Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7kne_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 5.A OE2 no hydrogen 2.520 N/A SER 1.A OG SER 1.A O no hydrogen 2.515 N/A THR 2.A N GLU 5.A OE2 no hydrogen 2.637 N/A THR 2.A OG1 GLU 5.A OE2 no hydrogen 2.917 N/A GLU 5.A N THR 2.A OG1 no hydrogen 3.256 N/A GLN 6.A N THR 2.A O no hydrogen 3.339 N/A ALA 7.A N ILE 3.A O no hydrogen 3.039 N/A THR 9.A OG1 GLU 5.A O no hydrogen 2.914 N/A PHE 10.A N GLN 6.A O no hydrogen 3.203 N/A LEU 11.A N ALA 7.A O no hydrogen 2.927 N/A ASP 12.A N LYS 8.A O no hydrogen 3.155 N/A LYS 13.A N THR 9.A O no hydrogen 3.167 N/A PHE 14.A N PHE 10.A O no hydrogen 2.845 N/A ASN 15.A N LEU 11.A O no hydrogen 3.022 N/A HIS 16.A ND1 ASP 12.A O no hydrogen 2.951 N/A GLU 17.A N LYS 13.A O no hydrogen 3.339 N/A ALA 18.A N PHE 14.A O no hydrogen 2.870 N/A GLU 19.A N ASN 15.A O no hydrogen 3.412 N/A LEU 21.A N GLU 17.A O no hydrogen 3.415 N/A PHE 22.A N ALA 18.A O no hydrogen 2.713 N/A TYR 23.A OH ASP 337.A OD2 no hydrogen 2.856 N/A SER 25.A N LEU 21.A O no hydrogen 3.207 N/A SER 25.A OG PHE 22.A O no hydrogen 3.032 N/A SER 26.A N PHE 22.A O no hydrogen 2.928 N/A SER 26.A OG PHE 22.A O no hydrogen 2.797 N/A LEU 27.A N TYR 23.A O no hydrogen 2.941 N/A ALA 28.A N GLN 24.A O no hydrogen 3.196 N/A SER 29.A N SER 25.A O no hydrogen 3.012 N/A TRP 30.A N SER 26.A O no hydrogen 2.874 N/A ASN 31.A N LEU 27.A O no hydrogen 3.148 N/A TYR 32.A N ALA 28.A O no hydrogen 3.242 N/A ASN 33.A N TRP 30.A O no hydrogen 3.303 N/A ASN 33.A ND2 SER 29.A O no hydrogen 2.641 N/A THR 34.A N ASN 31.A O no hydrogen 3.487 N/A THR 34.A OG1 TRP 30.A O no hydrogen 3.282 N/A THR 34.A OG1 ASN 31.A O no hydrogen 3.321 N/A ASN 35.A N ASN 31.A O no hydrogen 2.976 N/A ASN 40.A N THR 37.A OG1 no hydrogen 3.264 N/A ASN 40.A ND2 ASN 31.A O no hydrogen 2.885 N/A ASN 40.A ND2 ASN 35.A O no hydrogen 2.702 N/A GLN 42.A NE2 ASN 46.A OD1 no hydrogen 2.847 N/A ASN 43.A N GLU 39.A O no hydrogen 2.795 N/A MET 44.A N ASN 40.A O no hydrogen 2.983 N/A ASN 45.A N VAL 41.A O no hydrogen 3.112 N/A ASN 45.A ND2 VAL 41.A O no hydrogen 3.678 N/A ASN 46.A N GLN 42.A O no hydrogen 2.990 N/A ALA 47.A N ASN 43.A O no hydrogen 3.429 N/A GLY 48.A N MET 44.A O no hydrogen 3.003 N/A ASP 49.A N ASN 45.A O no hydrogen 3.238 N/A TRP 51.A N ALA 47.A O no hydrogen 3.150 N/A SER 52.A N GLY 48.A O no hydrogen 3.225 N/A SER 52.A OG GLY 48.A O no hydrogen 2.973 N/A ALA 53.A N ASP 49.A O no hydrogen 2.963 N/A PHE 54.A N LYS 50.A O no hydrogen 3.109 N/A LEU 55.A N TRP 51.A O no hydrogen 3.418 N/A GLN 58.A N PHE 54.A O no hydrogen 3.278 N/A SER 59.A N LEU 55.A O no hydrogen 3.029 N/A SER 59.A OG LEU 82.A O no hydrogen 3.445 N/A SER 59.A OG GLN 84.A O no hydrogen 3.474 N/A SER 59.A OG ASN 85.A OD1 no hydrogen 3.523 N/A THR 60.A OG1 LYS 56.A O no hydrogen 3.545 N/A THR 60.A OG1 GLU 57.A O no hydrogen 2.763 N/A LEU 61.A N GLU 57.A O no hydrogen 3.416 N/A ALA 62.A N GLN 58.A O no hydrogen 3.254 N/A GLN 63.A N THR 60.A O no hydrogen 3.416 N/A LYS 76.A NZ ILE 70.A O no hydrogen 3.521 N/A LEU 77.A N LEU 73.A O no hydrogen 3.293 N/A GLN 78.A NE2 THR 74.A O no hydrogen 2.740 N/A LEU 79.A N VAL 75.A O no hydrogen 3.032 N/A GLN 80.A N LYS 76.A O no hydrogen 3.089 N/A ALA 81.A N LEU 77.A O no hydrogen 3.351 N/A LEU 82.A N GLN 78.A O no hydrogen 3.054 N/A GLN 83.A N LEU 79.A O no hydrogen 3.094 N/A GLN 83.A NE2 GLN 63.A OE1 no hydrogen 3.536 N/A GLN 84.A NE2 GLN 80.A O no hydrogen 2.902 N/A GLN 84.A NE2 TYR 178.A OH no hydrogen 3.210 N/A SER 88.A N ASN 85.A O no hydrogen 3.361 N/A LYS 94.A N SER 91.A O no hydrogen 3.166 N/A SER 95.A N SER 91.A O no hydrogen 2.755 N/A SER 95.A OG SER 87.A O no hydrogen 3.453 N/A SER 95.A OG SER 87.A OG no hydrogen 3.000 N/A SER 95.A OG SER 91.A O no hydrogen 3.141 N/A ARG 97.A NH1 GLU 164.A O no hydrogen 3.471 N/A LEU 98.A N SER 95.A O no hydrogen 3.336 N/A THR 100.A OG1 LYS 96.A O no hydrogen 2.855 N/A THR 100.A OG1 ASN 99.A OD1 no hydrogen 3.118 N/A ILE 101.A N ARG 97.A O no hydrogen 3.425 N/A LEU 102.A N LEU 98.A O no hydrogen 3.023 N/A THR 104.A N THR 100.A O no hydrogen 3.262 N/A THR 104.A OG1 THR 100.A O no hydrogen 2.618 N/A MET 105.A N ILE 101.A O no hydrogen 3.157 N/A SER 106.A N LEU 102.A O no hydrogen 3.441 N/A THR 107.A N ASN 103.A O no hydrogen 3.395 N/A THR 107.A OG1 ASN 103.A O no hydrogen 3.067 N/A THR 107.A OG1 THR 104.A O no hydrogen 2.907 N/A ILE 108.A N THR 104.A O no hydrogen 3.047 N/A TYR 109.A N MET 105.A O no hydrogen 2.928 N/A SER 110.A N SER 106.A O no hydrogen 3.156 N/A SER 110.A N THR 107.A O no hydrogen 3.307 N/A SER 110.A OG THR 107.A O no hydrogen 2.714 N/A THR 111.A N ILE 108.A O no hydrogen 3.262 N/A THR 111.A OG1 ILE 108.A O no hydrogen 2.455 N/A ASN 119.A N ASN 116.A O no hydrogen 3.293 N/A GLN 121.A N ASN 119.A O no hydrogen 2.913 N/A GLY 129.A N LEU 125.A O no hydrogen 2.925 N/A LEU 130.A N LEU 126.A O no hydrogen 2.954 N/A ALA 135.A N ASN 131.A O no hydrogen 3.202 N/A ARG 143.A NE HIS 247.A O no hydrogen 3.027 N/A ARG 143.A NH1 MET 134.A O no hydrogen 2.911 N/A ARG 143.A NH2 HIS 247.A O no hydrogen 3.153 N/A LEU 144.A N TYR 140.A O no hydrogen 3.208 N/A TRP 145.A N ASN 141.A O no hydrogen 3.159 N/A ALA 146.A N GLU 142.A O no hydrogen 2.778 N/A TRP 147.A N ARG 143.A O no hydrogen 2.999 N/A SER 149.A N ALA 146.A O no hydrogen 3.252 N/A SER 149.A OG ALA 146.A O no hydrogen 2.783 N/A ARG 151.A N TRP 147.A O no hydrogen 3.395 N/A LEU 158.A N GLY 155.A O no hydrogen 3.469 N/A ARG 159.A NE GLU 477.A O no hydrogen 2.923 N/A ARG 159.A NH1 GLU 477.A O no hydrogen 3.103 N/A LEU 161.A N LEU 158.A O no hydrogen 3.065 N/A TYR 162.A N LEU 158.A O no hydrogen 2.752 N/A TYR 165.A N LEU 161.A O no hydrogen 3.230 N/A VAL 166.A N TYR 162.A O no hydrogen 3.257 N/A LYS 169.A NZ TYR 165.A OH no hydrogen 2.782 N/A ASN 170.A ND2 ASP 180.A OD1 no hydrogen 3.315 N/A ARG 174.A NH1 ASN 170.A OD1 no hydrogen 2.974 N/A ARG 174.A NH1 GLU 171.A OE1 no hydrogen 2.711 N/A ARG 174.A NH2 ASN 170.A OD1 no hydrogen 2.945 N/A ARG 174.A NH2 GLU 179.A O no hydrogen 3.528 N/A ASN 176.A N MET 172.A O no hydrogen 2.928 N/A ASN 176.A N ALA 173.A O no hydrogen 3.071 N/A HIS 177.A N ARG 174.A O no hydrogen 3.237 N/A TYR 178.A N ALA 173.A O no hydrogen 2.576 N/A TYR 178.A OH GLN 84.A OE1 no hydrogen 3.323 N/A TYR 184.A N ASP 180.A O no hydrogen 3.082 N/A TYR 184.A N TYR 181.A O no hydrogen 3.267 N/A ARG 186.A N ASP 183.A O no hydrogen 3.217 N/A GLY 187.A N TYR 184.A O no hydrogen 3.232 N/A GLU 190.A N GLY 187.A O no hydrogen 3.328 N/A VAL 191.A N TYR 199.A O no hydrogen 3.444 N/A ARG 201.A NH1 ASP 183.A OD1 no hydrogen 2.536 N/A GLY 202.A N SER 200.A OG no hydrogen 3.282 N/A GLN 203.A N SER 200.A O no hydrogen 3.332 N/A ASP 207.A N GLN 203.A O no hydrogen 3.040 N/A VAL 208.A N LEU 204.A O no hydrogen 2.940 N/A GLU 209.A N ILE 205.A O no hydrogen 3.005 N/A HIS 210.A N GLU 206.A O no hydrogen 3.019 N/A THR 211.A N ASP 207.A O no hydrogen 3.242 N/A THR 211.A OG1 ASP 207.A O no hydrogen 3.085 N/A THR 211.A OG1 VAL 208.A O no hydrogen 2.624 N/A PHE 212.A N GLU 209.A O no hydrogen 3.382 N/A TYR 219.A N ILE 215.A O no hydrogen 3.161 N/A GLU 220.A N LYS 216.A O no hydrogen 2.953 N/A HIS 223.A N TYR 219.A O no hydrogen 3.258 N/A ALA 224.A N GLU 220.A O no hydrogen 3.360 N/A TYR 225.A N HIS 221.A O no hydrogen 3.280 N/A VAL 226.A N LEU 222.A O no hydrogen 3.277 N/A ALA 228.A N TYR 225.A O no hydrogen 3.296 N/A ASP 251.A N LEU 249.A O no hydrogen 3.041 N/A ARG 255.A NH2 HIS 487.A NE2 no hydrogen 3.067 N/A TRP 257.A NE1 GLY 254.A O no hydrogen 3.122 N/A ASN 259.A ND2 ALA 135.A O no hydrogen 2.895 N/A LEU 260.A N TRP 257.A O no hydrogen 3.260 N/A TYR 261.A N THR 258.A O no hydrogen 3.465 N/A SER 262.A OG ASN 259.A O no hydrogen 3.534 N/A THR 264.A N LEU 260.A O no hydrogen 2.797 N/A THR 264.A OG1 LEU 260.A O no hydrogen 2.482 N/A LYS 270.A NZ ASP 413.A OD2 no hydrogen 3.446 N/A THR 276.A N ASP 274.A OD1 no hydrogen 3.206 N/A THR 276.A OG1 ASP 274.A OD1 no hydrogen 2.747 N/A ALA 278.A N VAL 275.A O no hydrogen 3.144 N/A MET 279.A N VAL 275.A O no hydrogen 3.405 N/A TRP 284.A N MET 279.A O no hydrogen 3.269 N/A ALA 286.A N ASP 285.A OD1 no hydrogen 2.864 N/A ILE 289.A N ALA 286.A O no hydrogen 3.311 N/A LYS 291.A N GLN 287.A O no hydrogen 3.232 N/A GLU 294.A N PHE 290.A O no hydrogen 3.080 N/A LYS 295.A N LYS 291.A O no hydrogen 3.372 N/A PHE 296.A N GLU 292.A O no hydrogen 3.232 N/A PHE 297.A N GLU 294.A O no hydrogen 3.274 N/A VAL 298.A N GLU 294.A O no hydrogen 3.377 N/A SER 299.A N LYS 295.A O no hydrogen 3.282 N/A SER 299.A OG LYS 295.A O no hydrogen 3.533 N/A SER 299.A OG PHE 296.A O no hydrogen 2.853 N/A VAL 300.A N PHE 296.A O no hydrogen 3.420 N/A GLY 301.A N PHE 297.A O no hydrogen 3.079 N/A GLY 308.A N THR 306.A OG1 no hydrogen 3.374 N/A ASN 312.A ND2 GLY 308.A O no hydrogen 2.720 N/A SER 313.A N PHE 309.A O no hydrogen 3.135 N/A SER 313.A OG PHE 309.A O no hydrogen 3.294 N/A LYS 323.A NZ VAL 321.A O no hydrogen 3.416 N/A THR 329.A OG1 HIS 327.A O no hydrogen 3.289 N/A LYS 335.A NZ ASP 20.A OD2 no hydrogen 3.459 N/A ASP 337.A N GLY 334.A O no hydrogen 3.068 N/A THR 344.A OG1 LEU 315.A O no hydrogen 2.642 N/A ASP 350.A N THR 347.A OG1 no hydrogen 3.283 N/A LEU 352.A N MET 348.A O no hydrogen 3.317 N/A THR 353.A N ASP 349.A O no hydrogen 2.717 N/A THR 353.A OG1 ASP 349.A O no hydrogen 2.752 N/A ALA 354.A N ASP 350.A O no hydrogen 2.918 N/A HIS 355.A N PHE 351.A O no hydrogen 3.344 N/A HIS 355.A ND1 PHE 351.A O no hydrogen 3.215 N/A HIS 356.A N LEU 352.A O no hydrogen 2.831 N/A HIS 356.A ND1 GLY 387.A O no hydrogen 2.673 N/A GLU 357.A N THR 353.A O no hydrogen 2.947 N/A GLN 362.A N MET 358.A O no hydrogen 3.097 N/A GLN 362.A NE2 PRO 303.A O no hydrogen 2.791 N/A TYR 363.A N GLY 359.A O no hydrogen 3.034 N/A ASP 364.A N HIS 360.A O no hydrogen 2.876 N/A ASP 364.A N ILE 361.A O no hydrogen 3.041 N/A MET 365.A N ILE 361.A O no hydrogen 3.273 N/A ALA 366.A N TYR 363.A O no hydrogen 3.345 N/A TYR 367.A OH HIS 383.A NE2 no hydrogen 3.026 N/A ALA 368.A N MET 365.A O no hydrogen 3.327 N/A GLN 370.A N TYR 367.A O no hydrogen 3.129 N/A GLN 370.A NE2 ARG 541.A O no hydrogen 2.836 N/A LEU 374.A N PRO 371.A O no hydrogen 3.119 N/A ARG 375.A N PHE 372.A O no hydrogen 3.198 N/A ARG 375.A NH1 ALA 368.A O no hydrogen 3.165 N/A ARG 375.A NH2 GLU 19.A OE2 no hydrogen 3.299 N/A GLY 377.A N ASN 376.A OD1 no hydrogen 2.807 N/A ASN 379.A ND2 TYR 503.A OH no hydrogen 3.541 N/A GLY 381.A N ASN 379.A OD1 no hydrogen 2.798 N/A PHE 382.A N ASN 379.A OD1 no hydrogen 3.032 N/A HIS 383.A ND1 HIS 383.A O no hydrogen 2.845 N/A HIS 383.A NE2 ASP 364.A OD1 no hydrogen 2.632 N/A HIS 383.A NE2 TYR 367.A OH no hydrogen 3.026 N/A ALA 385.A N GLY 381.A O no hydrogen 3.068 N/A VAL 386.A N PHE 382.A O no hydrogen 2.996 N/A GLU 388.A N ALA 385.A O no hydrogen 3.243 N/A SER 391.A N GLU 388.A O no hydrogen 3.252 N/A SER 391.A OG GLU 388.A O no hydrogen 2.547 N/A SER 391.A OG GLU 388.A OE2 no hydrogen 3.539 N/A LEU 392.A N GLU 388.A O no hydrogen 3.414 N/A SER 393.A OG ILE 389.A O no hydrogen 3.301 N/A ALA 394.A N MET 390.A O no hydrogen 3.139 N/A THR 396.A N SER 393.A O no hydrogen 3.314 N/A THR 396.A OG1 SER 393.A O no hydrogen 2.556 N/A LEU 400.A N THR 396.A O no hydrogen 3.185 N/A LYS 401.A N PRO 397.A O no hydrogen 3.023 N/A LYS 401.A NZ PHE 410.A O no hydrogen 2.977 N/A SER 402.A N HIS 399.A O no hydrogen 3.244 N/A SER 402.A OG LYS 398.A O no hydrogen 2.508 N/A ILE 403.A N HIS 399.A O no hydrogen 3.465 N/A SER 407.A OG ASP 409.A O no hydrogen 3.272 N/A GLN 411.A N GLN 411.A OE1 no hydrogen 2.868 N/A GLU 415.A N GLU 415.A OE1 no hydrogen 2.840 N/A THR 416.A OG1 ASP 413.A O no hydrogen 3.076 N/A GLU 417.A N ASN 414.A O no hydrogen 3.219 N/A ILE 418.A N ASN 414.A O no hydrogen 3.292 N/A ASN 419.A ND2 PHE 267.A O no hydrogen 3.033 N/A LEU 421.A N GLU 417.A O no hydrogen 2.848 N/A LEU 422.A N ILE 418.A O no hydrogen 2.907 N/A GLN 424.A N PHE 420.A O no hydrogen 3.382 N/A ALA 425.A N LEU 421.A O no hydrogen 2.885 N/A LEU 426.A N LEU 422.A O no hydrogen 3.015 N/A THR 427.A OG1 LYS 423.A O no hydrogen 3.229 N/A THR 427.A OG1 GLN 424.A O no hydrogen 3.197 N/A VAL 429.A N ALA 425.A O no hydrogen 3.095 N/A GLY 430.A N ALA 425.A O no hydrogen 3.324 N/A THR 431.A OG1 ARG 255.A O no hydrogen 3.567 N/A THR 431.A OG1 THR 435.A OG1 no hydrogen 3.425 N/A LEU 432.A N VAL 429.A O no hydrogen 3.355 N/A THR 435.A N THR 431.A O no hydrogen 3.092 N/A THR 435.A OG1 THR 431.A O no hydrogen 2.416 N/A TYR 436.A N LEU 432.A O no hydrogen 3.258 N/A MET 437.A N PRO 433.A O no hydrogen 3.293 N/A LYS 440.A N TYR 436.A O no hydrogen 2.933 N/A TRP 441.A N MET 437.A O no hydrogen 2.912 N/A ARG 442.A N LEU 438.A O no hydrogen 2.978 N/A ARG 442.A NH1 TYR 492.A O no hydrogen 3.489 N/A ARG 442.A NH2 TYR 492.A O no hydrogen 3.520 N/A TRP 443.A N GLU 439.A O no hydrogen 2.990 N/A VAL 445.A N TRP 441.A O no hydrogen 3.438 N/A PHE 446.A N ARG 442.A O no hydrogen 3.120 N/A LYS 447.A N TRP 443.A O no hydrogen 2.777 N/A LYS 447.A NZ GLU 449.A OE2 no hydrogen 3.559 N/A GLY 448.A N MET 444.A O no hydrogen 3.156 N/A GLN 454.A N PRO 451.A O no hydrogen 3.189 N/A TRP 459.A N TRP 455.A O no hydrogen 3.295 N/A TRP 460.A N MET 456.A O no hydrogen 2.857 N/A ARG 464.A N TRP 460.A O no hydrogen 3.128 N/A ARG 464.A NE GLU 471.A OE1 no hydrogen 3.348 N/A ARG 464.A NE GLU 471.A OE2 no hydrogen 3.156 N/A ARG 464.A NH2 GLU 471.A OE1 no hydrogen 3.109 N/A ARG 464.A NH2 GLU 471.A OE2 no hydrogen 3.252 N/A ILE 466.A N MET 462.A O no hydrogen 2.680 N/A GLY 468.A N LYS 463.A O no hydrogen 2.583 N/A GLU 471.A N GLU 471.A OE1 no hydrogen 2.791 N/A SER 484.A N ASP 481.A O no hydrogen 3.446 N/A SER 484.A OG ASP 481.A O no hydrogen 2.595 N/A SER 489.A N LEU 485.A O no hydrogen 3.298 N/A SER 489.A OG LEU 485.A O no hydrogen 3.293 N/A ASN 490.A N PHE 486.A O no hydrogen 3.205 N/A ASN 490.A ND2 ASN 490.A O no hydrogen 2.254 N/A TYR 492.A N HIS 487.A O no hydrogen 3.098 N/A SER 493.A OG GLU 380.A OE1 no hydrogen 2.468 N/A TYR 497.A N PHE 494.A O no hydrogen 3.384 N/A THR 499.A N ILE 495.A O no hydrogen 3.350 N/A TYR 503.A N THR 499.A O no hydrogen 3.250 N/A GLN 504.A N ARG 500.A O no hydrogen 2.928 N/A PHE 505.A N THR 501.A O no hydrogen 3.286 N/A GLN 506.A NE2 LEU 502.A O no hydrogen 3.266 N/A PHE 507.A N TYR 503.A O no hydrogen 3.184 N/A GLU 509.A N PHE 505.A O no hydrogen 3.426 N/A ALA 510.A N GLN 506.A O no hydrogen 3.278 N/A LEU 511.A N PHE 507.A O no hydrogen 2.919 N/A CYS 512.A N GLN 508.A O no hydrogen 3.050 N/A CYS 512.A SG GLN 508.A O no hydrogen 3.249 N/A GLN 513.A N GLU 509.A O no hydrogen 3.028 N/A ALA 514.A N ALA 510.A O no hydrogen 3.086 N/A ALA 515.A N LEU 511.A O no hydrogen 2.960 N/A LYS 516.A N GLN 513.A O no hydrogen 3.329 N/A LYS 516.A NZ ALA 514.A O no hydrogen 3.023 N/A HIS 517.A N CYS 512.A O no hydrogen 3.301 N/A CYS 524.A N LEU 521.A O no hydrogen 3.328 N/A CYS 524.A SG ASP 525.A O no hydrogen 3.604 N/A ILE 526.A N ASP 525.A OD1 no hydrogen 2.716 N/A SER 527.A N ASP 525.A OD1 no hydrogen 3.430 N/A SER 527.A OG ASP 525.A OD2 no hydrogen 3.299 N/A SER 529.A OG ILE 526.A O no hydrogen 2.145 N/A GLU 531.A N GLU 531.A OE1 no hydrogen 2.928 N/A LYS 535.A NZ ASN 554.A O no hydrogen 2.984 N/A LEU 536.A N ALA 532.A O no hydrogen 3.214 N/A PHE 537.A N GLY 533.A O no hydrogen 2.853 N/A ASN 538.A N GLN 534.A O no hydrogen 3.139 N/A MET 539.A N LEU 536.A O no hydrogen 3.130 N/A LEU 540.A N LEU 536.A O no hydrogen 2.944 N/A ARG 541.A N PHE 537.A O no hydrogen 3.403 N/A LYS 544.A NZ ASP 188.A OD2 no hydrogen 3.256 N/A SER 545.A N LEU 542.A O no hydrogen 3.226 N/A SER 545.A OG LEU 542.A O no hydrogen 2.637 N/A SER 545.A OG GLU 546.A OE1 no hydrogen 2.586 N/A TRP 548.A NE1 TYR 189.A O no hydrogen 2.800 N/A LEU 550.A N PRO 547.A O no hydrogen 3.171 N/A ALA 551.A N TRP 548.A O no hydrogen 3.053 N/A LEU 552.A N TRP 548.A O no hydrogen 3.370 N/A ASN 554.A N LEU 550.A O no hydrogen 3.168 N/A ASN 554.A N ALA 551.A O no hydrogen 3.250 N/A VAL 555.A N LEU 552.A O no hydrogen 3.107 N/A VAL 556.A N LEU 552.A O no hydrogen 2.961 N/A ASN 560.A ND2 ASP 207.A OD1 no hydrogen 3.386 N/A MET 561.A N ASN 560.A OD1 no hydrogen 2.610 N/A ARG 564.A NE ARG 564.A O no hydrogen 3.070 N/A ARG 564.A NE ASN 568.A OD1 no hydrogen 3.285 N/A TYR 569.A N LEU 566.A O no hydrogen 3.364 N/A TYR 569.A OH GLN 424.A OE1 no hydrogen 2.580 N/A PHE 570.A N LEU 567.A O no hydrogen 3.153 N/A PHE 574.A N PHE 570.A O no hydrogen 2.821 N/A THR 575.A N GLU 571.A O no hydrogen 3.205 N/A THR 575.A OG1 GLU 571.A O no hydrogen 3.190 N/A THR 575.A OG1 PRO 572.A O no hydrogen 3.411 N/A LEU 577.A N LEU 573.A O no hydrogen 3.040 N/A LYS 578.A N PHE 574.A O no hydrogen 2.884 N/A ASP 579.A N THR 575.A O no hydrogen 3.401 N/A GLN 580.A N TRP 576.A O no hydrogen 3.029 N/A ASN 581.A N LEU 577.A O no hydrogen 3.093 N/A SER 584.A OG ASN 581.A OD1 no hydrogen 3.160 N/A SER 589.A OG THR 590.A O no hydrogen 3.523 N/A SER 589.A OG ASP 591.A OD1 no hydrogen 2.925 N/A