Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ikm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 16.A N GLY 13.A O no hydrogen 3.135 N/A GLN 17.A N LEU 14.A O no hydrogen 2.504 N/A ILE 18.A N LEU 14.A O no hydrogen 2.504 N/A MET 25.A N GLY 23.A O no hydrogen 2.799 N/A VAL 31.A N PRO 26.A O no hydrogen 3.210 N/A VAL 31.A N GLY 27.A O no hydrogen 2.834 N/A ARG 32.A N GLU 28.A O no hydrogen 2.418 N/A ARG 33.A N ALA 29.A O no hydrogen 2.559 N/A SER 34.A OG ALA 30.A O no hydrogen 3.554 N/A GLU 36.A N ARG 32.A O no hydrogen 2.573 N/A HIS 37.A N ARG 33.A O no hydrogen 3.329 N/A LEU 43.A N LEU 38.A O no hydrogen 3.021 N/A TRP 44.A NE1 HIS 37.A O no hydrogen 2.317 N/A GLN 68.A N ASN 65.A O no hydrogen 2.467 N/A HIS 69.A N ASN 65.A O no hydrogen 3.243 N/A ARG 71.A N ASP 67.A O no hydrogen 2.740 N/A LEU 73.A N HIS 69.A O no hydrogen 3.125 N/A ALA 74.A N PHE 70.A O no hydrogen 2.840 N/A GLN 75.A N ARG 71.A O no hydrogen 2.710 N/A LYS 76.A N LEU 72.A O no hydrogen 2.995 N/A SER 78.A N ALA 74.A O no hydrogen 2.908 N/A SER 78.A OG ALA 74.A O no hydrogen 2.410 N/A SER 78.A OG GLN 75.A O no hydrogen 2.945 N/A LEU 79.A N GLN 75.A O no hydrogen 2.878 N/A TYR 81.A OH ARG 219.A O no hydrogen 2.007 N/A LEU 82.A N LEU 79.A O no hydrogen 2.797 N/A GLU 83.A N LEU 79.A O no hydrogen 2.964 N/A ALA 84.A N PRO 80.A O no hydrogen 3.370 N/A ALA 85.A N TYR 81.A O no hydrogen 3.127 N/A ASN 86.A N LEU 82.A O no hydrogen 2.727 N/A ASN 86.A ND2 GLU 83.A OE2 no hydrogen 3.251 N/A LEU 89.A N ALA 85.A O no hydrogen 2.794 N/A GLN 90.A N ASN 86.A O no hydrogen 2.915 N/A ALA 91.A N LEU 87.A O no hydrogen 3.155 N/A GLU 104.A N TYR 152.A O no hydrogen 2.633 N/A THR 107.A N GLY 105.A O no hydrogen 3.133 N/A PHE 128.A N HIS 200.A NE2 no hydrogen 2.195 N/A GLU 131.A N LEU 142.A O no hydrogen 3.433 N/A GLY 137.A N ALA 135.A O no hydrogen 2.396 N/A VAL 144.A N ASP 129.A O no hydrogen 3.223 N/A SER 147.A OG ALA 125.A O no hydrogen 2.528 N/A LEU 159.A N CYS 155.A O no hydrogen 2.986 N/A VAL 160.A N GLN 157.A O no hydrogen 2.918 N/A GLU 161.A N ARG 158.A O no hydrogen 2.529 N/A LEU 170.A N SER 168.A O no hydrogen 2.733 N/A SER 171.A OG GLU 161.A OE2 no hydrogen 3.309 N/A ILE 176.A N ALA 173.A O no hydrogen 2.982 N/A LEU 178.A N LEU 175.A O no hydrogen 2.936 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.835 N/A THR 182.A N LEU 178.A O no hydrogen 2.766 N/A THR 182.A OG1 LEU 178.A O no hydrogen 3.161 N/A THR 182.A OG1 GLU 179.A O no hydrogen 2.621 N/A GLY 183.A N GLU 179.A O no hydrogen 3.218 N/A SER 185.A OG SER 185.A O no hydrogen 2.622 N/A SER 186.A OG SER 185.A O no hydrogen 2.475 N/A THR 188.A OG1 GLN 189.A O no hydrogen 2.826 N/A THR 188.A OG1 GLN 189.A OE1 no hydrogen 3.223 N/A GLN 189.A N THR 188.A OG1 no hydrogen 2.346 N/A GLN 189.A NE2 PRO 187.A O no hydrogen 3.276 N/A ASN 201.A ND2 THR 308.A OG1 no hydrogen 2.740 N/A VAL 202.A N ASP 224.A OD2 no hydrogen 2.312 N/A ILE 209.A N ASP 205.A O no hydrogen 2.488 N/A ARG 210.A N GLU 211.A OE1 no hydrogen 3.253 N/A ARG 210.A NH2 GLN 712.A OE1 no hydrogen 3.099 N/A GLU 211.A N HIS 208.A O no hydrogen 3.486 N/A TYR 213.A OH MET 220.A O no hydrogen 2.869 N/A LEU 214.A N TYR 339.A OH no hydrogen 3.152 N/A ARG 219.A NE SER 218.A O no hydrogen 2.470 N/A ASP 224.A N THR 715.A OG1 no hydrogen 3.190 N/A THR 225.A N HIS 200.A O no hydrogen 2.454 N/A THR 225.A OG1 ASN 201.A OD1 no hydrogen 2.370 N/A SER 227.A OG ASP 224.A O no hydrogen 2.623 N/A SER 227.A OG THR 715.A OG1 no hydrogen 2.661 N/A MET 228.A N SER 227.A OG no hydrogen 2.497 N/A MET 230.A N MET 226.A O no hydrogen 3.041 N/A ALA 231.A N SER 227.A O no hydrogen 2.777 N/A ILE 232.A N MET 228.A O no hydrogen 2.542 N/A SER 233.A OG HIS 229.A O no hydrogen 3.487 N/A SER 233.A OG SER 233.A O no hydrogen 2.434 N/A SER 236.A N GLN 239.A OE1 no hydrogen 3.313 N/A ARG 240.A N SER 236.A O no hydrogen 2.961 N/A ARG 240.A NH2 LEU 235.A O no hydrogen 3.457 N/A ARG 240.A NH2 SER 256.A O no hydrogen 3.505 N/A SER 241.A N SER 237.A O no hydrogen 3.473 N/A SER 241.A OG SER 237.A O no hydrogen 3.297 N/A SER 241.A OG PHE 238.A O no hydrogen 2.413 N/A LEU 242.A N PHE 238.A O no hydrogen 3.111 N/A TRP 243.A N GLN 239.A O no hydrogen 2.685 N/A ILE 244.A N ARG 240.A O no hydrogen 2.337 N/A ALA 245.A N SER 241.A O no hydrogen 3.116 N/A ALA 246.A N LEU 242.A O no hydrogen 3.395 N/A LYS 247.A N TRP 243.A O no hydrogen 2.963 N/A LYS 247.A NZ SER 257.A OG no hydrogen 2.437 N/A GLN 248.A N ILE 244.A O no hydrogen 3.333 N/A GLN 248.A NE2 GLU 265.A OE1 no hydrogen 3.271 N/A SER 256.A OG ASP 254.A O no hydrogen 2.436 N/A SER 260.A OG ASN 261.A OD1 no hydrogen 3.295 N/A ASN 261.A N ASN 261.A OD1 no hydrogen 2.409 N/A SER 262.A N ASN 259.A OD1 no hydrogen 3.407 N/A LEU 263.A N SER 260.A O no hydrogen 2.680 N/A ALA 264.A N SER 260.A O no hydrogen 3.063 N/A GLU 265.A N ASN 261.A O no hydrogen 3.045 N/A VAL 266.A N LEU 263.A O no hydrogen 2.822 N/A HIS 267.A N LEU 263.A O no hydrogen 2.739 N/A ARG 268.A N ALA 264.A O no hydrogen 2.982 N/A LEU 269.A N ALA 264.A O no hydrogen 2.580 N/A LYS 276.A NZ CYS 301.A O no hydrogen 3.206 N/A PHE 282.A N PRO 278.A O no hydrogen 3.243 N/A LYS 284.A N LEU 281.A O no hydrogen 3.203 N/A THR 286.A N VAL 283.A O no hydrogen 3.091 N/A THR 286.A OG1 ASP 289.A OD1 no hydrogen 3.448 N/A ARG 291.A NH1 LYS 288.A O no hydrogen 2.477 N/A PHE 294.A N ILE 290.A O no hydrogen 2.542 N/A GLN 295.A N ARG 291.A O no hydrogen 2.545 N/A ASP 296.A N GLU 292.A O no hydrogen 3.403 N/A LEU 297.A N ASN 293.A O no hydrogen 2.929 N/A MET 298.A N PHE 294.A O no hydrogen 2.584 N/A TYR 300.A N LEU 297.A O no hydrogen 2.244 N/A CYS 301.A SG GLU 280.A OE2 no hydrogen 3.816 N/A ALA 302.A N MET 298.A O no hydrogen 3.233 N/A GLN 303.A N GLN 299.A O no hydrogen 2.968 N/A ASP 304.A N TYR 300.A O no hydrogen 2.803 N/A VAL 305.A N CYS 301.A O no hydrogen 2.869 N/A TRP 306.A N ALA 302.A O no hydrogen 2.834 N/A ALA 307.A N GLN 303.A O no hydrogen 2.969 N/A THR 308.A N ASP 304.A O no hydrogen 3.346 N/A THR 308.A OG1 VAL 305.A O no hydrogen 2.932 N/A HIS 309.A N VAL 305.A O no hydrogen 3.055 N/A GLU 310.A N TRP 306.A O no hydrogen 2.524 N/A VAL 311.A N ALA 307.A O no hydrogen 2.217 N/A PHE 312.A N THR 308.A O no hydrogen 2.659 N/A GLN 313.A N HIS 309.A O no hydrogen 2.832 N/A GLN 314.A N GLU 310.A O no hydrogen 3.096 N/A GLN 314.A NE2 LEU 89.A O no hydrogen 2.293 N/A GLN 315.A NE2 HIS 267.A O no hydrogen 3.426 N/A LEU 316.A N GLN 313.A O no hydrogen 2.973 N/A GLU 321.A N PRO 317.A O no hydrogen 2.803 N/A ARG 322.A N PHE 319.A O no hydrogen 2.689 N/A CYS 323.A N LEU 320.A O no hydrogen 2.699 N/A CYS 323.A SG PHE 319.A O no hydrogen 3.836 N/A THR 328.A OG1 SER 890.A OG no hydrogen 3.218 N/A ALA 330.A N PRO 326.A O no hydrogen 2.987 N/A GLY 331.A N VAL 327.A O no hydrogen 2.854 N/A MET 332.A N THR 328.A O no hydrogen 3.188 N/A LEU 333.A N LEU 329.A O no hydrogen 3.164 N/A LEU 333.A N ALA 330.A O no hydrogen 2.932 N/A GLU 334.A N ALA 330.A O no hydrogen 3.412 N/A MET 335.A N GLY 331.A O no hydrogen 3.243 N/A GLY 336.A N MET 332.A O no hydrogen 3.296 N/A VAL 342.A N VAL 747.A O no hydrogen 2.417 N/A TRP 346.A N ASN 343.A O no hydrogen 2.940 N/A TYR 349.A N ASN 345.A O no hydrogen 2.436 N/A TYR 349.A OH GLU 742.A O no hydrogen 3.177 N/A LEU 350.A N TRP 346.A O no hydrogen 2.581 N/A ALA 351.A N GLU 347.A O no hydrogen 2.645 N/A GLU 352.A N ARG 348.A O no hydrogen 2.843 N/A ALA 353.A N TYR 349.A O no hydrogen 3.257 N/A GLN 354.A N LEU 350.A O no hydrogen 2.912 N/A GLN 354.A NE2 LEU 350.A O no hydrogen 3.657 N/A GLY 355.A N ALA 351.A O no hydrogen 3.088 N/A THR 356.A OG1 GLU 352.A O no hydrogen 3.106 N/A GLU 359.A N GLY 355.A O no hydrogen 3.310 N/A LEU 360.A N THR 356.A O no hydrogen 2.845 N/A GLN 361.A N TYR 357.A O no hydrogen 3.018 N/A ARG 362.A N GLU 358.A O no hydrogen 2.682 N/A GLU 363.A N GLU 359.A O no hydrogen 2.662 N/A MET 364.A N LEU 360.A O no hydrogen 2.827 N/A LYS 365.A N GLN 361.A O no hydrogen 2.835 N/A LYS 366.A N ARG 362.A O no hydrogen 3.323 N/A SER 367.A N GLU 363.A O no hydrogen 2.895 N/A SER 367.A OG MET 364.A O no hydrogen 2.288 N/A LEU 368.A N MET 364.A O no hydrogen 2.469 N/A MET 369.A N LYS 365.A O no hydrogen 2.360 N/A ASP 370.A N LYS 366.A O no hydrogen 2.520 N/A LEU 371.A N SER 367.A O no hydrogen 2.675 N/A ALA 372.A N LEU 368.A O no hydrogen 2.990 N/A ASN 373.A N MET 369.A O no hydrogen 2.986 N/A ASP 374.A N ASP 370.A O no hydrogen 2.703 N/A ALA 375.A N LEU 371.A O no hydrogen 2.975 N/A CYS 376.A N ALA 372.A O no hydrogen 3.166 N/A CYS 376.A SG ALA 372.A O no hydrogen 3.596 N/A GLN 377.A N ASN 373.A O no hydrogen 3.438 N/A GLN 377.A N ASP 374.A O no hydrogen 3.165 N/A LEU 378.A N ASP 374.A O no hydrogen 3.240 N/A SER 380.A N LEU 378.A O no hydrogen 3.037 N/A ARG 383.A NE GLU 382.A OE1 no hydrogen 3.345 N/A LYS 385.A NZ GLU 386.A OE2 no hydrogen 3.404 N/A TRP 389.A N GLU 386.A O no hydrogen 3.185 N/A ASP 392.A N PRO 388.A O no hydrogen 3.018 N/A LEU 393.A N TRP 389.A O no hydrogen 2.461 N/A GLU 394.A N LEU 390.A O no hydrogen 3.073 N/A ASP 396.A N ASP 392.A O no hydrogen 3.213 N/A GLN 398.A NE2 LEU 481.A O no hydrogen 2.718 N/A GLN 398.A NE2 CYS 482.A O no hydrogen 3.355 N/A LYS 401.A NZ PRO 475.A O no hydrogen 2.366 N/A LYS 407.A NZ GLU 411.A OE1 no hydrogen 2.898 N/A SER 416.A OG ALA 415.A O no hydrogen 2.387 N/A LYS 417.A NZ LYS 417.A O no hydrogen 2.966 N/A LEU 418.A N HIS 474.A O no hydrogen 3.346 N/A GLY 422.A N LYS 401.A O no hydrogen 3.223 N/A GLY 422.A N GLN 402.A O no hydrogen 2.856 N/A GLU 440.A N SER 439.A OG no hydrogen 2.373 N/A MET 449.A N GLN 445.A O no hydrogen 3.211 N/A ALA 450.A N GLN 446.A O no hydrogen 2.348 N/A ARG 451.A N ASP 447.A O no hydrogen 2.240 N/A ARG 451.A NH2 GLU 442.A OE1 no hydrogen 3.441 N/A ALA 452.A N VAL 448.A O no hydrogen 2.633 N/A CYS 453.A N MET 449.A O no hydrogen 2.943 N/A CYS 453.A SG ALA 450.A O no hydrogen 2.649 N/A LEU 454.A N ALA 450.A O no hydrogen 2.680 N/A LEU 454.A N ARG 451.A O no hydrogen 3.102 N/A GLN 455.A N ARG 451.A O no hydrogen 3.442 N/A LYS 456.A N ALA 452.A O no hydrogen 3.398 N/A LEU 457.A N CYS 453.A O no hydrogen 2.848 N/A LYS 458.A N LEU 454.A O no hydrogen 2.442 N/A GLY 459.A N GLN 455.A O no hydrogen 2.174 N/A THR 460.A N LYS 456.A O no hydrogen 2.817 N/A THR 460.A OG1 LYS 456.A O no hydrogen 2.568 N/A THR 461.A N LEU 457.A O no hydrogen 3.039 N/A THR 461.A OG1 LEU 457.A O no hydrogen 2.637 N/A GLU 462.A N LYS 458.A O no hydrogen 3.266 N/A GLU 462.A N GLY 459.A O no hydrogen 2.956 N/A LEU 464.A N THR 460.A O no hydrogen 2.607 N/A TRP 490.A N PRO 488.A O no hydrogen 2.246 N/A GLN 500.A NE2 LEU 496.A O no hydrogen 3.040 N/A MET 501.A N LEU 497.A O no hydrogen 3.156 N/A THR 504.A N MET 501.A O no hydrogen 3.328 N/A THR 504.A OG1 SER 498.A O no hydrogen 2.461 N/A THR 504.A OG1 MET 501.A O no hydrogen 3.297 N/A LYS 506.A N VAL 503.A O no hydrogen 2.963 N/A LYS 506.A NZ GLU 521.A OE2 no hydrogen 2.609 N/A LYS 506.A NZ ALA 590.A O no hydrogen 2.279 N/A LEU 507.A N VAL 503.A O no hydrogen 3.111 N/A TYR 519.A OH ASP 513.A OD2 no hydrogen 2.295 N/A SER 520.A OG GLY 524.A O no hydrogen 2.478 N/A ARG 522.A N SER 520.A O no hydrogen 2.663 N/A TRP 525.A N PHE 618.A O no hydrogen 2.933 N/A TYR 527.A OH GLY 514.A O no hydrogen 2.660 N/A GLY 531.A N VAL 529.A O no hydrogen 1.948 N/A ASN 535.A N ARG 533.A O no hydrogen 2.628 N/A THR 543.A OG1 ALA 537.A O no hydrogen 3.344 N/A THR 544.A N PRO 540.A O no hydrogen 3.416 N/A THR 544.A OG1 THR 541.A O no hydrogen 2.393 N/A GLU 546.A N GLY 542.A O no hydrogen 3.344 N/A SER 547.A N THR 543.A O no hydrogen 2.756 N/A SER 547.A OG THR 543.A O no hydrogen 2.610 N/A GLY 549.A N LEU 545.A O no hydrogen 3.422 N/A VAL 550.A N GLU 546.A O no hydrogen 2.952 N/A VAL 551.A N GLY 549.A O no hydrogen 2.918 N/A ARG 555.A NH1 VAL 550.A O no hydrogen 3.141 N/A ILE 557.A N PRO 553.A O no hydrogen 2.277 N/A GLU 558.A N TYR 554.A O no hydrogen 2.112 N/A SER 559.A N ARG 555.A O no hydrogen 2.897 N/A SER 559.A OG ARG 555.A O no hydrogen 2.768 N/A SER 559.A OG ALA 556.A O no hydrogen 2.550 N/A LEU 560.A N ALA 556.A O no hydrogen 3.280 N/A TYR 561.A N ILE 557.A O no hydrogen 3.073 N/A ARG 562.A N SER 559.A O no hydrogen 3.128 N/A LYS 563.A N SER 559.A O no hydrogen 2.628 N/A HIS 564.A N LEU 560.A O no hydrogen 2.810 N/A LEU 566.A N ARG 562.A O no hydrogen 3.360 N/A GLN 568.A N HIS 564.A O no hydrogen 2.653 N/A GLY 569.A N CYS 565.A O no hydrogen 3.101 N/A LYS 570.A N LEU 566.A O no hydrogen 2.809 N/A GLN 571.A N GLU 567.A O no hydrogen 2.507 N/A GLN 571.A NE2 LEU 517.A O no hydrogen 3.545 N/A GLN 571.A NE2 GLN 568.A O no hydrogen 3.659 N/A GLN 572.A N GLN 568.A O no hydrogen 2.587 N/A LEU 573.A N GLY 569.A O no hydrogen 3.415 N/A MET 574.A N LYS 570.A O no hydrogen 3.064 N/A GLN 576.A N GLN 572.A O no hydrogen 2.808 N/A GLN 576.A NE2 GLN 572.A O no hydrogen 3.423 N/A GLU 577.A N LEU 573.A O no hydrogen 2.875 N/A ALA 578.A N PRO 575.A O no hydrogen 2.751 N/A ALA 590.A N LEU 586.A O no hydrogen 3.126 N/A ARG 591.A N LEU 588.A O no hydrogen 3.158 N/A GLY 593.A N GLU 521.A OE2 no hydrogen 2.479 N/A ASP 596.A N ASP 596.A OD2 no hydrogen 2.330 N/A THR 597.A OG1 ASP 596.A O no hydrogen 2.313 N/A HIS 602.A N PRO 599.A O no hydrogen 2.843 N/A HIS 603.A N TYR 601.A O no hydrogen 3.094 N/A HIS 603.A N HIS 603.A ND1 no hydrogen 2.609 N/A CYS 616.A SG ASP 534.A OD1 no hydrogen 3.633 N/A PHE 618.A N TRP 525.A O no hydrogen 3.094 N/A ASN 627.A N HIS 623.A O no hydrogen 2.318 N/A CYS 629.A SG ASN 630.A O no hydrogen 3.180 N/A ASN 630.A ND2 HIS 523.A NE2 no hydrogen 2.788 N/A ASN 630.A ND2 THR 597.A O no hydrogen 2.797 N/A SER 633.A N VAL 631.A O no hydrogen 2.379 N/A MET 643.A N PHE 639.A O no hydrogen 3.190 N/A MET 643.A N LEU 640.A O no hydrogen 3.119 N/A GLU 644.A N LEU 640.A O no hydrogen 3.048 N/A GLU 644.A N PRO 641.A O no hydrogen 2.709 N/A ASP 645.A N PRO 641.A O no hydrogen 3.278 N/A ARG 659.A N ALA 655.A O no hydrogen 3.066 N/A ALA 660.A N SER 656.A O no hydrogen 3.261 N/A LEU 661.A N GLY 657.A O no hydrogen 2.490 N/A GLU 662.A N PRO 658.A O no hydrogen 2.684 N/A ILE 663.A N ARG 659.A O no hydrogen 2.501 N/A ASN 664.A N ALA 660.A O no hydrogen 2.922 N/A ASN 664.A ND2 GLU 644.A OE1 no hydrogen 3.214 N/A LYS 665.A N LEU 661.A O no hydrogen 2.829 N/A LYS 665.A NZ GLU 662.A OE2 no hydrogen 2.805 N/A MET 666.A N GLU 662.A O no hydrogen 3.222 N/A MET 666.A N ILE 663.A O no hydrogen 2.631 N/A ILE 667.A N ILE 663.A O no hydrogen 3.325 N/A SER 668.A N ASN 664.A O no hydrogen 2.825 N/A SER 668.A OG ASN 664.A O no hydrogen 2.882 N/A ARG 671.A N ILE 667.A O no hydrogen 2.936 N/A ALA 673.A N PHE 669.A O no hydrogen 3.354 N/A HIS 674.A N TRP 670.A O no hydrogen 2.406 N/A ILE 677.A N ALA 673.A O no hydrogen 2.865 N/A SER 678.A N HIS 674.A O no hydrogen 2.962 N/A SER 678.A OG HIS 674.A O no hydrogen 3.135 N/A SER 679.A N LYS 675.A O no hydrogen 3.017 N/A SER 679.A OG LYS 675.A O no hydrogen 2.445 N/A SER 679.A OG ARG 676.A O no hydrogen 2.151 N/A GLN 680.A N ILE 677.A O no hydrogen 3.179 N/A VAL 694.A N PRO 691.A O no hydrogen 3.176 N/A HIS 697.A N ALA 693.A O no hydrogen 2.880 N/A ASP 699.A N ARG 696.A O no hydrogen 3.354 N/A GLN 712.A N GLN 712.A OE1 no hydrogen 2.483 N/A ARG 721.A NH1 ASP 961.A OD1 no hydrogen 3.520 N/A ALA 723.A N THR 718.A OG1 no hydrogen 3.212 N/A LEU 729.A N GLU 725.A O no hydrogen 2.987 N/A THR 730.A N THR 727.A O no hydrogen 3.407 N/A THR 730.A OG1 PRO 726.A O no hydrogen 2.205 N/A THR 730.A OG1 GLU 931.A OE1 no hydrogen 3.294 N/A SER 732.A OG THR 730.A O no hydrogen 3.141 N/A ARG 738.A NH1 SER 1055.A OG no hydrogen 3.204 N/A SER 741.A N ARG 738.A O no hydrogen 2.303 N/A SER 741.A OG PRO 736.A O no hydrogen 3.052 N/A SER 741.A OG VAL 739.A O no hydrogen 3.286 N/A VAL 747.A N LEU 743.A O no hydrogen 3.131 N/A GLN 748.A N ALA 745.A O no hydrogen 3.069 N/A TYR 753.A N PRO 750.A O no hydrogen 2.874 N/A THR 754.A N VAL 995.A O no hydrogen 3.035 N/A THR 754.A OG1 VAL 995.A O no hydrogen 3.523 N/A LEU 755.A N ASP 1040.A O no hydrogen 3.055 N/A GLY 757.A N ASP 1038.A O no hydrogen 2.988 N/A VAL 760.A N ASP 989.A O no hydrogen 3.484 N/A SER 762.A OG ASP 761.A O no hydrogen 2.267 N/A GLN 763.A N ASP 989.A OD2 no hydrogen 3.219 N/A TRP 766.A N SER 762.A O no hydrogen 2.727 N/A ALA 768.A N GLU 764.A O no hydrogen 3.207 N/A ALA 769.A N LEU 765.A O no hydrogen 2.893 N/A VAL 770.A N TRP 766.A O no hydrogen 3.066 N/A LEU 771.A N ILE 767.A O no hydrogen 3.213 N/A GLY 772.A N ALA 768.A O no hydrogen 3.375 N/A GLY 772.A N GLU 871.A OE1 no hydrogen 3.125 N/A ASP 773.A N ALA 769.A O no hydrogen 3.415 N/A ALA 774.A N VAL 770.A O no hydrogen 2.568 N/A HIS 775.A N LEU 771.A O no hydrogen 3.141 N/A HIS 775.A N GLY 772.A O no hydrogen 2.535 N/A PHE 776.A N ASP 773.A O no hydrogen 2.832 N/A THR 783.A N ASP 868.A OD1 no hydrogen 2.739 N/A TRP 787.A N CYS 782.A O no hydrogen 2.198 N/A MET 788.A N ALA 784.A O no hydrogen 2.259 N/A SER 795.A N ARG 793.A O no hydrogen 3.072 N/A ASP 799.A N ARG 796.A O no hydrogen 2.629 N/A LEU 800.A N GLY 797.A O no hydrogen 2.349 N/A HIS 801.A N GLY 797.A O no hydrogen 2.930 N/A HIS 801.A ND1 GLY 797.A O no hydrogen 3.028 N/A SER 802.A N THR 798.A O no hydrogen 2.457 N/A SER 802.A OG ASP 799.A O no hydrogen 2.398 N/A THR 804.A N LEU 800.A O no hydrogen 2.942 N/A ALA 805.A N HIS 801.A O no hydrogen 3.208 N/A THR 806.A N SER 802.A O no hydrogen 2.767 N/A THR 806.A OG1 SER 802.A O no hydrogen 2.635 N/A THR 807.A N LYS 803.A O no hydrogen 3.134 N/A THR 807.A OG1 LYS 803.A O no hydrogen 2.778 N/A THR 807.A OG1 THR 804.A O no hydrogen 3.200 N/A LYS 816.A N ARG 812.A O no hydrogen 2.535 N/A ASN 819.A N LYS 816.A O no hydrogen 3.149 N/A TYR 820.A N LYS 816.A O no hydrogen 3.248 N/A GLY 821.A N ILE 817.A O no hydrogen 2.826 N/A ILE 823.A N ASN 819.A O no hydrogen 2.314 N/A TYR 824.A N TYR 820.A O no hydrogen 2.857 N/A TYR 824.A OH GLU 764.A OE1 no hydrogen 3.257 N/A GLY 825.A N GLY 821.A O no hydrogen 3.409 N/A PHE 830.A N GLY 827.A O no hydrogen 2.929 N/A ALA 831.A N GLN 828.A O no hydrogen 3.037 N/A ARG 833.A N PRO 829.A O no hydrogen 2.788 N/A LEU 834.A N PHE 830.A O no hydrogen 3.053 N/A LEU 835.A N ALA 831.A O no hydrogen 2.672 N/A MET 836.A N GLU 832.A O no hydrogen 2.634 N/A GLN 837.A N ARG 833.A O no hydrogen 3.029 N/A PHE 838.A N LEU 834.A O no hydrogen 3.081 N/A ASN 839.A ND2 LEU 835.A O no hydrogen 2.614 N/A THR 843.A OG1 ARG 841.A O no hydrogen 3.062 N/A GLU 846.A N LEU 842.A O no hydrogen 3.328 N/A ALA 847.A N THR 843.A O no hydrogen 2.849 N/A ALA 848.A N GLN 844.A O no hydrogen 2.640 N/A GLU 849.A N GLN 845.A O no hydrogen 2.948 N/A LYS 850.A N GLU 846.A O no hydrogen 3.045 N/A ALA 851.A N ALA 847.A O no hydrogen 2.739 N/A GLN 852.A N ALA 848.A O no hydrogen 2.882 N/A GLN 853.A N GLU 849.A O no hydrogen 2.950 N/A MET 854.A N LYS 850.A O no hydrogen 2.875 N/A TYR 855.A N ALA 851.A O no hydrogen 3.057 N/A ALA 856.A N GLN 852.A O no hydrogen 2.648 N/A ALA 857.A N GLN 853.A O no hydrogen 2.685 N/A THR 858.A OG1 MET 854.A O no hydrogen 3.072 N/A LYS 859.A N ALA 856.A O no hydrogen 3.221 N/A LYS 859.A NZ ALA 826.A O no hydrogen 3.447 N/A ARG 865.A NH1 GLU 869.A O no hydrogen 2.246 N/A SER 867.A OG ALA 857.A O no hydrogen 1.968 N/A SER 867.A OG ASP 868.A OD2 no hydrogen 3.430 N/A LEU 873.A N GLU 869.A O no hydrogen 2.859 N/A ARG 875.A N GLU 871.A O no hydrogen 2.262 N/A GLU 876.A N TRP 872.A O no hydrogen 2.453 N/A LEU 877.A N LEU 873.A O no hydrogen 2.573 N/A ASN 878.A N VAL 874.A O no hydrogen 2.554 N/A LEU 879.A N ARG 875.A O no hydrogen 2.746 N/A ARG 883.A N ASP 882.A OD1 no hydrogen 2.355 N/A SER 890.A OG THR 328.A OG1 no hydrogen 3.218 N/A GLN 892.A NE2 TRP 953.A O no hydrogen 3.623 N/A GLU 900.A N LYS 896.A O no hydrogen 3.158 N/A LYS 909.A N GLN 906.A O no hydrogen 2.996 N/A GLU 911.A N LYS 909.A O no hydrogen 2.490 N/A VAL 912.A N LYS 909.A O no hydrogen 3.360 N/A VAL 913.A N LYS 909.A O no hydrogen 2.883 N/A ARG 916.A N VAL 912.A O no hydrogen 2.481 N/A TRP 918.A N GLU 915.A O no hydrogen 2.839 N/A LYS 919.A N GLU 915.A O no hydrogen 3.338 N/A SER 924.A N GLY 920.A O no hydrogen 2.797 N/A SER 924.A OG GLY 920.A O no hydrogen 2.910 N/A GLU 925.A N GLY 921.A O no hydrogen 3.121 N/A GLU 925.A N THR 922.A O no hydrogen 2.824 N/A MET 926.A N THR 922.A O no hydrogen 3.206 N/A PHE 927.A N SER 924.A O no hydrogen 3.156 N/A ASN 928.A N SER 924.A O no hydrogen 2.469 N/A THR 935.A OG1 ALA 934.A O no hydrogen 2.224 N/A THR 948.A OG1 GLY 825.A O no hydrogen 3.504 N/A SER 949.A OG PHE 946.A O no hydrogen 2.646 N/A ARG 950.A N PHE 946.A O no hydrogen 3.280 N/A VAL 951.A N MET 947.A O no hydrogen 2.431 N/A ASN 952.A N THR 948.A O no hydrogen 2.740 N/A TRP 953.A N SER 949.A O no hydrogen 2.875 N/A VAL 954.A N ARG 950.A O no hydrogen 2.941 N/A VAL 954.A N VAL 951.A O no hydrogen 3.179 N/A GLN 956.A N ASN 952.A O no hydrogen 3.260 N/A GLN 956.A NE2 ASN 952.A OD1 no hydrogen 2.859 N/A SER 957.A N TRP 953.A O no hydrogen 2.373 N/A SER 957.A OG TRP 953.A O no hydrogen 2.222 N/A SER 958.A N VAL 954.A O no hydrogen 2.722 N/A SER 958.A OG VAL 954.A O no hydrogen 2.464 N/A ALA 959.A N GLN 956.A O no hydrogen 2.537 N/A VAL 960.A N GLN 956.A O no hydrogen 3.080 N/A VAL 960.A N SER 957.A O no hydrogen 3.039 N/A ASP 961.A N SER 957.A O no hydrogen 3.312 N/A TYR 962.A N SER 958.A O no hydrogen 3.239 N/A LEU 963.A N ALA 959.A O no hydrogen 3.146 N/A HIS 964.A N VAL 960.A O no hydrogen 3.082 N/A LEU 965.A N TYR 962.A O no hydrogen 3.021 N/A MET 966.A N TYR 962.A O no hydrogen 3.503 N/A LEU 967.A N LEU 963.A O no hydrogen 3.156 N/A VAL 968.A N HIS 964.A O no hydrogen 2.681 N/A ALA 969.A N LEU 965.A O no hydrogen 2.778 N/A MET 970.A N MET 966.A O no hydrogen 3.157 N/A LYS 971.A N LEU 967.A O no hydrogen 2.794 N/A LYS 971.A NZ HIS 964.A O no hydrogen 3.519 N/A TRP 972.A N VAL 968.A O no hydrogen 2.950 N/A LEU 973.A N ALA 969.A O no hydrogen 2.624 N/A PHE 974.A N MET 970.A O no hydrogen 2.675 N/A GLU 975.A N LYS 971.A O no hydrogen 3.123 N/A GLU 976.A N TRP 972.A O no hydrogen 2.911 N/A PHE 977.A N GLU 975.A O no hydrogen 2.392 N/A ARG 982.A N LEU 994.A O no hydrogen 2.460 N/A CYS 984.A SG MET 335.A O no hydrogen 2.640 N/A SER 986.A OG CYS 984.A O no hydrogen 2.914 N/A ASP 989.A N GLU 990.A OE2 no hydrogen 2.449 N/A GLU 990.A N ILE 987.A O no hydrogen 2.365 N/A VAL 991.A N ALA 758.A O no hydrogen 3.384 N/A TYR 993.A N VAL 756.A O no hydrogen 2.595 N/A LEU 994.A N ARG 982.A O no hydrogen 2.397 N/A VAL 995.A N THR 754.A O no hydrogen 2.915 N/A ARG 996.A NE ASP 980.A O no hydrogen 2.930 N/A GLU 997.A N GLU 997.A OE1 no hydrogen 3.300 N/A ARG 1002.A NH1 ALA 978.A O no hydrogen 2.709 N/A ALA 1003.A N ASP 999.A O no hydrogen 3.418 N/A LEU 1005.A N ARG 1002.A O no hydrogen 3.129 N/A LEU 1007.A N ALA 1003.A O no hydrogen 2.883 N/A GLN 1008.A N ALA 1004.A O no hydrogen 2.880 N/A ILE 1009.A N LEU 1005.A O no hydrogen 2.626 N/A THR 1010.A N ALA 1006.A O no hydrogen 2.601 N/A ASN 1011.A N LEU 1007.A O no hydrogen 2.960 N/A ASN 1011.A N GLN 1008.A O no hydrogen 2.913 N/A ASN 1011.A ND2 LEU 1007.A O no hydrogen 2.619 N/A LEU 1012.A N GLN 1008.A O no hydrogen 3.247 N/A LEU 1013.A N ILE 1009.A O no hydrogen 2.895 N/A THR 1014.A N THR 1010.A O no hydrogen 2.994 N/A THR 1014.A OG1 THR 1010.A O no hydrogen 2.311 N/A ARG 1015.A N ASN 1011.A O no hydrogen 2.643 N/A ARG 1015.A NE TYR 962.A OH no hydrogen 2.968 N/A CYS 1016.A N LEU 1012.A O no hydrogen 2.433 N/A CYS 1016.A SG LEU 1012.A O no hydrogen 2.328 N/A MET 1017.A N LEU 1013.A O no hydrogen 2.577 N/A PHE 1018.A N THR 1014.A O no hydrogen 2.809 N/A ALA 1019.A N ARG 1015.A O no hydrogen 3.472 N/A LYS 1021.A N MET 1017.A O no hydrogen 3.413 N/A GLN 1029.A NE2 PRO 52.A O no hydrogen 2.354 N/A PHE 1033.A N GLN 1029.A O no hydrogen 3.378 N/A PHE 1034.A N VAL 1031.A O no hydrogen 2.720 N/A SER 1035.A OG ALA 1036.A O no hydrogen 3.337 N/A ASP 1038.A N GLY 757.A O no hydrogen 2.831 N/A CYS 1042.A SG GLU 1061.A OE2 no hydrogen 3.773 N/A MET 1049.A N GLU 1046.A O no hydrogen 3.150 N/A CYS 1051.A SG THR 1053.A O no hydrogen 3.345 N/A THR 1053.A N THR 1058.A OG1 no hydrogen 2.758 N/A THR 1053.A OG1 ASP 737.A OD2 no hydrogen 2.259 N/A THR 1053.A OG1 LYS 1052.A O no hydrogen 2.332 N/A ASN 1056.A ND2 GLU 352.A O no hydrogen 3.450 N/A ASN 1056.A ND2 ALA 353.A O no hydrogen 3.207 N/A THR 1058.A OG1 PRO 1054.A O no hydrogen 2.064 N/A GLN 1068.A NE2 THR 1048.A O no hydrogen 3.347 N/A TYR 1075.A OH ASP 53.A O no hydrogen 3.130 N/A ILE 1078.A N ILE 1074.A O no hydrogen 3.331 N/A GLU 1079.A N TYR 1075.A O no hydrogen 3.438 N/A GLU 1079.A N GLN 1076.A O no hydrogen 2.559 N/A LEU 1080.A N ILE 1077.A O no hydrogen 3.177 N/A THR 1081.A N ILE 1077.A O no hydrogen 3.322 N/A LYS 1082.A N ILE 1078.A O no hydrogen 2.563 N/A SER 1089.A OG THR 1081.A O no hydrogen 2.341 N/A SER 1089.A OG LYS 1082.A O no hydrogen 2.589 N/A