 600.A O no hydrogen 2.923 N/A ARG 604.A NE ARG 604.A O no hydrogen 2.965 N/A VAL 605.A N LEU 601.A O no hydrogen 2.861 N/A LYS 606.A N MET 602.A O no hydrogen 3.236 N/A LYS 606.A NZ MET 602.A O no hydrogen 3.469 N/A LYS 607.A N LYS 603.A O no hydrogen 3.119 N/A LEU 608.A N ARG 604.A O no hydrogen 2.840 N/A PHE 609.A N VAL 605.A O no hydrogen 2.747 N/A LYS 610.A N LYS 606.A O no hydrogen 2.494 N/A ASN 611.A N LYS 607.A O no hydrogen 2.857 N/A GLN 612.A N LEU 608.A O no hydrogen 2.860 N/A GLN 612.A NE2 ASN 639.A OD1 no hydrogen 2.665 N/A GLN 613.A N PHE 609.A O no hydrogen 2.953 N/A GLN 613.A N LYS 610.A O no hydrogen 3.202 N/A GLN 613.A NE2 PHE 609.A O no hydrogen 2.313 N/A GLU 614.A N GLU 614.A OE1 no hydrogen 2.841 N/A PHE 615.A N ASN 611.A O no hydrogen 2.606 N/A ILE 616.A N GLN 612.A O no hydrogen 2.788 N/A ASP 618.A N GLU 622.A OE2 no hydrogen 3.482 N/A TYR 621.A N ASP 618.A OD2 no hydrogen 2.498 N/A GLU 622.A N ASP 618.A O no hydrogen 2.599 N/A ALA 623.A N PRO 619.A O no hydrogen 3.313 N/A TYR 625.A N TYR 621.A O no hydrogen 2.607 N/A VAL 626.A N GLU 622.A O no hydrogen 3.130 N/A LYS 638.A NZ VAL 681.A O no hydrogen 2.541 N/A LEU 642.A N ASN 639.A O no hydrogen 2.317 N/A LEU 642.A N ASN 639.A OD1 no hydrogen 3.228 N/A GLU 643.A N ASN 639.A O no hydrogen 3.303 N/A LEU 644.A N PRO 640.A O no hydrogen 2.799 N/A VAL 645.A N LEU 641.A O no hydrogen 3.085 N/A LYS 646.A N LEU 642.A O no hydrogen 2.907 N/A SER 647.A N GLU 643.A O no hydrogen 2.886 N/A SER 647.A OG GLU 643.A O no hydrogen 3.077 N/A SER 647.A OG LEU 644.A O no hydrogen 2.398 N/A LEU 648.A N LEU 644.A O no hydrogen 2.909 N/A CYS 649.A N VAL 645.A O no hydrogen 2.859 N/A HIS 650.A N LYS 646.A O no hydrogen 2.913 N/A VAL 651.A N SER 647.A O no hydrogen 2.924 N/A MET 652.A N LEU 648.A O no hydrogen 2.903 N/A LEU 653.A N CYS 649.A O no hydrogen 2.655 N/A SER 655.A N MET 652.A O no hydrogen 3.209 N/A SER 655.A OG GLU 587.A OE2 no hydrogen 2.925 N/A SER 655.A OG THR 658.A OG1 no hydrogen 3.159 N/A LYS 656.A NZ SER 657.A OG no hydrogen 3.264 N/A SER 657.A N GLU 587.A OE2 no hydrogen 2.895 N/A THR 658.A OG1 SER 655.A O no hydrogen 3.150 N/A ILE 659.A N LYS 656.A O no hydrogen 3.318 N/A GLU 661.A N GLU 661.A OE1 no hydrogen 2.524 N/A ILE 662.A N THR 658.A O no hydrogen 2.616 N/A ARG 663.A N ILE 659.A O no hydrogen 2.853 N/A THR 664.A N LEU 660.A O no hydrogen 2.926 N/A THR 664.A OG1 GLU 661.A O no hydrogen 2.240 N/A LEU 665.A N GLU 661.A O no hydrogen 2.894 N/A ARG 666.A N ILE 662.A O no hydrogen 2.855 N/A LYS 667.A N ARG 663.A O no hydrogen 2.889 N/A GLU 668.A N THR 664.A O no hydrogen 2.921 N/A LEU 669.A N LEU 665.A O no hydrogen 2.872 N/A LEU 670.A N ARG 666.A O no hydrogen 2.882 N/A LYS 671.A N LYS 667.A O no hydrogen 2.925 N/A ILE 672.A N GLU 668.A O no hydrogen 2.869 N/A PHE 673.A N LEU 669.A O no hydrogen 2.752 N/A GLU 674.A N GLU 674.A OE1 no hydrogen 2.406 N/A GLU 683.A N LYS 680.A O no hydrogen 2.930 N/A LYS 685.A NZ LYS 680.A O no hydrogen 3.187 N/A LYS 685.A NZ GLU 683.A OE1 no hydrogen 3.539 N/A VAL 693.A N ILE 707.A O no hydrogen 3.026 N/A ASP 695.A N ASP 706.A OD1 no hydrogen 2.349 N/A CYS 698.A SG LYS 725.A O no hydrogen 3.964 N/A GLU 699.A N GLU 699.A OE1 no hydrogen 2.495 N/A CYS 701.A SG CYS 698.A O no hydrogen 3.360 N/A PHE 702.A N CYS 698.A O no hydrogen 2.451 N/A SER 705.A N PHE 696.A O no hydrogen 2.796 N/A ILE 707.A N VAL 693.A O no hydrogen 3.371 N/A PHE 709.A N LEU 691.A O no hydrogen 2.594 N/A CYS 710.A SG LEU 689.A O no hydrogen 3.496 N/A LYS 711.A NZ ASP 523.A OD2 no hydrogen 2.866 N/A LYS 711.A NZ GLN 550.A OE1 no hydrogen 2.642 N/A ALA 712.A N ASP 708.A O no hydrogen 3.111 N/A GLU 715.A N GLU 715.A OE1 no hydrogen 2.722 N/A ILE 717.A N ALA 713.A O no hydrogen 3.152 N/A SER 719.A N GLU 715.A O no hydrogen 2.756 N/A CYS 720.A SG CYS 723.A O no hydrogen 3.260 N/A CYS 720.A SG LYS 725.A O no hydrogen 3.730 N/A ARG 722.A NH1 CYS 701.A O no hydrogen 2.641 N/A LYS 725.A NZ GLU 699.A OE2 no hydrogen 2.537 N/A LYS 725.A NZ ALA 726.A O no hydrogen 2.883 N/A PHE 727.A N PHE 718.A O no hydrogen 2.295 N/A LEU 732.A N ASN 728.A O no hydrogen 3.419 N/A GLN 733.A N GLN 729.A O no hydrogen 2.927 N/A GLU 734.A N VAL 730.A O no hydrogen 2.889 N/A HIS 735.A N LEU 731.A O no hydrogen 2.879 N/A HIS 735.A ND1 LEU 731.A O no hydrogen 3.039 N/A LEU 736.A N LEU 732.A O no hydrogen 2.936 N/A ILE 737.A N GLN 733.A O no hydrogen 2.912 N/A GLN 738.A N GLU 734.A O no hydrogen 2.821 N/A LYS 739.A N HIS 735.A O no hydrogen 2.938 N/A LEU 740.A N LEU 736.A O no hydrogen 2.931 N/A ARG 741.A N ILE 737.A O no hydrogen 2.889 N/A SER 742.A N GLN 738.A O no hydrogen 2.878 N/A SER 742.A OG GLN 738.A O no hydrogen 2.675 N/A ASP 743.A N LYS 739.A O no hydrogen 2.923 N/A ILE 744.A N LEU 740.A O no hydrogen 3.003 N/A GLU 745.A N ARG 741.A O no hydrogen 2.880 N/A GLU 745.A N GLU 745.A OE1 no hydrogen 2.762 N/A SER 746.A N SER 742.A O no hydrogen 2.925 N/A SER 746.A OG SER 742.A O no hydrogen 2.859 N/A TYR 747.A N ASP 743.A O no hydrogen 2.846 N/A LEU 748.A N ILE 744.A O no hydrogen 2.943 N/A ILE 749.A N SER 746.A O no hydrogen 2.926 N/A CYS 754.A N LYS 759.A O no hydrogen 2.912 N/A CYS 754.A SG GLY 773.A O no hydrogen 3.178 N/A CYS 754.A SG ALA 774.A O no hydrogen 3.488 N/A SER 755.A OG GLU 776.A OE2 no hydrogen 3.328 N/A LYS 761.A N LEU 752.A O no hydrogen 2.872 N/A ARG 762.A N VAL 760.A O no hydrogen 2.794 N/A ARG 762.A NH2 ASP 751.A OD2 no hydrogen 2.766 N/A SER 766.A OG HIS 768.A O no hydrogen 3.031 N/A TRP 775.A NE1 SER 766.A OG no hydrogen 2.456 N/A GLU 782.A N GLU 782.A OE1 no hydrogen 2.648 N/A VAL 785.A N ARG 781.A O no hydrogen 2.845 N/A GLN 786.A N GLU 782.A O no hydrogen 2.984 N/A GLN 786.A NE2 SER 783.A O no hydrogen 3.396 N/A GLN 786.A NE2 SER 783.A OG no hydrogen 3.261 N/A LYS 787.A N SER 783.A O no hydrogen 2.878 N/A LEU 788.A N ILE 784.A O no hydrogen 2.867 N/A ASN 789.A N VAL 785.A O no hydrogen 2.905 N/A VAL 790.A N GLN 786.A O no hydrogen 2.908 N/A PHE 791.A N LYS 787.A O no hydrogen 2.856 N/A LYS 792.A N LEU 788.A O no hydrogen 2.883 N/A LYS 792.A NZ ASN 789.A OD1 no hydrogen 2.633 N/A GLN 793.A N ASN 789.A O no hydrogen 2.884 N/A GLN 793.A NE2 HIS 634.A NE2 no hydrogen 3.031 N/A VAL 794.A N VAL 790.A O no hydrogen 2.914 N/A ALA 795.A N PHE 791.A O no hydrogen 2.857 N/A LYS 796.A N LYS 792.A O no hydrogen 2.905 N/A TYR 797.A N GLN 793.A O no hydrogen 2.894 N/A TYR 798.A N VAL 794.A O no hydrogen 2.437 N/A ILE 802.A N GLN 733.A OE1 no hydrogen 2.731 N/A ILE 802.A N ASP 801.A OD1 no hydrogen 2.781 N/A LEU 803.A N GLN 733.A OE1 no hydrogen 3.391 N/A LEU 804.A N PHE 800.A O no hydrogen 2.659 N/A SER 805.A N ASP 801.A O no hydrogen 2.897 N/A SER 805.A OG ASP 801.A O no hydrogen 3.189 N/A SER 805.A OG ILE 802.A O no hydrogen 2.470 N/A CYS 806.A N ILE 802.A O no hydrogen 2.922 N/A ILE 807.A N LEU 803.A O no hydrogen 2.883 N/A ALA 808.A N LEU 804.A O no hydrogen 2.908 N/A ASP 809.A N SER 805.A O no hydrogen 2.912 N/A LEU 810.A N CYS 806.A O no hydrogen 2.905 N/A THR 811.A N ILE 807.A O no hydrogen 2.975 N/A THR 811.A OG1 ILE 807.A O no hydrogen 3.477 N/A THR 811.A OG1 ALA 808.A O no hydrogen 2.493 N/A ILE 812.A N ASP 809.A O no hydrogen 3.067 N/A