Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ast_M.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLU 6.A OE2 no hydrogen 3.556 N/A LYS 7.A N VAL 4.A O no hydrogen 3.008 N/A TRP 8.A N GLU 5.A O no hydrogen 3.285 N/A ARG 9.A N GLU 6.A O no hydrogen 3.183 N/A ARG 9.A NE GLU 5.A OE2 no hydrogen 3.328 N/A ARG 9.A NH1 TRP 8.A O no hydrogen 3.419 N/A PHE 14.A N LEU 10.A O no hydrogen 3.357 N/A PHE 14.A N LEU 11.A O no hydrogen 3.126 N/A LEU 15.A N LEU 11.A O no hydrogen 2.883 N/A LYS 16.A NZ PRO 12.A O no hydrogen 2.274 N/A LYS 18.A N PHE 14.A O no hydrogen 3.378 N/A LYS 18.A NZ ILE 483.A O no hydrogen 2.377 N/A GLN 23.A NE2 LEU 20.A O no hydrogen 3.356 N/A HIS 24.A N VAL 21.A O no hydrogen 2.818 N/A ASP 26.A N LYS 22.A O no hydrogen 2.849 N/A SER 27.A N GLN 23.A O no hydrogen 2.937 N/A SER 27.A OG HIS 24.A O no hydrogen 2.808 N/A PHE 28.A N HIS 24.A O no hydrogen 3.064 N/A ASN 29.A N ILE 25.A O no hydrogen 2.815 N/A TYR 30.A N ASP 26.A O no hydrogen 2.992 N/A PHE 31.A N SER 27.A O no hydrogen 2.981 N/A ILE 32.A N PHE 28.A O no hydrogen 2.880 N/A ASN 33.A N ASN 29.A O no hydrogen 2.855 N/A VAL 34.A N TYR 30.A O no hydrogen 2.932 N/A GLU 35.A N TYR 30.A O no hydrogen 3.428 N/A LYS 37.A NZ TYR 62.A OH no hydrogen 3.245 N/A LYS 38.A N VAL 34.A O no hydrogen 2.866 N/A ILE 39.A N GLU 35.A O no hydrogen 2.911 N/A MET 40.A N ILE 36.A O no hydrogen 2.852 N/A LYS 41.A N LYS 37.A O no hydrogen 2.986 N/A LYS 41.A N LYS 38.A O no hydrogen 2.920 N/A ALA 42.A N ILE 39.A O no hydrogen 2.950 N/A THR 47.A OG1 SER 48.A OG no hydrogen 3.396 N/A SER 48.A OG THR 47.A OG1 no hydrogen 3.396 N/A ALA 50.A N ASP 49.A OD2 no hydrogen 2.387 N/A ASP 51.A N SER 48.A O no hydrogen 3.152 N/A TRP 54.A N ASP 51.A OD1 no hydrogen 2.424 N/A LEU 59.A N ASP 97.A O no hydrogen 2.487 N/A TYR 62.A N THR 95.A O no hydrogen 3.392 N/A GLU 69.A N GLU 70.A OE1 no hydrogen 3.416 N/A GLU 70.A N GLU 70.A OE1 no hydrogen 2.529 N/A SER 71.A OG SER 71.A O no hydrogen 2.522 N/A VAL 74.A N SER 91.A O no hydrogen 3.153 N/A SER 79.A OG HIS 81.A O no hydrogen 2.140 N/A CYS 83.A N PRO 80.A O no hydrogen 3.003 N/A CYS 83.A SG SER 79.A O no hydrogen 3.463 N/A CYS 83.A SG GLU 82.A O no hydrogen 3.277 N/A THR 89.A OG1 TYR 90.A O no hydrogen 3.566 N/A SER 91.A OG TYR 90.A O no hydrogen 2.697 N/A ALA 92.A N MET 117.A O no hydrogen 3.123 N/A THR 95.A N PRO 93.A O no hydrogen 2.833 N/A THR 101.A N TYR 55.A O no hydrogen 2.653 N/A THR 101.A OG1 MET 53.A O no hydrogen 2.362 N/A THR 101.A OG1 TYR 55.A O no hydrogen 3.093 N/A GLN 105.A N ARG 102.A O no hydrogen 3.040 N/A ARG 109.A NE ILE 107.A O no hydrogen 2.440 N/A LEU 112.A N VAL 96.A O no hydrogen 2.863 N/A ARG 116.A NH1 ASP 390.A OD1 no hydrogen 2.744 N/A MET 117.A N ALA 92.A O no hydrogen 2.501 N/A LEU 121.A N TYR 149.A O no hydrogen 3.114 N/A ARG 122.A NH2 PRO 143.A O no hydrogen 2.617 N/A SER 123.A N MET 120.A O no hydrogen 3.168 N/A SER 124.A N ASN 29.A OD1 no hydrogen 2.694 N/A SER 124.A OG ASN 29.A OD1 no hydrogen 2.405 N/A ASN 125.A N SER 123.A OG no hydrogen 3.268 N/A ASN 125.A ND2 SER 124.A O no hydrogen 2.868 N/A LYS 131.A NZ VAL 127.A O no hydrogen 2.673 N/A GLU 135.A N THR 132.A OG1 no hydrogen 3.345 N/A PHE 136.A N THR 132.A O no hydrogen 3.134 N/A ALA 137.A N ALA 134.A O no hydrogen 3.190 N/A LYS 138.A NZ GLU 135.A OE1 no hydrogen 3.391 N/A ASN 140.A N ALA 137.A O no hydrogen 2.800 N/A CYS 142.A N ASN 681.A OD1 no hydrogen 3.191 N/A CYS 142.A SG TYR 426.A OH no hydrogen 2.902 N/A CYS 142.A SG ASN 681.A OD1 no hydrogen 3.221 N/A GLY 148.A N LEU 121.A O no hydrogen 2.948 N/A TYR 149.A OH ASP 145.A OD2 no hydrogen 3.333 N/A PHE 150.A N LYS 157.A O no hydrogen 3.121 N/A VAL 152.A N VAL 155.A O no hydrogen 2.903 N/A VAL 155.A N VAL 152.A O no hydrogen 2.496 N/A LYS 157.A N PHE 150.A O no hydrogen 3.445 N/A LYS 157.A NZ ILE 400.A O no hydrogen 3.232 N/A VAL 158.A N GLN 419.A O no hydrogen 2.940 N/A ILE 161.A N ARG 435.A O no hydrogen 3.390 N/A GLN 162.A N GLU 344.A O no hydrogen 3.167 N/A ASN 168.A ND2 ASN 523.A O no hydrogen 3.301 N/A ARG 169.A NH2 SER 166.A OG no hydrogen 3.093 N/A GLU 173.A N ILE 171.A O no hydrogen 3.156 N/A GLU 173.A N VAL 180.A O no hydrogen 3.292 N/A ALA 182.A N ILE 171.A O no hydrogen 3.399 N/A SER 183.A OG TYR 315.A OH no hydrogen 3.032 N/A THR 185.A OG1 HIS 301.A O no hydrogen 2.305 N/A SER 186.A OG THR 185.A O no hydrogen 2.396 N/A SER 186.A OG GLU 190.A O no hydrogen 3.556 N/A THR 188.A OG1 SER 187.A O no hydrogen 2.223 N/A LYS 192.A N GLU 190.A O no hydrogen 2.934 N/A LYS 192.A NZ GLU 190.A O no hydrogen 3.281 N/A LYS 192.A NZ GLU 190.A OE1 no hydrogen 2.867 N/A THR 195.A N SER 193.A O no hydrogen 2.610 N/A ASN 196.A N GLY 181.A O no hydrogen 2.530 N/A ALA 198.A N ALA 179.A O no hydrogen 3.262 N/A VAL 199.A N ARG 203.A O no hydrogen 2.933 N/A ARG 203.A NE GLU 252.A OE2 no hydrogen 2.754 N/A ARG 207.A N THR 195.A O no hydrogen 2.995 N/A THR 210.A OG1 ASN 209.A OD1 no hydrogen 3.430 N/A SER 212.A N LYS 271.A O no hydrogen 3.097 N/A SER 212.A OG LYS 271.A O no hydrogen 2.176 N/A ILE 217.A N PHE 204.A O no hydrogen 2.920 N/A ILE 220.A N PRO 216.A O no hydrogen 3.223 N/A PHE 221.A N ILE 217.A O no hydrogen 2.794 N/A LYS 222.A N VAL 218.A O no hydrogen 2.947 N/A LYS 222.A NZ ASP 229.A OD1 no hydrogen 2.518 N/A LYS 222.A NZ ASP 229.A OD2 no hydrogen 3.181 N/A ALA 223.A N ILE 219.A O no hydrogen 2.902 N/A MET 224.A N ILE 220.A O no hydrogen 3.269 N/A MET 224.A N PHE 221.A O no hydrogen 3.373 N/A GLY 225.A N GLN 261.A OE1 no hydrogen 2.515 N/A GLU 227.A N GLU 227.A OE1 no hydrogen 2.319 N/A SER 228.A OG VAL 226.A O no hydrogen 3.537 N/A SER 228.A OG SER 228.A O no hydrogen 2.489 N/A SER 228.A OG GLU 231.A OE1 no hydrogen 3.343 N/A GLU 231.A N SER 228.A O no hydrogen 2.396 N/A VAL 233.A N ASP 229.A O no hydrogen 2.994 N/A GLN 234.A N GLN 230.A O no hydrogen 2.917 N/A MET 235.A N GLU 231.A O no hydrogen 2.970 N/A ILE 236.A N ILE 232.A O no hydrogen 2.940 N/A GLY 237.A N VAL 233.A O no hydrogen 3.169 N/A ALA 244.A N GLU 240.A O no hydrogen 2.913 N/A ALA 245.A N HIS 241.A O no hydrogen 2.859 N/A PHE 246.A N VAL 242.A O no hydrogen 2.957 N/A GLY 247.A N MET 243.A O no hydrogen 2.922 N/A SER 249.A N PHE 246.A O no hydrogen 2.969 N/A GLU 251.A N GLY 247.A O no hydrogen 2.908 N/A GLU 252.A N PRO 248.A O no hydrogen 2.889 N/A CYS 253.A N SER 249.A O no hydrogen 2.924 N/A CYS 253.A SG GLN 257.A O no hydrogen 3.854 N/A GLN 254.A N LEU 250.A O no hydrogen 2.880 N/A LYS 255.A N GLU 251.A O no hydrogen 2.871 N/A ALA 256.A N GLU 252.A O no hydrogen 2.914 N/A GLN 257.A N CYS 253.A O no hydrogen 2.821 N/A GLN 261.A N THR 260.A OG1 no hydrogen 2.483 N/A ILE 268.A N LEU 265.A O no hydrogen 2.909 N/A GLY 269.A N LEU 265.A O no hydrogen 2.436 N/A ASN 270.A N LYS 266.A O no hydrogen 3.111 N/A ARG 274.A NH2 ALA 295.A O no hydrogen 3.261 N/A ARG 276.A N ARG 273.A O no hydrogen 2.451 N/A GLY 281.A N TRP 278.A O no hydrogen 3.343 N/A ARG 291.A N GLU 288.A O no hydrogen 2.353 N/A GLU 292.A N GLU 288.A O no hydrogen 2.731 N/A GLU 292.A N GLU 292.A OE1 no hydrogen 2.873 N/A LEU 293.A N GLU 289.A O no hydrogen 2.950 N/A LEU 294.A N ALA 290.A O no hydrogen 2.864 N/A ALA 295.A N ARG 291.A O no hydrogen 2.886 N/A SER 296.A N LEU 293.A O no hydrogen 3.043 N/A SER 296.A OG LEU 293.A O no hydrogen 2.208 N/A THR 300.A N THR 297.A O no hydrogen 3.416 N/A THR 300.A OG1 THR 297.A O no hydrogen 2.806 N/A LYS 312.A NZ THR 300.A O no hydrogen 3.451 N/A CYS 313.A N PHE 309.A O no hydrogen 2.820 N/A CYS 313.A SG MET 224.A O no hydrogen 3.025 N/A CYS 313.A SG PHE 309.A O no hydrogen 3.001 N/A ILE 314.A N ARG 310.A O no hydrogen 2.926 N/A TYR 315.A N ALA 311.A O no hydrogen 2.927 N/A TYR 315.A OH SER 183.A OG no hydrogen 3.032 N/A THR 316.A N LYS 312.A O no hydrogen 2.887 N/A THR 316.A OG1 LYS 312.A O no hydrogen 3.059 N/A ALA 317.A N CYS 313.A O no hydrogen 2.845 N/A VAL 318.A N ILE 314.A O no hydrogen 2.859 N/A MET 319.A N TYR 315.A O no hydrogen 2.893 N/A VAL 320.A N THR 316.A O no hydrogen 2.720 N/A ARG 322.A N VAL 318.A O no hydrogen 2.710 N/A ASP 329.A N GLN 327.A O no hydrogen 2.472 N/A ASN 340.A N TYR 337.A O no hydrogen 2.446 N/A ASN 340.A ND2 ARG 335.A O no hydrogen 2.867 N/A LYS 341.A N TYR 337.A O no hydrogen 3.332 N/A LYS 341.A NZ GLU 163.A OE1 no hydrogen 3.297 N/A ARG 342.A N GLN 164.A O no hydrogen 3.367 N/A ARG 342.A NE GLY 339.A O no hydrogen 3.214 N/A ARG 342.A NH1 GLY 570.A O no hydrogen 2.705 N/A LEU 343.A N GLY 571.A O no hydrogen 2.798 N/A LEU 345.A N GLN 348.A OE1 no hydrogen 3.223 N/A LEU 349.A N LEU 345.A O no hydrogen 3.058 N/A LEU 350.A N ALA 346.A O no hydrogen 2.987 N/A SER 351.A N GLY 347.A O no hydrogen 2.789 N/A LEU 352.A N GLN 348.A O no hydrogen 2.949 N/A LEU 353.A N LEU 349.A O no hydrogen 2.989 N/A PHE 354.A N LEU 350.A O no hydrogen 2.831 N/A GLU 355.A N SER 351.A O no hydrogen 2.954 N/A ASP 356.A N LEU 352.A O no hydrogen 2.933 N/A LEU 357.A N LEU 353.A O no hydrogen 2.880 N/A PHE 358.A N PHE 354.A O no hydrogen 2.995 N/A LYS 359.A N GLU 355.A O no hydrogen 2.954 N/A LYS 360.A N ASP 356.A O no hydrogen 2.835 N/A PHE 361.A N LEU 357.A O no hydrogen 2.903 N/A ASN 362.A N PHE 358.A O no hydrogen 2.885 N/A SER 363.A N LYS 359.A O no hydrogen 2.805 N/A SER 363.A OG LYS 360.A O no hydrogen 2.683 N/A GLU 364.A N LYS 360.A O no hydrogen 2.939 N/A MET 365.A N PHE 361.A O no hydrogen 2.907 N/A LYS 366.A N ASN 362.A O no hydrogen 2.824 N/A LYS 367.A N SER 363.A O no hydrogen 2.878 N/A ILE 368.A N GLU 364.A O no hydrogen 2.935 N/A ALA 369.A N MET 365.A O no hydrogen 2.896 N/A ASP 370.A N LYS 366.A O no hydrogen 2.833 N/A GLN 371.A N ILE 368.A O no hydrogen 3.235 N/A GLN 371.A NE2 ILE 368.A O no hydrogen 3.049 N/A VAL 372.A N ALA 369.A O no hydrogen 3.272 N/A LYS 375.A N VAL 372.A O no hydrogen 2.870 N/A LYS 375.A NZ GLN 371.A OE1 no hydrogen 3.099 N/A GLN 380.A N ALA 378.A O no hydrogen 2.777 N/A GLN 380.A NE2 LYS 375.A O no hydrogen 2.376 N/A GLN 380.A NE2 ARG 377.A O no hydrogen 2.229 N/A HIS 386.A N ASP 382.A O no hydrogen 2.654 N/A HIS 386.A ND1 HIS 386.A O no hydrogen 2.376 N/A GLN 389.A NE2 HIS 386.A ND1 no hydrogen 3.149 N/A GLN 391.A N ARG 388.A O no hydrogen 2.979 N/A THR 393.A OG1 ASP 390.A O no hydrogen 2.390 N/A GLY 395.A N GLN 391.A O no hydrogen 3.479 N/A MET 396.A N ILE 392.A O no hydrogen 2.927 N/A VAL 397.A N THR 393.A O no hydrogen 2.926 N/A ASN 398.A N ASN 394.A O no hydrogen 2.835 N/A ASN 398.A ND2 ASN 394.A O no hydrogen 2.377 N/A ALA 399.A N GLY 395.A O no hydrogen 2.943 N/A ILE 400.A N MET 396.A O no hydrogen 2.937 N/A SER 401.A N VAL 397.A O no hydrogen 2.856 N/A SER 401.A OG VAL 397.A O no hydrogen 2.330 N/A SER 401.A OG ASN 398.A O no hydrogen 3.066 N/A THR 402.A N ASN 398.A O no hydrogen 2.908 N/A THR 402.A OG1 ASN 398.A O no hydrogen 2.863 N/A ASN 404.A N THR 402.A OG1 no hydrogen 3.099 N/A TRP 405.A N ARG 414.A O no hydrogen 3.086 N/A SER 406.A OG ASP 413.A OD1 no hydrogen 3.065 N/A GLY 416.A N GLY 403.A O no hydrogen 3.256 N/A THR 418.A OG1 ILE 400.A O no hydrogen 2.805 N/A GLN 419.A N VAL 158.A O no hydrogen 3.250 N/A LEU 421.A N GLU 156.A O no hydrogen 3.271 N/A ARG 423.A N LEU 421.A O no hydrogen 2.819 N/A ARG 423.A NH2 TYR 149.A OH no hydrogen 2.945 N/A LEU 424.A N SER 422.A O no hydrogen 2.707 N/A ILE 427.A N SER 425.A OG no hydrogen 2.879 N/A SER 428.A OG SER 422.A O no hydrogen 2.465 N/A SER 428.A OG LYS 672.A O no hydrogen 3.182 N/A LEU 430.A N TYR 426.A O no hydrogen 3.337 N/A GLY 431.A N ILE 427.A O no hydrogen 2.922 N/A MET 432.A N SER 428.A O no hydrogen 2.849 N/A THR 434.A OG1 LEU 430.A O no hydrogen 3.347 N/A THR 434.A OG1 MET 433.A O no hydrogen 2.587 N/A ARG 435.A NE GLY 431.A O no hydrogen 3.013 N/A ARG 435.A NH2 GLY 431.A O no hydrogen 2.691 N/A ILE 436.A N LYS 475.A O no hydrogen 2.237 N/A SER 437.A N ILE 161.A O no hydrogen 2.365 N/A SER 437.A OG ILE 161.A O no hydrogen 2.754 N/A SER 438.A N LEU 473.A O no hydrogen 2.784 N/A SER 438.A OG LEU 473.A O no hydrogen 2.509 N/A ARG 444.A NE GLN 439.A O no hydrogen 3.020 N/A ARG 444.A NE PHE 440.A O no hydrogen 2.922 N/A VAL 446.A N THR 443.A O no hydrogen 2.717 N/A SER 447.A OG SER 447.A O no hydrogen 2.437 N/A GLY 448.A N VAL 446.A O no hydrogen 2.742 N/A GLN 453.A NE2 SER 451.A O no hydrogen 2.695 N/A LEU 460.A N GLN 456.A O no hydrogen 3.471 N/A CYS 461.A N ASN 476.A O no hydrogen 3.272 N/A CYS 461.A SG LEU 645.A O no hydrogen 3.428 N/A GLU 467.A N THR 465.A O no hydrogen 3.137 N/A LYS 475.A N ILE 436.A O no hydrogen 2.355 N/A LYS 475.A NZ TYR 338.A OH no hydrogen 3.506 N/A LYS 475.A NZ GLY 472.A O no hydrogen 3.410 N/A ASN 476.A ND2 GLY 431.A O no hydrogen 3.189 N/A ASN 476.A ND2 THR 434.A O no hydrogen 3.395 N/A LEU 477.A N THR 434.A O no hydrogen 3.117 N/A THR 481.A N LEU 479.A O no hydrogen 2.405 N/A THR 481.A OG1 LEU 479.A O no hydrogen 3.130 N/A THR 481.A OG1 THR 481.A O no hydrogen 2.500 N/A HIS 482.A ND1 MET 480.A O no hydrogen 2.662 N/A THR 484.A N ARG 572.A O no hydrogen 3.408 N/A THR 484.A OG1 ARG 572.A O no hydrogen 3.174 N/A ILE 492.A N ASP 489.A O no hydrogen 3.169 N/A VAL 493.A N ASP 489.A O no hydrogen 3.160 N/A LYS 494.A N GLY 490.A O no hydrogen 2.974 N/A ALA 496.A N ILE 492.A O no hydrogen 2.838 N/A ALA 496.A N VAL 493.A O no hydrogen 3.233 N/A SER 497.A N VAL 493.A O no hydrogen 2.934 N/A SER 497.A OG LYS 494.A O no hydrogen 2.854 N/A SER 497.A OG ASN 498.A OD1 no hydrogen 3.507 N/A ASN 498.A N LYS 494.A O no hydrogen 2.940 N/A LEU 499.A N LEU 495.A O no hydrogen 2.847 N/A ASN 505.A N ASP 503.A OD2 no hydrogen 3.533 N/A LEU 506.A N ASP 503.A O no hydrogen 2.925 N/A LEU 507.A N VAL 504.A O no hydrogen 3.420 N/A CYS 508.A SG GLU 231.A OE2 no hydrogen 3.653 N/A GLU 510.A N CYS 508.A O no hydrogen 2.349 N/A LEU 512.A N GLU 510.A O no hydrogen 2.481 N/A SER 513.A OG GLU 510.A O no hydrogen 2.481 N/A SER 513.A OG GLU 510.A OE2 no hydrogen 3.102 N/A ASN 516.A N SER 513.A O no hydrogen 2.761 N/A LEU 519.A N ARG 562.A O no hydrogen 2.766 N/A ASN 523.A N PHE 521.A O no hydrogen 2.766 N/A ASN 523.A N ILE 566.A O no hydrogen 2.874 N/A ASN 523.A ND2 ASP 489.A OD1 no hydrogen 2.530 N/A ASN 525.A ND2 LEU 522.A O no hydrogen 3.314 N/A LYS 535.A N ASP 532.A O no hydrogen 3.304 N/A LEU 536.A N ASP 532.A O no hydrogen 3.036 N/A VAL 537.A N HIS 533.A O no hydrogen 2.934 N/A THR 539.A N LYS 535.A O no hydrogen 2.897 N/A PHE 540.A N LEU 536.A O no hydrogen 2.910 N/A ARG 541.A N VAL 537.A O no hydrogen 2.933 N/A LEU 542.A N ASN 538.A O no hydrogen 2.960 N/A MET 543.A N PHE 540.A O no hydrogen 3.142 N/A ARG 544.A N PHE 540.A O no hydrogen 2.997 N/A ARG 544.A NH1 GLU 618.A OE1 no hydrogen 2.720 N/A ARG 545.A N ARG 541.A O no hydrogen 2.921 N/A GLU 551.A N ILE 549.A O no hydrogen 2.736 N/A SER 554.A OG GLU 618.A OE1 no hydrogen 3.537 N/A SER 556.A OG ASP 621.A OD1 no hydrogen 2.633 N/A THR 557.A N ASP 621.A OD1 no hydrogen 3.084 N/A THR 557.A N ASP 621.A OD2 no hydrogen 2.881 N/A THR 557.A OG1 THR 557.A O no hydrogen 2.519 N/A ASN 558.A N CYS 563.A O no hydrogen 3.049 N/A CYS 563.A N ASN 558.A O no hydrogen 3.377 N/A CYS 563.A N ASP 561.A O no hydrogen 2.690 N/A TYR 565.A N SER 556.A O no hydrogen 3.314 N/A ILE 566.A N PHE 521.A O no hydrogen 2.879 N/A SER 567.A N SER 554.A O no hydrogen 3.325 N/A SER 568.A N ASN 523.A OD1 no hydrogen 2.389 N/A SER 568.A OG SER 568.A O no hydrogen 2.408 N/A ARG 572.A NE ASP 569.A O no hydrogen 2.409 N/A CYS 574.A SG LEU 573.A O no hydrogen 2.962 N/A CYS 574.A SG LEU 614.A O no hydrogen 3.204 N/A CYS 574.A SG ASP 615.A OD1 no hydrogen 3.268 N/A TYR 577.A N GLU 612.A O no hydrogen 2.542 N/A TYR 577.A OH GLU 619.A OE2 no hydrogen 3.129 N/A ILE 578.A N LEU 638.A O no hydrogen 2.934 N/A ILE 579.A N LEU 610.A O no hydrogen 2.961 N/A VAL 580.A N THR 636.A O no hydrogen 3.095 N/A LYS 584.A N VAL 580.A O no hydrogen 2.889 N/A ALA 586.A N ILE 579.A O no hydrogen 2.781 N/A VAL 587.A N PRO 585.A O no hydrogen 2.837 N/A THR 588.A OG1 VAL 587.A O no hydrogen 2.504 N/A THR 588.A OG1 HIS 591.A ND1 no hydrogen 3.009 N/A HIS 591.A ND1 VAL 587.A O no hydrogen 2.248 N/A GLU 593.A N GLU 593.A OE1 no hydrogen 2.605 N/A GLU 594.A N HIS 591.A O no hydrogen 2.684 N/A LEU 595.A N HIS 591.A O no hydrogen 2.196 N/A ALA 596.A N MET 592.A O no hydrogen 2.804 N/A LEU 606.A N GLU 603.A O no hydrogen 2.845 N/A SER 609.A OG GLU 608.A O no hydrogen 2.504 N/A VAL 611.A N PHE 605.A O no hydrogen 2.952 N/A GLU 612.A N TYR 577.A O no hydrogen 2.496 N/A LEU 614.A N ARG 575.A O no hydrogen 2.902 N/A GLU 618.A N SER 554.A OG no hydrogen 3.208 N/A ASN 620.A N VAL 616.A O no hydrogen 2.895 N/A ASN 620.A ND2 ASN 620.A O no hydrogen 2.419 N/A ASP 621.A N ASN 617.A O no hydrogen 2.980 N/A ASP 621.A N GLU 618.A O no hydrogen 3.138 N/A CYS 622.A N GLU 618.A O no hydrogen 2.877 N/A CYS 622.A SG GLU 618.A O no hydrogen 3.379 N/A CYS 622.A SG GLU 619.A O no hydrogen 3.655 N/A ILE 631.A N GLU 628.A O no hydrogen 2.832 N/A LYS 633.A NZ GLN 583.A O no hydrogen 2.256 N/A ASP 634.A N ASN 632.A O no hydrogen 2.389 N/A THR 636.A N ASN 623.A O no hydrogen 2.912 N/A LEU 638.A N ILE 578.A O no hydrogen 2.574 N/A GLU 639.A N ALA 625.A O no hydrogen 3.170 N/A GLY 651.A N GLY 647.A O no hydrogen 2.398 N/A TYR 655.A N GLY 942.A O no hydrogen 3.099 N/A TYR 655.A OH SER 948.A O no hydrogen 2.622 N/A HIS 658.A N TYR 655.A O no hydrogen 3.369 N/A ASN 659.A ND2 ASN 664.A OD1 no hydrogen 2.863 N/A ASN 659.A ND2 HIS 882.A ND1 no hydrogen 3.107 N/A ARG 663.A NE ARG 918.A O no hydrogen 2.630 N/A ARG 663.A NH2 SER 917.A O no hydrogen 3.465 N/A THR 665.A N SER 661.A O no hydrogen 2.914 N/A THR 665.A OG1 SER 661.A O no hydrogen 3.397 N/A THR 665.A OG1 PRO 662.A O no hydrogen 2.333 N/A TYR 666.A N PRO 662.A O no hydrogen 2.870 N/A GLN 667.A N ARG 663.A O no hydrogen 2.923 N/A CYS 668.A N ASN 664.A O no hydrogen 2.874 N/A CYS 668.A SG ALA 650.A O no hydrogen 3.457 N/A CYS 668.A SG ASN 664.A O no hydrogen 2.981 N/A ALA 669.A N THR 665.A O no hydrogen 2.987 N/A ALA 669.A N TYR 666.A O no hydrogen 3.081 N/A MET 670.A N TYR 666.A O no hydrogen 2.865 N/A GLY 671.A N GLN 667.A O no hydrogen 2.874 N/A LYS 672.A N ALA 669.A O no hydrogen 3.268 N/A LYS 672.A NZ CYS 668.A O no hydrogen 2.382 N/A GLN 673.A N GLN 673.A OE1 no hydrogen 3.129 N/A MET 675.A N LYS 992.A O no hydrogen 2.823 N/A ASN 684.A N ASN 681.A O no hydrogen 2.716 N/A ARG 685.A N GLN 682.A O no hydrogen 3.276 N/A TYR 691.A N LEU 689.A O no hydrogen 2.541 N/A LEU 692.A N MET 690.A O no hydrogen 2.651 N/A LYS 702.A N HIS 940.A O no hydrogen 2.954 N/A LYS 702.A NZ GLU 707.A OE2 no hydrogen 3.337 N/A LYS 704.A N THR 943.A OG1 no hydrogen 2.817 N/A ILE 706.A N THR 703.A O no hydrogen 2.529 N/A GLU 710.A N GLU 707.A O no hydrogen 2.841 N/A LYS 713.A N GLU 710.A O no hydrogen 3.291 N/A GLY 717.A N TYR 989.A OH no hydrogen 2.693 N/A ASN 719.A N GLN 697.A OE1 no hydrogen 3.044 N/A ALA 720.A N VAL 988.A O no hydrogen 2.964 N/A MET 725.A N MET 910.A O no hydrogen 2.672 N/A SER 728.A OG SER 728.A O no hydrogen 2.433 N/A ASP 734.A N ILE 732.A O no hydrogen 3.014 N/A ALA 735.A N ASP 731.A O no hydrogen 2.737 N/A LEU 736.A N VAL 887.A O no hydrogen 2.386 N/A ASN 739.A N ASP 907.A O no hydrogen 3.073 N/A ASN 739.A ND2 LYS 740.A O no hydrogen 2.185 N/A ASN 739.A ND2 SER 742.A OG no hydrogen 2.985 N/A LYS 740.A N VAL 892.A O no hydrogen 2.378 N/A ALA 741.A N ASP 744.A OD2 no hydrogen 2.332 N/A SER 742.A OG ASP 907.A OD1 no hydrogen 2.850 N/A GLY 746.A N LEU 743.A O no hydrogen 3.392 N/A PHE 747.A N SER 742.A O no hydrogen 2.440 N/A CYS 750.A SG ARG 749.A O no hydrogen 3.079 N/A CYS 750.A SG ARG 870.A O no hydrogen 3.405 N/A LYS 754.A NZ ASP 999.A OD1 no hydrogen 2.488 N/A CYS 758.A N ILE 862.A O no hydrogen 3.387 N/A THR 759.A OG1 THR 759.A O no hydrogen 2.500 N/A LEU 760.A N PHE 860.A O no hydrogen 2.473 N/A LYS 761.A NZ THR 759.A O no hydrogen 3.441 N/A LYS 761.A NZ THR 759.A OG1 no hydrogen 2.320 N/A THR 764.A OG1 ASN 765.A OD1 no hydrogen 2.666 N/A VAL 771.A N PHE 768.A O no hydrogen 2.991 N/A MET 772.A N LYS 770.A O no hydrogen 2.835 N/A THR 780.A OG1 PRO 783.A O no hydrogen 2.828 N/A ARG 781.A N PRO 783.A O no hydrogen 2.937 N/A ALA 792.A N ASP 791.A OD1 no hydrogen 2.579 N/A GLY 794.A N ASP 791.A O no hydrogen 3.184 N/A CYS 796.A SG ASP 791.A OD2 no hydrogen 2.967 N/A SER 797.A OG LEU 790.A O no hydrogen 2.360 N/A SER 797.A OG CYS 796.A O no hydrogen 2.460 N/A GLY 799.A N SER 797.A O no hydrogen 2.479 N/A VAL 802.A N GLU 800.A O no hydrogen 2.561 N/A GLN 806.A N GLU 803.A O no hydrogen 3.030 N/A LEU 808.A N ILE 837.A O no hydrogen 3.197 N/A VAL 809.A N ILE 837.A O no hydrogen 3.137 N/A SER 812.A OG ASP 834.A OD1 no hydrogen 2.821 N/A THR 815.A OG1 MET 813.A O no hydrogen 3.504 N/A THR 817.A N PRO 814.A O no hydrogen 2.902 N/A THR 817.A OG1 GLN 766.A OE1 no hydrogen 2.292 N/A THR 817.A OG1 PRO 814.A O no hydrogen 2.715 N/A GLN 818.A N GLN 766.A OE1 no hydrogen 2.701 N/A GLU 822.A N GLU 822.A OE1 no hydrogen 2.512 N/A GLY 823.A N LEU 821.A O no hydrogen 2.669 N/A GLN 828.A N GLN 828.A OE1 no hydrogen 2.930 N/A GLN 829.A N PRO 827.A O no hydrogen 2.399 N/A GLN 829.A NE2 THR 767.A O no hydrogen 2.259 N/A TYR 832.A OH GLN 829.A OE1 no hydrogen 2.770 N/A VAL 835.A N LYS 811.A O no hydrogen 3.136 N/A ILE 837.A N VAL 809.A O no hydrogen 2.798 N/A LYS 840.A NZ SER 845.A OG no hydrogen 2.646 N/A THR 843.A OG1 ALA 842.A O no hydrogen 2.343 N/A GLU 848.A N LEU 865.A O no hydrogen 2.894 N/A LYS 849.A NZ ARG 683.A O no hydrogen 3.541 N/A SER 854.A OG ASN 855.A O no hydrogen 3.278 N/A GLU 857.A N ASN 855.A OD1 no hydrogen 3.031 N/A ASP 858.A N ASN 855.A O no hydrogen 3.201 N/A LEU 861.A N SER 853.A O no hydrogen 3.080 N/A LYS 863.A N MET 851.A O no hydrogen 3.237 N/A LEU 865.A N LYS 849.A O no hydrogen 3.084 N/A ARG 867.A N TYR 846.A O no hydrogen 3.457 N/A ARG 867.A NH1 GLU 848.A OE1 no hydrogen 3.350 N/A GLN 868.A N VAL 752.A O no hydrogen 2.684 N/A THR 869.A OG1 CYS 750.A O no hydrogen 3.008 N/A ARG 870.A N GLN 868.A O no hydrogen 2.736 N/A ARG 870.A NE GLN 868.A OE1 no hydrogen 3.055 N/A ARG 870.A NH1 ASP 999.A OD1 no hydrogen 2.815 N/A ARG 870.A NH2 GLN 868.A OE1 no hydrogen 2.344 N/A ASP 876.A N GLU 873.A O no hydrogen 3.113 N/A LYS 877.A NZ HIS 995.A O no hydrogen 2.861 N/A PHE 878.A N GLY 886.A O no hydrogen 3.171 N/A SER 879.A N GLN 991.A O no hydrogen 3.187 N/A SER 879.A OG GLN 667.A OE1 no hydrogen 3.489 N/A SER 880.A N SER 879.A OG no hydrogen 2.442 N/A CYS 888.A SG GLU 873.A O no hydrogen 3.842 N/A CYS 888.A SG ASP 876.A O no hydrogen 4.015 N/A GLY 889.A N LEU 736.A O no hydrogen 2.650 N/A GLN 894.A NE2 GLN 894.A O no hydrogen 3.029 N/A GLU 895.A N GLU 895.A OE2 no hydrogen 3.057 N/A ASP 896.A N PRO 893.A O no hydrogen 3.009 N/A MET 897.A N GLN 894.A O no hydrogen 3.224 N/A PHE 899.A N THR 971.A O no hydrogen 3.305 N/A CYS 900.A N ILE 904.A O no hydrogen 3.017 N/A CYS 900.A SG ILE 904.A O no hydrogen 3.521 N/A CYS 905.A SG PRO 906.A O no hydrogen 3.848 N/A ASP 907.A N THR 721.A O no hydrogen 3.180 N/A ILE 908.A N THR 721.A O no hydrogen 3.242 N/A ASN 911.A ND2 ASP 731.A O no hydrogen 3.348 N/A ASN 911.A ND2 ILE 732.A O no hydrogen 3.367 N/A HIS 913.A N ASN 911.A O no hydrogen 2.533 N/A ARG 918.A NH1 GLY 914.A O no hydrogen 3.053 N/A MET 919.A N PHE 915.A O no hydrogen 2.431 N/A THR 920.A OG1 THR 920.A O no hydrogen 2.421 N/A GLY 922.A N ASN 659.A OD1 no hydrogen 3.088 N/A LYS 923.A NZ SER 880.A OG no hydrogen 2.244 N/A LEU 928.A N ILE 925.A O no hydrogen 2.601 N/A ALA 929.A N ILE 925.A O no hydrogen 3.113 N/A GLY 930.A N GLU 926.A O no hydrogen 2.967 N/A ALA 932.A N LEU 928.A O no hydrogen 2.890 N/A GLY 933.A N GLY 930.A O no hydrogen 2.859 N/A VAL 934.A N GLY 930.A O no hydrogen 2.962 N/A GLY 937.A N VAL 934.A O no hydrogen 3.089 N/A TYR 941.A OH GLU 707.A OE2 no hydrogen 2.096 N/A GLY 942.A N LYS 702.A O no hydrogen 3.018 N/A GLY 946.A N THR 943.A O no hydrogen 2.805 N/A SER 948.A OG TYR 941.A O no hydrogen 3.238 N/A LYS 949.A NZ GLY 946.A O no hydrogen 3.256 N/A CYS 954.A N VAL 950.A O no hydrogen 2.902 N/A CYS 954.A SG VAL 950.A O no hydrogen 2.986 N/A CYS 954.A SG TYR 964.A O no hydrogen 2.999 N/A GLU 955.A N LYS 951.A O no hydrogen 2.961 N/A ASP 956.A N ASP 952.A O no hydrogen 2.916 N/A LEU 957.A N VAL 953.A O no hydrogen 2.956 N/A VAL 958.A N CYS 954.A O no hydrogen 2.963 N/A ARG 959.A N GLU 955.A O no hydrogen 2.899 N/A HIS 960.A N ASP 956.A O no hydrogen 3.097 N/A GLY 961.A N VAL 958.A O no hydrogen 3.045 N/A TYR 962.A N LEU 957.A O no hydrogen 2.701 N/A ASN 963.A ND2 TYR 969.A OH no hydrogen 2.426 N/A ASP 968.A N ILE 983.A O no hydrogen 2.920 N/A THR 971.A N PHE 899.A O no hydrogen 3.337 N/A THR 971.A OG1 PHE 899.A O no hydrogen 3.426 N/A SER 972.A N GLU 977.A O no hydrogen 3.066 N/A SER 972.A OG GLU 977.A O no hydrogen 3.038 N/A THR 975.A OG1 GLU 977.A OE1 no hydrogen 2.992 N/A THR 975.A OG1 GLU 977.A OE2 no hydrogen 3.171 N/A GLY 976.A N SER 972.A O no hydrogen 2.697 N/A LEU 979.A N VAL 970.A O no hydrogen 2.753 N/A ILE 983.A N ASP 968.A O no hydrogen 3.070 N/A VAL 988.A N ALA 720.A O no hydrogen 2.848 N/A LEU 993.A N LYS 877.A O no hydrogen 3.335 N/A LYS 1000.A NZ HIS 995.A ND1 no hydrogen 2.732 N/A ARG 1004.A NE GLY 1024.A O no hydrogen 2.685 N/A ARG 1004.A NH1 THR 1017.A OG1 no hydrogen 2.756 N/A ARG 1004.A NH2 GLY 1024.A O no hydrogen 2.336 N/A ARG 1009.A N ASP 1054.A OD2 no hydrogen 2.386 N/A ARG 1009.A NH1 ARG 1014.A O no hydrogen 3.395 N/A ALA 1010.A N GLN 1015.A O no hydrogen 2.953 N/A ARG 1014.A NH1 TYR 1089.A O no hydrogen 3.045 N/A GLN 1015.A NE2 GLU 1018.A OE1 no hydrogen 3.483 N/A THR 1017.A OG1 THR 1017.A O no hydrogen 2.457 N/A GLU 1018.A N PRO 1016.A O no hydrogen 2.841 N/A GLY 1024.A N ASP 1023.A OD1 no hydrogen 3.077 N/A GLU 1032.A N GLU 1032.A OE1 no hydrogen 2.917 N/A ARG 1033.A N GLY 1029.A O no hydrogen 3.302 N/A ARG 1033.A NH1 GLY 1029.A O no hydrogen 2.774 N/A ASP 1034.A N GLU 1030.A O no hydrogen 3.010 N/A CYS 1035.A N MET 1031.A O no hydrogen 2.898 N/A LEU 1036.A N GLU 1032.A O no hydrogen 2.907 N/A ILE 1037.A N ARG 1033.A O no hydrogen 2.885 N/A GLY 1038.A N CYS 1035.A O no hydrogen 2.971 N/A LEU 1045.A N ALA 1041.A O no hydrogen 3.331 N/A LEU 1046.A N SER 1042.A O no hydrogen 2.986 N/A GLU 1047.A N MET 1043.A O no hydrogen 2.804 N/A ARG 1048.A N LEU 1044.A O no hydrogen 2.961 N/A ARG 1048.A NE ARG 1048.A O no hydrogen 3.151 N/A ARG 1048.A NH2 SER 1052.A O no hydrogen 3.487 N/A LEU 1049.A N LEU 1045.A O no hydrogen 2.900 N/A MET 1050.A N LEU 1046.A O no hydrogen 2.853 N/A ILE 1051.A N GLU 1047.A O no hydrogen 2.915 N/A SER 1052.A N LEU 1049.A O no hydrogen 3.382 N/A SER 1052.A OG LEU 1049.A O no hydrogen 2.993 N/A SER 1053.A N SER 1052.A OG no hydrogen 2.770 N/A CYS 1061.A SG GLN 1063.A O no hydrogen 3.334 N/A CYS 1061.A SG HIS 1081.A O no hydrogen 3.893 N/A GLY 1068.A N ASP 1059.A O no hydrogen 3.370 N/A CYS 1073.A SG ASP 1059.A OD1 no hydrogen 3.294 N/A CYS 1073.A SG TYR 1069.A O no hydrogen 3.050 N/A CYS 1073.A SG SER 1070.A O no hydrogen 3.930 N/A HIS 1074.A ND1 TRP 1072.A O no hydrogen 3.302 N/A SER 1079.A OG LYS 1077.A O no hydrogen 3.429 N/A CYS 1080.A N SER 1078.A OG no hydrogen 3.409 N/A SER 1083.A N ASP 1059.A OD2 no hydrogen 2.360 N/A SER 1083.A OG VAL 1060.A O no hydrogen 3.033 N/A SER 1084.A N ASP 1059.A OD2 no hydrogen 3.411 N/A SER 1084.A OG SER 1083.A O no hydrogen 2.492 N/A LEU 1085.A N VAL 1058.A O no hydrogen 2.734 N/A ILE 1087.A N PHE 1056.A O no hydrogen 3.053 N/A LEU 1093.A N TYR 1089.A O no hydrogen 2.915 N/A LEU 1094.A N ALA 1090.A O no hydrogen 2.891 N/A PHE 1095.A N CYS 1091.A O no hydrogen 2.890 N/A GLN 1096.A N LYS 1092.A O no hydrogen 2.967 N/A GLN 1096.A NE2 LYS 1092.A O no hydrogen 2.812 N/A GLU 1097.A N LEU 1093.A O no hydrogen 2.878 N/A LEU 1098.A N LEU 1094.A O no hydrogen 2.902 N/A GLN 1099.A N PHE 1095.A O no hydrogen 2.941 N/A GLN 1099.A N GLN 1096.A O no hydrogen 2.883 N/A SER 1100.A OG GLU 1097.A O no hydrogen 2.891 N/A