Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wqt_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ARG 868.A O no hydrogen 3.462 N/A PHE 6.A N ILE 870.A O no hydrogen 3.417 N/A ARG 8.A N ASP 875.A OD2 no hydrogen 2.765 N/A ILE 9.A N ASP 875.A OD2 no hydrogen 3.176 N/A GLU 11.A N ILE 9.A O no hydrogen 3.045 N/A LEU 18.A N ASP 584.A OD1 no hydrogen 2.975 N/A GLU 20.A N PRO 17.A O no hydrogen 2.799 N/A GLN 22.A N THR 19.A O no hydrogen 2.914 N/A VAL 23.A N THR 19.A O no hydrogen 2.920 N/A SER 25.A OG THR 329.A OG1 no hydrogen 3.129 N/A TYR 26.A N GLN 22.A O no hydrogen 3.291 N/A TYR 26.A N VAL 23.A O no hydrogen 2.880 N/A TYR 26.A OH PRO 113.A O no hydrogen 2.374 N/A ARG 27.A N VAL 23.A O no hydrogen 3.157 N/A ARG 27.A NH1 GLU 24.A OE1 no hydrogen 3.549 N/A ARG 28.A N GLU 24.A O no hydrogen 2.808 N/A LEU 30.A N TYR 26.A O no hydrogen 3.153 N/A GLN 31.A NE2 VAL 34.A O no hydrogen 2.653 N/A GLN 31.A NE2 PRO 35.A O no hydrogen 2.844 N/A LYS 38.A N PRO 35.A O no hydrogen 3.160 N/A GLU 40.A N GLN 31.A OE1 no hydrogen 3.055 N/A ILE 44.A N ALA 29.A O no hydrogen 2.716 N/A ALA 46.A N ASN 41.A O no hydrogen 2.590 N/A ALA 47.A N GLY 43.A O no hydrogen 2.833 N/A PHE 48.A N ILE 44.A O no hydrogen 3.188 N/A PHE 48.A N GLN 45.A O no hydrogen 2.697 N/A ARG 49.A N GLN 45.A O no hydrogen 3.203 N/A GLU 50.A N ALA 46.A O no hydrogen 3.092 N/A THR 51.A OG1 GLU 50.A OE1 no hydrogen 2.777 N/A PHE 62.A N ASP 61.A OD1 no hydrogen 2.955 N/A LEU 63.A N ARG 91.A O no hydrogen 3.175 N/A GLU 64.A N ARG 91.A O no hydrogen 3.245 N/A TYR 65.A OH GLN 31.A O no hydrogen 3.263 N/A ARG 66.A NH2 GLU 106.A OE2 no hydrogen 3.508 N/A CYS 77.A N PRO 73.A O no hydrogen 3.340 N/A CYS 77.A N GLN 74.A O no hydrogen 2.612 N/A CYS 77.A SG PHE 72.A O no hydrogen 3.779 N/A CYS 77.A SG PRO 73.A O no hydrogen 3.144 N/A GLU 79.A N ASP 75.A O no hydrogen 3.032 N/A LYS 80.A N GLU 76.A O no hydrogen 2.884 N/A LYS 80.A NZ GLU 76.A OE1 no hydrogen 3.513 N/A ASP 81.A N ARG 78.A O no hydrogen 3.281 N/A LEU 82.A N CYS 77.A O no hydrogen 2.762 N/A TYR 84.A N ILE 122.A O no hydrogen 2.922 N/A GLN 85.A NE2 HIS 111.A O no hydrogen 3.430 N/A GLN 85.A NE2 GLU 373.A OE2 no hydrogen 3.171 N/A LEU 88.A N GLY 110.A O no hydrogen 3.234 N/A TYR 89.A N ARG 66.A O no hydrogen 3.262 N/A ARG 91.A N GLU 64.A O no hydrogen 2.916 N/A ILE 95.A N VAL 59.A O no hydrogen 2.868 N/A VAL 107.A N ALA 90.A O no hydrogen 2.698 N/A LEU 109.A N LEU 88.A O no hydrogen 2.806 N/A GLY 110.A N SER 369.A OG no hydrogen 3.244 N/A HIS 111.A N GLU 373.A OE2 no hydrogen 3.218 N/A ILE 112.A N ALA 86.A O no hydrogen 3.138 N/A THR 116.A N SER 120.A O no hydrogen 2.782 N/A THR 116.A OG1 SER 120.A O no hydrogen 2.582 N/A GLY 119.A N THR 116.A O no hydrogen 2.679 N/A SER 120.A OG ASP 118.A OD1 no hydrogen 2.897 N/A PHE 121.A N ARG 128.A O no hydrogen 3.417 N/A ASN 124.A ND2 GLU 782.A OE2 no hydrogen 2.766 N/A GLY 125.A N LEU 82.A O no hydrogen 2.999 N/A ARG 128.A N PHE 121.A O no hydrogen 2.651 N/A ARG 128.A NE GLN 387.A O no hydrogen 3.478 N/A ARG 128.A NH1 SER 381.A O no hydrogen 3.364 N/A VAL 129.A N GLN 387.A O no hydrogen 2.866 N/A GLN 133.A NE2 ALA 406.A O no hydrogen 2.835 N/A ILE 134.A N SER 405.A O no hydrogen 3.034 N/A SER 137.A OG TYR 141.A OH no hydrogen 2.580 N/A SER 137.A OG ASN 324.A O no hydrogen 2.978 N/A TYR 141.A N SER 155.A O no hydrogen 2.905 N/A TYR 141.A OH SER 137.A O no hydrogen 2.574 N/A PHE 142.A N ASP 317.A OD2 no hydrogen 2.822 N/A THR 143.A N ILE 153.A O no hydrogen 3.027 N/A THR 143.A OG1 PRO 144.A O no hydrogen 3.525 N/A ASP 145.A N ARG 151.A O no hydrogen 3.516 N/A ARG 148.A N ASP 145.A OD1 no hydrogen 3.016 N/A ILE 153.A N THR 143.A O no hydrogen 2.940 N/A ALA 154.A N LEU 168.A O no hydrogen 2.722 N/A SER 155.A N TYR 141.A O no hydrogen 2.678 N/A SER 155.A OG ALA 154.A O no hydrogen 3.155 N/A SER 155.A OG ASP 167.A OD2 no hydrogen 3.169 N/A ILE 156.A N ILE 166.A O no hydrogen 2.904 N/A LYS 161.A NZ PRO 409.A O no hydrogen 2.727 N/A ILE 166.A N ILE 156.A O no hydrogen 3.185 N/A ASP 167.A N LYS 179.A O no hydrogen 3.098 N/A LEU 168.A N ALA 154.A O no hydrogen 3.028 N/A GLU 169.A N SER 177.A O no hydrogen 2.867 N/A ASN 173.A N GLU 171.A OE2 no hydrogen 2.855 N/A ASN 173.A ND2 GLU 171.A OE1 no hydrogen 3.095 N/A GLY 174.A N GLU 171.A O no hydrogen 2.992 N/A SER 177.A N GLU 169.A O no hydrogen 2.667 N/A LYS 179.A N ASP 167.A O no hydrogen 3.015 N/A VAL 180.A N ARG 183.A O no hydrogen 3.176 N/A LEU 189.A N PRO 186.A O no hydrogen 2.868 N/A LEU 191.A N LEU 187.A O no hydrogen 2.896 N/A ARG 192.A N VAL 188.A O no hydrogen 2.825 N/A ARG 192.A NE ARG 192.A O no hydrogen 3.252 N/A ARG 192.A NH2 ASP 197.A OD2 no hydrogen 3.322 N/A VAL 193.A N LEU 189.A O no hydrogen 3.110 N/A LEU 194.A N LEU 191.A O no hydrogen 2.900 N/A GLY 195.A N ARG 192.A O no hydrogen 2.970 N/A TYR 196.A N LEU 191.A O no hydrogen 3.162 N/A THR 200.A N GLU 199.A OE2 no hydrogen 2.539 N/A THR 200.A OG1 GLU 204.A OE1 no hydrogen 2.887 N/A LEU 201.A N ASP 197.A O no hydrogen 2.691 N/A ALA 202.A N GLN 198.A O no hydrogen 2.996 N/A ARG 203.A N GLU 199.A O no hydrogen 3.222 N/A LEU 205.A N ALA 202.A O no hydrogen 2.784 N/A TYR 208.A OH ARG 302.A O no hydrogen 2.806 N/A VAL 212.A N GLY 209.A O no hydrogen 2.796 N/A GLN 213.A N GLU 210.A O no hydrogen 3.482 N/A GLN 213.A NE2 GLU 210.A O no hydrogen 3.660 N/A GLY 214.A N LEU 211.A O no hydrogen 2.759 N/A LEU 215.A N VAL 212.A O no hydrogen 2.806 N/A MET 216.A N VAL 212.A O no hydrogen 3.056 N/A GLU 218.A N ASP 217.A OD1 no hydrogen 2.574 N/A VAL 220.A N GLU 218.A OE1 no hydrogen 2.949 N/A PHE 221.A N GLU 218.A OE1 no hydrogen 2.461 N/A ALA 222.A N GLU 218.A OE1 no hydrogen 3.445 N/A ARG 224.A N PHE 221.A O no hydrogen 2.932 N/A ALA 228.A N PRO 225.A O no hydrogen 2.778 N/A LEU 229.A N GLU 226.A O no hydrogen 3.008 N/A ARG 231.A N GLU 227.A O no hydrogen 3.382 N/A LEU 232.A N ALA 228.A O no hydrogen 2.757 N/A PHE 233.A N LEU 229.A O no hydrogen 3.030 N/A THR 234.A N ILE 230.A O no hydrogen 3.395 N/A THR 234.A OG1 ILE 230.A O no hydrogen 2.997 N/A THR 234.A OG1 ARG 231.A O no hydrogen 2.975 N/A LEU 235.A N LEU 232.A O no hydrogen 2.980 N/A LEU 236.A N PHE 233.A O no hydrogen 2.641 N/A LYS 246.A N ARG 244.A O no hydrogen 2.518 N/A ALA 247.A N ASP 245.A O no hydrogen 2.415 N/A TYR 250.A N LYS 246.A O no hydrogen 2.894 N/A VAL 251.A N ALA 247.A O no hydrogen 2.927 N/A TYR 252.A N ALA 249.A O no hydrogen 2.663 N/A GLY 253.A N TYR 250.A O no hydrogen 2.705 N/A ARG 260.A NH1 ALA 46.A O no hydrogen 3.409 N/A GLY 264.A N ASP 262.A O no hydrogen 2.968 N/A ARG 268.A NH1 ILE 277.A O no hydrogen 3.173 N/A ARG 268.A NH2 ILE 277.A O no hydrogen 3.474 N/A TYR 269.A N GLU 265.A O no hydrogen 2.602 N/A TYR 269.A OH GLY 323.A O no hydrogen 2.413 N/A TYR 269.A OH ASN 324.A OD1 no hydrogen 3.290 N/A LYS 270.A NZ PRO 138.A O no hydrogen 2.636 N/A LYS 270.A NZ ALA 266.A O no hydrogen 2.379 N/A ALA 271.A N GLY 267.A O no hydrogen 3.283 N/A ALA 271.A N ARG 268.A O no hydrogen 2.690 N/A GLU 273.A N TYR 269.A O no hydrogen 3.127 N/A LYS 274.A NZ ASN 324.A OD1 no hydrogen 2.537 N/A LEU 275.A N ALA 271.A O no hydrogen 2.880 N/A THR 283.A OG1 ARG 259.A O no hydrogen 2.675 N/A ALA 285.A N THR 283.A O no hydrogen 2.571 N/A GLU 291.A N ASP 289.A O no hydrogen 2.725 N/A THR 300.A N VAL 296.A O no hydrogen 3.128 N/A THR 300.A OG1 VAL 296.A O no hydrogen 2.554 N/A THR 300.A OG1 PHE 297.A O no hydrogen 2.843 N/A LEU 301.A N PHE 297.A O no hydrogen 3.286 N/A ARG 302.A N LEU 298.A O no hydrogen 2.766 N/A TYR 303.A N PRO 299.A O no hydrogen 2.767 N/A PHE 305.A N LEU 301.A O no hydrogen 3.013 N/A LEU 307.A N TYR 303.A O no hydrogen 3.218 N/A THR 308.A N LEU 304.A O no hydrogen 3.089 N/A THR 308.A OG1 LEU 304.A O no hydrogen 2.609 N/A ALA 309.A N ALA 306.A O no hydrogen 3.275 N/A HIS 321.A N ASP 318.A OD1 no hydrogen 2.679 N/A HIS 321.A ND1 THR 427.A OG1 no hydrogen 2.802 N/A ARG 325.A N LEU 322.A O no hydrogen 2.820 N/A ARG 326.A NE GLU 332.A OE2 no hydrogen 3.263 N/A ARG 328.A N GLN 133.A O no hydrogen 2.568 N/A ARG 328.A NH1 GLN 133.A OE1 no hydrogen 3.099 N/A THR 329.A OG1 SER 25.A OG no hydrogen 3.129 N/A GLY 331.A N SER 25.A OG no hydrogen 2.563 N/A LEU 333.A N THR 329.A O no hydrogen 3.006 N/A MET 334.A N VAL 330.A O no hydrogen 2.770 N/A THR 335.A N GLY 331.A O no hydrogen 2.753 N/A ASP 336.A N GLU 332.A O no hydrogen 2.759 N/A GLN 337.A N LEU 333.A O no hydrogen 3.085 N/A PHE 338.A N MET 334.A O no hydrogen 2.832 N/A ARG 339.A N THR 335.A O no hydrogen 2.933 N/A VAL 340.A N ASP 336.A O no hydrogen 3.246 N/A GLY 341.A N GLN 337.A O no hydrogen 3.230 N/A LEU 342.A N PHE 338.A O no hydrogen 2.982 N/A ALA 343.A N ARG 339.A O no hydrogen 2.942 N/A ARG 344.A N VAL 340.A O no hydrogen 2.874 N/A LEU 345.A N GLY 341.A O no hydrogen 2.686 N/A LEU 345.A N LEU 342.A O no hydrogen 2.922 N/A ALA 346.A N LEU 342.A O no hydrogen 2.775 N/A GLY 348.A N LEU 345.A O no hydrogen 2.953 N/A VAL 349.A N LEU 345.A O no hydrogen 3.423 N/A ARG 350.A N ALA 346.A O no hydrogen 3.244 N/A ARG 352.A N GLY 348.A O no hydrogen 2.676 N/A ARG 352.A NH2 VAL 367.A O no hydrogen 2.619 N/A GLY 356.A N MET 353.A O no hydrogen 3.014 N/A SER 357.A OG SER 360.A OG no hydrogen 3.343 N/A SER 360.A OG SER 357.A O no hydrogen 2.541 N/A THR 362.A OG1 LEU 361.A O no hydrogen 2.561 N/A LYS 365.A NZ SER 357.A OG no hydrogen 3.105 N/A LEU 366.A N PRO 363.A O no hydrogen 2.982 N/A VAL 367.A N ALA 364.A O no hydrogen 2.925 N/A SER 369.A OG PHE 108.A O no hydrogen 3.185 N/A GLU 373.A N SER 369.A O no hydrogen 2.897 N/A ALA 374.A N ARG 370.A O no hydrogen 3.179 N/A ALA 375.A N PRO 371.A O no hydrogen 3.307 N/A ILE 376.A N LEU 372.A O no hydrogen 3.364 N/A ARG 377.A N GLU 373.A O no hydrogen 2.978 N/A GLU 378.A N ALA 374.A O no hydrogen 3.016 N/A GLU 378.A N ALA 375.A O no hydrogen 2.675 N/A PHE 379.A N ALA 375.A O no hydrogen 3.014 N/A PHE 380.A N ILE 376.A O no hydrogen 3.160 N/A SER 381.A OG ARG 377.A O no hydrogen 2.443 N/A ARG 382.A N GLU 378.A O no hydrogen 2.572 N/A SER 383.A N PHE 379.A O no hydrogen 3.401 N/A LEU 385.A N SER 383.A OG no hydrogen 3.253 N/A GLN 387.A N VAL 129.A O no hydrogen 2.906 N/A LYS 389.A N ASP 127.A O no hydrogen 3.165 N/A LYS 389.A NZ ASP 118.A OD2 no hydrogen 3.506 N/A THR 392.A OG1 ASP 390.A OD2 no hydrogen 2.945 N/A ASN 393.A N SER 396.A OG no hydrogen 2.974 N/A ASN 393.A ND2 GLN 559.A O no hydrogen 3.383 N/A ASN 393.A ND2 ALA 562.A O no hydrogen 3.078 N/A SER 396.A N ASN 393.A OD1 no hydrogen 3.169 N/A SER 396.A OG ASP 390.A O no hydrogen 2.884 N/A SER 396.A OG ASN 393.A O no hydrogen 2.527 N/A SER 397.A N ASN 393.A O no hydrogen 3.475 N/A SER 397.A OG PRO 394.A O no hydrogen 2.870 N/A LEU 398.A N PRO 394.A O no hydrogen 3.401 N/A ARG 399.A N LEU 395.A O no hydrogen 3.105 N/A ARG 399.A NH1 ASN 557.A OD1 no hydrogen 2.891 N/A HIS 400.A N SER 396.A O no hydrogen 3.089 N/A LYS 401.A N LEU 398.A O no hydrogen 2.967 N/A LYS 401.A NZ ASP 118.A O no hydrogen 2.937 N/A ARG 402.A N ARG 399.A O no hydrogen 2.857 N/A ARG 402.A NH1 ALA 450.A O no hydrogen 3.204 N/A ARG 402.A NH2 ALA 450.A O no hydrogen 2.684 N/A ARG 402.A NH2 ALA 451.A O no hydrogen 3.455 N/A SER 405.A N SER 132.A O no hydrogen 3.219 N/A SER 405.A OG LEU 407.A O no hydrogen 3.151 N/A ALA 406.A N LEU 445.A O no hydrogen 3.088 N/A THR 413.A OG1 ALA 406.A O no hydrogen 2.593 N/A ARG 422.A N GLY 418.A O no hydrogen 2.940 N/A ARG 422.A NH1 ILE 443.A O no hydrogen 3.332 N/A THR 427.A OG1 HIS 321.A ND1 no hydrogen 2.802 N/A HIS 428.A N HIS 425.A O no hydrogen 2.994 N/A TYR 429.A N ARG 426.A O no hydrogen 3.386 N/A ARG 431.A N HIS 428.A O no hydrogen 2.691 N/A ARG 431.A NH2 MET 480.A O no hydrogen 2.868 N/A ILE 432.A N HIS 428.A O no hydrogen 2.870 N/A CYS 433.A SG THR 538.A OG1 no hydrogen 3.282 N/A THR 437.A OG1 PRO 438.A O no hydrogen 3.502 N/A THR 437.A OG1 ILE 446.A O no hydrogen 3.231 N/A GLY 444.A N THR 437.A OG1 no hydrogen 2.553 N/A LEU 445.A N ASN 442.A O no hydrogen 2.871 N/A THR 447.A N ILE 404.A O no hydrogen 2.847 N/A THR 447.A OG1 CYS 433.A O no hydrogen 3.049 N/A THR 447.A OG1 SER 448.A O no hydrogen 3.459 N/A SER 448.A OG GLU 436.A OE1 no hydrogen 2.990 N/A ALA 450.A N ARG 431.A O no hydrogen 3.222 N/A ARG 454.A NE TYR 479.A OH no hydrogen 2.637 N/A ASP 456.A N GLY 459.A O no hydrogen 3.187 N/A LEU 458.A N ASP 456.A OD2 no hydrogen 2.951 N/A ARG 462.A N ARG 454.A O no hydrogen 3.027 N/A ARG 462.A NH2 GLU 457.A OE1 no hydrogen 3.054 N/A THR 463.A N MET 480.A O no hydrogen 3.277 N/A TYR 465.A OH GLU 485.A OE1 no hydrogen 2.469 N/A ARG 466.A N MET 526.A O no hydrogen 2.673 N/A ARG 466.A NE THR 474.A O no hydrogen 3.581 N/A ARG 467.A N GLU 476.A O no hydrogen 3.385 N/A VAL 469.A N VAL 472.A O no hydrogen 3.026 N/A VAL 472.A N VAL 469.A O no hydrogen 3.113 N/A VAL 473.A N ASN 500.A O no hydrogen 2.957 N/A THR 474.A N ARG 467.A O no hydrogen 2.687 N/A THR 474.A OG1 ARG 467.A O no hydrogen 2.568 N/A TYR 479.A OH TYR 452.A O no hydrogen 3.298 N/A MET 480.A N THR 463.A O no hydrogen 3.003 N/A GLU 485.A N THR 481.A O no hydrogen 2.936 N/A ASP 486.A N THR 483.A O no hydrogen 3.201 N/A ARG 487.A N GLU 484.A O no hydrogen 3.104 N/A TYR 488.A N GLU 485.A O no hydrogen 2.947 N/A THR 489.A N GLU 524.A OE2 no hydrogen 2.763 N/A ILE 490.A N ARG 510.A O no hydrogen 3.397 N/A ALA 491.A N PHE 525.A O no hydrogen 2.912 N/A GLN 492.A N VAL 508.A O no hydrogen 3.420 N/A THR 495.A OG1 GLN 492.A O no hydrogen 3.197 N/A GLU 498.A N ARG 501.A O no hydrogen 3.083 N/A ASN 500.A N GLU 498.A O no hydrogen 3.030 N/A ILE 502.A N GLY 471.A O no hydrogen 2.657 N/A VAL 507.A N VAL 518.A O no hydrogen 3.273 N/A ALA 509.A N VAL 516.A O no hydrogen 2.860 N/A ARG 510.A N ILE 490.A O no hydrogen 2.636 N/A ARG 511.A N GLU 514.A O no hydrogen 2.804 N/A LYS 512.A NZ ASP 486.A O no hydrogen 2.991 N/A VAL 516.A N ALA 509.A O no hydrogen 2.696 N/A VAL 518.A N VAL 507.A O no hydrogen 3.016 N/A SER 519.A OG GLU 521.A OE2 no hydrogen 3.165 N/A GLU 522.A N SER 519.A O no hydrogen 3.130 N/A GLU 524.A N THR 489.A O no hydrogen 3.285 N/A PHE 525.A N THR 489.A O no hydrogen 3.135 N/A MET 526.A N ARG 466.A O no hydrogen 2.707 N/A ASP 527.A N ALA 491.A O no hydrogen 2.573 N/A SER 529.A N GLN 532.A OE1 no hydrogen 2.526 N/A LYS 531.A N SER 529.A OG no hydrogen 3.258 N/A LYS 531.A NZ GLU 11.A OE2 no hydrogen 3.488 N/A GLN 532.A NE2 PRO 464.A O no hydrogen 2.985 N/A VAL 533.A N PRO 530.A O no hydrogen 3.221 N/A PHE 534.A N LYS 531.A O no hydrogen 2.789 N/A SER 535.A OG LEU 449.A O no hydrogen 2.715 N/A THR 538.A N SER 535.A O no hydrogen 2.895 N/A THR 538.A OG1 SER 535.A O no hydrogen 2.575 N/A ASN 539.A N SER 535.A O no hydrogen 2.918 N/A ASN 539.A ND2 LYS 531.A O no hydrogen 3.552 N/A ASN 539.A ND2 PHE 534.A O no hydrogen 2.775 N/A ASN 539.A ND2 SER 535.A O no hydrogen 2.974 N/A ILE 541.A N THR 538.A O no hydrogen 2.802 N/A HIS 546.A N PHE 543.A O no hydrogen 2.692 N/A ASP 547.A N LEU 544.A O no hydrogen 2.961 N/A ASP 548.A N MET 848.A O no hydrogen 2.886 N/A ASN 550.A N ASP 548.A OD2 no hydrogen 3.066 N/A ALA 552.A N ASP 548.A O no hydrogen 2.789 N/A LEU 553.A N ALA 549.A O no hydrogen 3.020 N/A MET 554.A N ARG 551.A O no hydrogen 3.230 N/A GLY 555.A N ARG 551.A O no hydrogen 3.444 N/A SER 556.A N ALA 552.A O no hydrogen 2.875 N/A SER 556.A OG ALA 552.A O no hydrogen 2.644 N/A ASN 557.A N LEU 553.A O no hydrogen 3.307 N/A MET 558.A N MET 554.A O no hydrogen 2.847 N/A GLN 559.A N GLY 555.A O no hydrogen 3.299 N/A THR 560.A N ASN 557.A O no hydrogen 2.837 N/A THR 560.A OG1 ASN 537.A OD1 no hydrogen 3.274 N/A GLN 561.A N MET 558.A O no hydrogen 2.884 N/A GLN 561.A NE2 THR 560.A O no hydrogen 3.387 N/A ALA 562.A N GLN 559.A O no hydrogen 3.291 N/A VAL 563.A N LYS 964.A O no hydrogen 3.012 N/A ILE 566.A N THR 695.A O no hydrogen 2.923 N/A ARG 567.A NH1 ARG 691.A O no hydrogen 2.530 N/A ALA 568.A N ILE 566.A O no hydrogen 3.138 N/A ALA 570.A N GLU 656.A OE2 no hydrogen 2.832 N/A VAL 572.A N ASN 665.A OD1 no hydrogen 2.801 N/A MET 574.A N TYR 869.A O no hydrogen 2.673 N/A THR 575.A OG1 ASN 539.A O no hydrogen 2.480 N/A THR 575.A OG1 GLU 578.A OE1 no hydrogen 3.405 N/A GLY 576.A N GLU 578.A OE1 no hydrogen 2.543 N/A ARG 580.A NH1 ASP 584.A OD2 no hydrogen 2.801 N/A ARG 580.A NH2 LEU 15.A O no hydrogen 3.143 N/A ARG 580.A NH2 ASP 584.A OD1 no hydrogen 2.766 N/A ARG 580.A NH2 ASP 584.A OD2 no hydrogen 3.269 N/A VAL 581.A N LEU 577.A O no hydrogen 2.842 N/A VAL 582.A N GLU 578.A O no hydrogen 3.379 N/A ARG 583.A N ARG 580.A O no hydrogen 2.898 N/A ASP 584.A N ARG 580.A O no hydrogen 3.051 N/A SER 585.A N VAL 581.A O no hydrogen 2.890 N/A LEU 586.A N ARG 583.A O no hydrogen 2.924 N/A ALA 587.A N VAL 582.A O no hydrogen 3.456 N/A ALA 591.A N ASP 647.A O no hydrogen 3.194 N/A GLY 595.A N VAL 643.A O no hydrogen 3.225 N/A GLU 596.A N ARG 608.A O no hydrogen 3.267 N/A VAL 597.A N GLN 641.A O no hydrogen 3.259 N/A ALA 598.A N VAL 606.A O no hydrogen 2.746 N/A ASP 601.A N ARG 604.A O no hydrogen 2.884 N/A ASN 603.A ND2 GLY 602.A O no hydrogen 2.845 N/A ARG 604.A N ASP 601.A O no hydrogen 3.108 N/A ILE 605.A N TYR 617.A O no hydrogen 3.223 N/A VAL 606.A N LYS 599.A O no hydrogen 2.715 N/A VAL 607.A N VAL 615.A O no hydrogen 3.024 N/A ARG 608.A N GLU 596.A O no hydrogen 3.035 N/A TYR 609.A OH TYR 617.A OH no hydrogen 2.479 N/A GLU 610.A N ASP 594.A O no hydrogen 3.118 N/A ARG 613.A N TYR 609.A O no hydrogen 3.428 N/A VAL 615.A N VAL 607.A O no hydrogen 3.051 N/A TYR 617.A N ILE 605.A O no hydrogen 2.697 N/A TYR 617.A OH GLU 592.A OE2 no hydrogen 3.194 N/A TYR 617.A OH TYR 609.A OH no hydrogen 2.479 N/A LEU 619.A N ASN 603.A O no hydrogen 3.013 N/A TYR 623.A OH ASP 75.A OD2 no hydrogen 2.626 N/A ARG 624.A NH1 SER 625.A O no hydrogen 3.476 N/A ARG 624.A NH2 ILE 699.A O no hydrogen 3.366 N/A SER 625.A N THR 629.A O no hydrogen 3.341 N/A SER 625.A OG THR 629.A O no hydrogen 2.419 N/A SER 625.A OG ALA 630.A O no hydrogen 3.568 N/A ASN 626.A ND2 LYS 389.A O no hydrogen 2.681 N/A GLY 628.A N SER 625.A O no hydrogen 3.178 N/A ARG 634.A NH2 ILE 566.A O no hydrogen 2.952 N/A ARG 636.A N LEU 649.A O no hydrogen 2.856 N/A VAL 638.A N GLN 641.A OE1 no hydrogen 3.366 N/A VAL 643.A N GLY 595.A O no hydrogen 3.210 N/A LYS 645.A NZ GLU 592.A O no hydrogen 2.528 N/A GLY 646.A N ALA 591.A O no hydrogen 2.615 N/A LEU 649.A N LEU 589.A O no hydrogen 3.164 N/A ASP 651.A N ARG 634.A O no hydrogen 2.990 N/A SER 655.A N GLY 652.A O no hydrogen 3.270 N/A SER 655.A OG PHE 659.A O no hydrogen 3.513 N/A GLU 656.A N PHE 659.A O no hydrogen 2.856 N/A ASN 657.A N ASP 651.A OD1 no hydrogen 2.553 N/A PHE 659.A N GLU 656.A O no hydrogen 3.203 N/A ALA 661.A N ALA 654.A O no hydrogen 2.662 N/A GLN 664.A N ILE 962.A O no hydrogen 3.320 N/A ASN 665.A ND2 ALA 570.A O no hydrogen 2.598 N/A VAL 668.A N GLY 958.A O no hydrogen 2.620 N/A ALA 669.A N VAL 837.A O no hydrogen 2.857 N/A MET 671.A N LEU 839.A O no hydrogen 2.633 N/A PHE 673.A N ASN 677.A OD1 no hydrogen 2.841 N/A GLY 675.A N PHE 673.A O no hydrogen 2.457 N/A ASN 677.A ND2 ILE 838.A O no hydrogen 3.560 N/A SER 685.A N ASP 836.A O no hydrogen 2.910 N/A GLU 686.A N LEU 821.A O no hydrogen 2.961 N/A LEU 688.A N SER 685.A O no hydrogen 3.059 N/A LYS 690.A N GLU 686.A O no hydrogen 3.019 N/A LYS 690.A N GLU 687.A O no hydrogen 3.275 N/A LYS 690.A NZ GLU 687.A OE1 no hydrogen 2.674 N/A ARG 691.A N GLU 687.A O no hydrogen 3.458 N/A PHE 693.A N LEU 688.A O no hydrogen 3.167 N/A TYR 694.A OH GLN 664.A O no hydrogen 3.105 N/A THR 695.A OG1 ASP 692.A O no hydrogen 3.411 N/A SER 696.A N ARG 799.A O no hydrogen 3.266 N/A HIS 698.A N GLN 797.A O no hydrogen 2.895 N/A GLU 700.A N VAL 795.A O no hydrogen 2.505 N/A TYR 702.A N VAL 793.A O no hydrogen 3.183 N/A ILE 704.A N VAL 791.A O no hydrogen 2.937 N/A ALA 706.A N GLU 789.A O no hydrogen 2.780 N/A ARG 715.A N THR 753.A OG1 no hydrogen 2.621 N/A THR 717.A N GLY 751.A O no hydrogen 3.028 N/A LEU 723.A N ILE 720.A O no hydrogen 3.076 N/A LEU 728.A N GLU 725.A O no hydrogen 2.959 N/A ASP 732.A N ASP 730.A O no hydrogen 2.852 N/A GLY 735.A N GLU 733.A O no hydrogen 2.862 N/A ARG 738.A N ASP 730.A O no hydrogen 3.118 N/A ARG 738.A NH2 GLY 740.A O no hydrogen 3.565 N/A LYS 744.A NZ VAL 743.A O no hydrogen 2.846 N/A GLY 746.A N VAL 760.A O no hydrogen 3.177 N/A ASP 747.A N LYS 744.A O no hydrogen 2.932 N/A ILE 748.A N ASP 747.A OD1 no hydrogen 2.629 N/A LEU 749.A N LEU 758.A O no hydrogen 3.115 N/A GLY 751.A N GLY 735.A O no hydrogen 3.347 N/A ARG 752.A N SER 757.A OG no hydrogen 3.171 N/A THR 753.A OG1 ARG 715.A O no hydrogen 2.489 N/A SER 757.A OG ASP 755.A OD1 no hydrogen 3.518 N/A SER 757.A OG ASP 755.A OD2 no hydrogen 3.218 N/A LEU 758.A N VAL 750.A O no hydrogen 2.940 N/A VAL 760.A N ASP 747.A O no hydrogen 2.851 N/A GLY 765.A N GLU 764.A OE2 no hydrogen 3.422 N/A ILE 767.A N ALA 796.A O no hydrogen 2.637 N/A VAL 768.A N ALA 741.A O no hydrogen 3.206 N/A VAL 769.A N TYR 794.A O no hydrogen 2.899 N/A ARG 773.A NH1 GLU 733.A OE2 no hydrogen 3.083 N/A ARG 773.A NH2 GLU 733.A OE2 no hydrogen 2.955 N/A ASP 778.A N ARG 776.A O no hydrogen 2.502 N/A LEU 783.A N VAL 781.A O no hydrogen 2.989 N/A LYS 784.A NZ GLU 705.A OE2 no hydrogen 2.580 N/A VAL 787.A N LYS 784.A O no hydrogen 3.150 N/A ARG 788.A N ALA 706.A O no hydrogen 3.148 N/A ARG 788.A NH1 GLU 714.A O no hydrogen 2.791 N/A VAL 790.A N LEU 774.A O no hydrogen 3.220 N/A VAL 791.A N ILE 704.A O no hydrogen 2.730 N/A ARG 792.A N VAL 772.A O no hydrogen 3.074 N/A ARG 792.A NH2 ASP 81.A OD1 no hydrogen 2.497 N/A VAL 793.A N TYR 702.A O no hydrogen 3.048 N/A TYR 794.A N ARG 770.A O no hydrogen 3.166 N/A VAL 795.A N GLU 700.A O no hydrogen 3.041 N/A ALA 796.A N ILE 767.A O no hydrogen 3.305 N/A GLN 797.A N HIS 698.A O no hydrogen 2.872 N/A ARG 799.A N SER 696.A O no hydrogen 2.730 N/A ARG 799.A NH1 GLN 797.A OE1 no hydrogen 3.019 N/A LEU 801.A N TYR 694.A O no hydrogen 3.354 N/A GLN 802.A N ASP 805.A OD1 no hydrogen 2.565 N/A LEU 807.A N GLY 815.A O no hydrogen 3.099 N/A ALA 808.A N MET 963.A O no hydrogen 3.212 N/A ASN 809.A N ASN 813.A O no hydrogen 3.349 N/A ASN 809.A ND2 GLN 852.A OE1 no hydrogen 3.432 N/A ARG 810.A NH1 VAL 573.A O no hydrogen 3.059 N/A GLY 812.A N ASN 809.A O no hydrogen 2.818 N/A ASN 813.A N ASN 809.A OD1 no hydrogen 2.518 N/A ASN 813.A ND2 GLN 852.A OE1 no hydrogen 3.433 N/A ALA 818.A N ILE 682.A O no hydrogen 3.266 N/A MET 826.A N VAL 823.A O no hydrogen 3.457 N/A HIS 828.A N TYR 943.A O no hydrogen 2.763 N/A LEU 829.A N GLY 832.A O no hydrogen 3.243 N/A LEU 829.A N THR 833.A O no hydrogen 3.331 N/A VAL 835.A N PRO 827.A O no hydrogen 2.804 N/A VAL 837.A N LEU 667.A O no hydrogen 3.028 N/A GLY 843.A N ASN 840.A O no hydrogen 3.003 N/A VAL 844.A N PRO 841.A O no hydrogen 2.639 N/A GLY 851.A N HIS 546.A O no hydrogen 3.079 N/A LEU 854.A N LEU 850.A O no hydrogen 3.221 N/A LEU 854.A N GLY 851.A O no hydrogen 2.830 N/A GLU 855.A N GLY 851.A O no hydrogen 2.969 N/A THR 856.A N GLN 852.A O no hydrogen 2.915 N/A THR 856.A OG1 GLN 852.A O no hydrogen 3.443 N/A HIS 857.A N ILE 853.A O no hydrogen 3.410 N/A LEU 858.A N LEU 854.A O no hydrogen 2.911 N/A GLY 859.A N GLU 855.A O no hydrogen 2.662 N/A LEU 860.A N THR 856.A O no hydrogen 2.650 N/A LEU 860.A N HIS 857.A O no hydrogen 2.725 N/A ALA 861.A N LEU 858.A O no hydrogen 3.345 N/A GLY 862.A N LEU 858.A O no hydrogen 3.251 N/A TYR 863.A N GLY 859.A O no hydrogen 3.129 N/A LEU 865.A N ALA 861.A O no hydrogen 2.672 N/A GLN 867.A N GLY 862.A O no hydrogen 3.015 N/A ARG 868.A N GLU 2.A O no hydrogen 2.916 N/A ARG 868.A NH1 GLU 656.A OE1 no hydrogen 3.564 N/A TYR 869.A N VAL 572.A O no hydrogen 2.802 N/A ILE 870.A N LYS 4.A O no hydrogen 3.221 N/A SER 871.A OG PRO 872.A O no hydrogen 3.169 N/A LYS 878.A NZ GLU 545.A OE1 no hydrogen 2.764 N/A LYS 878.A NZ GLU 545.A OE2 no hydrogen 2.491 N/A LYS 878.A NZ ALA 877.A O no hydrogen 3.494 N/A ILE 882.A N LYS 878.A O no hydrogen 3.400 N/A LYS 883.A N GLU 879.A O no hydrogen 3.286 N/A LYS 883.A NZ LEU 936.A O no hydrogen 3.242 N/A GLU 884.A N PRO 880.A O no hydrogen 3.300 N/A LEU 885.A N GLU 881.A O no hydrogen 3.299 N/A LEU 886.A N ILE 882.A O no hydrogen 2.858 N/A ALA 887.A N LYS 883.A O no hydrogen 2.987 N/A GLN 888.A N GLU 884.A O no hydrogen 3.152 N/A ALA 889.A N LEU 885.A O no hydrogen 2.951 N/A PHE 890.A N LEU 886.A O no hydrogen 3.101 N/A GLU 891.A N ALA 887.A O no hydrogen 3.333 N/A VAL 892.A N ALA 889.A O no hydrogen 2.790 N/A TYR 893.A N ALA 889.A O no hydrogen 2.961 N/A TYR 893.A OH ASP 831.A OD1 no hydrogen 3.035 N/A PHE 894.A N PHE 890.A O no hydrogen 2.993 N/A GLY 895.A N PHE 890.A O no hydrogen 3.359 N/A ARG 897.A NH2 GLY 903.A O no hydrogen 2.660 N/A ARG 897.A NH2 GLU 908.A OE1 no hydrogen 3.518 N/A ARG 897.A NH2 GLU 908.A OE2 no hydrogen 3.212 N/A LYS 898.A N PHE 894.A O no hydrogen 3.261 N/A LYS 898.A NZ GLU 928.A OE1 no hydrogen 2.689 N/A LYS 898.A NZ GLU 928.A OE2 no hydrogen 2.765 N/A GLU 900.A N LYS 896.A O no hydrogen 3.041 N/A GLY 901.A N LYS 898.A O no hydrogen 2.857 N/A PHE 902.A N ARG 897.A O no hydrogen 3.344 N/A ASP 905.A N GLU 908.A OE1 no hydrogen 2.531 N/A VAL 909.A N LYS 906.A O no hydrogen 3.222 N/A VAL 911.A N ARG 907.A O no hydrogen 3.318 N/A LEU 912.A N GLU 908.A O no hydrogen 3.314 N/A ARG 913.A N VAL 909.A O no hydrogen 2.780 N/A ARG 914.A N GLU 910.A O no hydrogen 3.166 N/A ARG 914.A N VAL 911.A O no hydrogen 3.020 N/A ALA 915.A N VAL 911.A O no hydrogen 2.890 N/A GLU 916.A N LEU 912.A O no hydrogen 2.959 N/A LEU 918.A N ALA 915.A O no hydrogen 2.966 N/A GLY 919.A N GLU 916.A O no hydrogen 2.880 N/A LEU 920.A N ALA 915.A O no hydrogen 2.912 N/A THR 922.A N GLU 933.A OE1 no hydrogen 3.026 N/A THR 922.A OG1 GLU 933.A OE1 no hydrogen 3.027 N/A THR 922.A OG1 GLU 933.A OE2 no hydrogen 3.294 N/A LYS 925.A NZ THR 922.A OG1 no hydrogen 2.781 N/A GLU 928.A N THR 926.A OG1 no hydrogen 3.184 N/A GLN 930.A N THR 926.A O no hydrogen 2.823 N/A GLN 930.A NE2 GLU 916.A OE2 no hydrogen 2.687 N/A GLN 930.A NE2 LYS 925.A O no hydrogen 3.035 N/A LEU 931.A N PRO 927.A O no hydrogen 2.889 N/A LYS 932.A N GLU 928.A O no hydrogen 3.101 N/A GLU 933.A N GLU 929.A O no hydrogen 2.717 N/A LEU 934.A N GLN 930.A O no hydrogen 3.130 N/A PHE 935.A N LEU 931.A O no hydrogen 2.649 N/A LEU 936.A N LYS 932.A O no hydrogen 2.990 N/A GLN 937.A N LEU 934.A O no hydrogen 3.111 N/A GLY 938.A N PHE 935.A O no hydrogen 2.909 N/A TYR 943.A N HIS 828.A O no hydrogen 2.709 N/A ARG 946.A N ASP 944.A OD1 no hydrogen 3.255 N/A ARG 946.A NE ASP 944.A OD2 no hydrogen 3.383 N/A ARG 946.A NH1 ASP 674.A OD1 no hydrogen 3.354 N/A ILE 951.A N LEU 942.A O no hydrogen 2.816 N/A ILE 955.A N VAL 940.A O no hydrogen 3.027 N/A VAL 957.A N GLY 938.A O no hydrogen 3.178 N/A GLY 958.A N VAL 668.A O no hydrogen 3.055 N/A ILE 962.A N GLN 664.A O no hydrogen 3.200 N/A LYS 964.A NZ ARG 799.A O no hydrogen 3.392 N/A LYS 964.A NZ ASP 805.A OD2 no hydrogen 3.493 N/A TYR 966.A N GLN 561.A O no hydrogen 2.808 N/A LYS 972.A N VAL 969.A O no hydrogen 3.249 N/A LYS 972.A NZ HIS 967.A NE2 no hydrogen 3.129 N/A ARG 976.A NE PRO 988.A O no hydrogen 3.386 N/A SER 982.A N GLN 987.A O no hydrogen 2.539 N/A SER 982.A OG THR 985.A OG1 no hydrogen 2.702 N/A THR 985.A N SER 982.A OG no hydrogen 2.984 N/A THR 985.A OG1 SER 982.A OG no hydrogen 2.702 N/A GLN 987.A NE2 SER 1025.A OG no hydrogen 2.432 N/A LEU 989.A N GLN 987.A O no hydrogen 2.470 N/A GLY 991.A N GLN 994.A O no hydrogen 3.404 N/A GLU 1004.A N GLU 1004.A OE1 no hydrogen 2.595 N/A VAL 1005.A N GLY 1001.A O no hydrogen 3.322 N/A TRP 1006.A N GLU 1002.A O no hydrogen 2.843 N/A ALA 1007.A N MET 1003.A O no hydrogen 3.305 N/A LEU 1008.A N GLU 1004.A O no hydrogen 2.985 N/A GLU 1009.A N VAL 1005.A O no hydrogen 2.611 N/A ALA 1010.A N TRP 1006.A O no hydrogen 2.697 N/A TYR 1011.A N ALA 1007.A O no hydrogen 3.075 N/A GLY 1012.A N LEU 1008.A O no hydrogen 3.326 N/A ALA 1014.A N GLY 1012.A O no hydrogen 2.656 N/A LEU 1017.A N ALA 1013.A O no hydrogen 2.705 N/A GLN 1018.A N ALA 1014.A O no hydrogen 2.815 N/A GLU 1019.A N HIS 1015.A O no hydrogen 2.711 N/A MET 1020.A N LEU 1017.A O no hydrogen 2.766 N/A LEU 1021.A N LEU 1017.A O no hydrogen 3.098 N/A THR 1022.A OG1 GLN 1018.A O no hydrogen 2.764 N/A LEU 1023.A N THR 1022.A OG1 no hydrogen 2.466 N/A LYS 1024.A N GLU 1019.A O no hydrogen 3.108 N/A SER 1025.A N THR 1022.A O no hydrogen 2.574 N/A ASN 1032.A N ILE 1028.A O no hydrogen 3.200 N/A ALA 1033.A N GLU 1029.A O no hydrogen 2.860 N/A ALA 1034.A N GLY 1030.A O no hydrogen 2.754 N/A TYR 1035.A N ARG 1031.A O no hydrogen 2.926 N/A GLU 1036.A N ASN 1032.A O no hydrogen 2.954 N/A ALA 1037.A N ALA 1033.A O no hydrogen 3.365 N/A ILE 1038.A N ALA 1034.A O no hydrogen 2.967 N/A ILE 1039.A N TYR 1035.A O no hydrogen 2.936 N/A LYS 1040.A N GLU 1036.A O no hydrogen 2.674 N/A LYS 1040.A N ALA 1037.A O no hydrogen 3.102 N/A LYS 1040.A NZ GLU 1042.A OE1 no hydrogen 3.063 N/A GLY 1041.A N ILE 1038.A O no hydrogen 2.956 N/A GLU 1042.A N ALA 1037.A O no hydrogen 2.549 N/A SER 1052.A OG ASP 1026.A OD2 no hydrogen 2.848 N/A PHE 1053.A N PRO 1050.A O no hydrogen 2.617 N/A ARG 1054.A NH1 ILE 1079.A O no hydrogen 3.207 N/A VAL 1055.A N GLU 1051.A O no hydrogen 3.063 N/A LEU 1056.A N SER 1052.A O no hydrogen 3.212 N/A VAL 1057.A N PHE 1053.A O no hydrogen 3.093 N/A LYS 1058.A N ARG 1054.A O no hydrogen 3.288 N/A GLU 1059.A N VAL 1055.A O no hydrogen 2.794 N/A LEU 1060.A N LEU 1056.A O no hydrogen 2.873 N/A LEU 1060.A N VAL 1057.A O no hydrogen 3.134 N/A GLN 1061.A N VAL 1057.A O no hydrogen 3.029 N/A ALA 1062.A N LYS 1058.A O no hydrogen 2.702 N/A LEU 1063.A N LEU 1060.A O no hydrogen 2.751 N/A THR 1069.A OG1 VAL 1077.A O no hydrogen 3.020 N/A ASP 1071.A N ASN 1075.A O no hydrogen 2.539 N/A LYS 1073.A N ASN 1075.A OD1 no hydrogen 3.074 N/A LYS 1073.A NZ ASN 1075.A OD1 no hydrogen 3.402 N/A