Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4e3c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ GLU 1.A O no hydrogen 3.198 N/A LYS 3.A NZ MET 2.A O no hydrogen 2.766 N/A THR 8.A OG1 ASN 13.A OD1 no hydrogen 3.183 N/A ILE 15.A N ILE 28.A O no hydrogen 2.718 N/A ARG 16.A N GLU 4.A O no hydrogen 3.136 N/A ARG 16.A NH1 GLU 4.A OE1 no hydrogen 3.023 N/A ARG 16.A NH2 GLN 25.A OE1 no hydrogen 3.447 N/A TRP 17.A N ILE 26.A O no hydrogen 2.638 N/A GLN 20.A N GLU 1.A OE1 no hydrogen 3.294 N/A THR 22.A OG1 ASN 19.A O no hydrogen 2.953 N/A ILE 26.A N TRP 17.A O no hydrogen 2.797 N/A ALA 27.A N MET 81.A O no hydrogen 2.918 N/A ILE 28.A N ILE 15.A O no hydrogen 2.952 N/A LYS 29.A N LEU 79.A O no hydrogen 2.717 N/A LYS 29.A NZ GLU 46.A OE1 no hydrogen 3.344 N/A LYS 29.A NZ GLU 46.A OE2 no hydrogen 2.737 N/A LYS 29.A NZ ASP 151.A OD2 no hydrogen 2.675 N/A GLN 30.A N ASN 13.A O no hydrogen 3.120 N/A ARG 32.A NE ASN 13.A OD1 no hydrogen 3.508 N/A ASN 39.A ND2 SER 36.A OG no hydrogen 2.849 N/A ARG 40.A N SER 36.A O no hydrogen 3.176 N/A GLU 41.A N PRO 37.A O no hydrogen 2.859 N/A ARG 42.A N ARG 38.A O no hydrogen 2.734 N/A ARG 42.A NE GLU 162.A O no hydrogen 3.010 N/A TRP 43.A N ASN 39.A O no hydrogen 2.778 N/A CYS 44.A N ARG 40.A O no hydrogen 2.932 N/A LEU 45.A N ARG 42.A O no hydrogen 2.827 N/A GLU 46.A N ARG 42.A O no hydrogen 3.268 N/A ILE 47.A N TRP 43.A O no hydrogen 3.111 N/A GLN 48.A N CYS 44.A O no hydrogen 3.273 N/A ILE 49.A N LEU 45.A O no hydrogen 2.781 N/A MET 50.A N GLU 46.A O no hydrogen 3.145 N/A ARG 51.A N ILE 47.A O no hydrogen 3.442 N/A ARG 52.A N ILE 49.A O no hydrogen 2.808 N/A ARG 52.A NH1 GLU 157.A OE1 no hydrogen 3.187 N/A ASN 57.A ND2 HIS 55.A NE2 no hydrogen 3.113 N/A VAL 59.A N ILE 149.A O no hydrogen 3.139 N/A ALA 60.A N GLU 82.A OE2 no hydrogen 3.087 N/A ARG 62.A N ALA 80.A O no hydrogen 2.948 N/A ARG 62.A NE ASP 63.A O no hydrogen 3.152 N/A ARG 62.A NH1 GLU 24.A OE2 no hydrogen 2.866 N/A ARG 62.A NH2 ASP 63.A O no hydrogen 3.358 N/A ASN 74.A N ALA 72.A O no hydrogen 2.887 N/A ASN 74.A ND2 ALA 72.A O no hydrogen 3.112 N/A ASP 75.A N GLU 34.A OE1 no hydrogen 3.416 N/A MET 81.A N ALA 27.A O no hydrogen 2.794 N/A GLU 82.A N ALA 60.A O no hydrogen 3.109 N/A LEU 89.A N ILE 136.A O no hydrogen 3.051 N/A ARG 90.A NH1 GLU 134.A OE1 no hydrogen 2.576 N/A ARG 90.A NH2 GLU 199.A OE1 no hydrogen 3.238 N/A ARG 90.A NH2 GLU 199.A OE2 no hydrogen 3.019 N/A LYS 91.A N ASP 88.A O no hydrogen 2.454 N/A TYR 92.A N LEU 89.A O no hydrogen 2.641 N/A LEU 93.A N LEU 89.A O no hydrogen 2.932 N/A ASN 94.A N ARG 90.A O no hydrogen 2.657 N/A ASN 94.A ND2 ARG 90.A O no hydrogen 2.768 N/A GLN 95.A N TYR 92.A O no hydrogen 2.705 N/A GLN 95.A NE2 LYS 91.A O no hydrogen 3.050 N/A LEU 102.A N CYS 200.A O no hydrogen 3.232 N/A ARG 103.A NH1 HIS 402.A O no hydrogen 3.524 N/A ARG 103.A NH2 GLN 405.A O no hydrogen 3.382 N/A ILE 107.A N GLU 104.A O no hydrogen 3.366 N/A LEU 108.A N GLY 105.A O no hydrogen 2.863 N/A THR 109.A OG1 ALA 106.A O no hydrogen 2.833 N/A LEU 111.A N ILE 107.A O no hydrogen 2.945 N/A SER 112.A N LEU 108.A O no hydrogen 2.638 N/A ASP 113.A N THR 109.A O no hydrogen 2.838 N/A ILE 114.A N LEU 110.A O no hydrogen 2.851 N/A ALA 115.A N LEU 111.A O no hydrogen 2.859 N/A SER 116.A N SER 112.A O no hydrogen 3.435 N/A SER 116.A OG HIS 55.A NE2 no hydrogen 3.315 N/A ALA 117.A N ASP 113.A O no hydrogen 2.982 N/A LEU 118.A N ILE 114.A O no hydrogen 2.916 N/A ARG 119.A N ALA 115.A O no hydrogen 2.850 N/A LEU 121.A N ALA 117.A O no hydrogen 3.144 N/A HIS 122.A N LEU 118.A O no hydrogen 2.812 N/A GLU 123.A N ARG 119.A O no hydrogen 3.195 N/A ASN 124.A N LEU 121.A O no hydrogen 2.560 N/A ASN 124.A ND2 TYR 120.A O no hydrogen 2.915 N/A ARG 125.A N HIS 122.A O no hydrogen 3.119 N/A ILE 126.A N LEU 121.A O no hydrogen 3.122 N/A ILE 127.A N LYS 156.A O no hydrogen 3.181 N/A HIS 128.A N ASP 189.A OD2 no hydrogen 3.227 N/A ARG 129.A N ASP 189.A OD1 no hydrogen 2.704 N/A ARG 129.A NH1 TYR 154.A O no hydrogen 3.162 N/A ASP 130.A N HIS 128.A O no hydrogen 2.498 N/A LYS 132.A NZ ASP 130.A OD2 no hydrogen 3.049 N/A ASN 135.A N LYS 132.A O no hydrogen 2.927 N/A GLY 141.A N GLN 140.A OE1 no hydrogen 2.786 N/A ILE 146.A N GLN 139.A O no hydrogen 2.946 N/A HIS 147.A N ASP 113.A OD2 no hydrogen 3.408 N/A LYS 148.A N ILE 146.A O no hydrogen 3.010 N/A ILE 150.A N ASN 135.A O no hydrogen 2.769 N/A GLY 153.A N ASP 151.A OD1 no hydrogen 2.760 N/A TYR 154.A OH GLY 10.A O no hydrogen 3.025 N/A ALA 155.A N LEU 152.A O no hydrogen 2.569 N/A LEU 158.A N ARG 125.A O no hydrogen 2.766 N/A GLN 160.A NE2 GLN 48.A OE1 no hydrogen 3.661 N/A GLN 172.A NE2 THR 170.A O no hydrogen 3.509 N/A GLN 172.A NE2 TRP 211.A O no hydrogen 3.648 N/A TYR 173.A OH GLU 199.A OE1 no hydrogen 2.414 N/A LEU 178.A N ALA 175.A O no hydrogen 2.947 N/A LEU 179.A N PRO 176.A O no hydrogen 2.554 N/A GLU 180.A N LEU 178.A O no hydrogen 2.564 N/A GLN 181.A NE2 PRO 176.A O no hydrogen 2.629 N/A THR 185.A OG1 THR 187.A OG1 no hydrogen 3.067 N/A THR 187.A N THR 185.A OG1 no hydrogen 3.144 N/A THR 187.A OG1 THR 185.A OG1 no hydrogen 3.067 N/A THR 187.A OG1 TRP 268.A O no hydrogen 3.247 N/A ASP 189.A N VAL 186.A O no hydrogen 3.180 N/A TRP 191.A N THR 187.A O no hydrogen 3.419 N/A SER 192.A OG ARG 129.A O no hydrogen 2.999 N/A SER 192.A OG VAL 188.A O no hydrogen 3.428 N/A PHE 193.A N ASP 189.A O no hydrogen 2.753 N/A GLY 194.A N TYR 190.A O no hydrogen 2.967 N/A THR 195.A N TRP 191.A O no hydrogen 2.920 N/A THR 195.A OG1 TRP 191.A O no hydrogen 2.708 N/A THR 195.A OG1 SER 192.A O no hydrogen 3.206 N/A LEU 196.A N SER 192.A O no hydrogen 2.691 N/A ALA 197.A N PHE 193.A O no hydrogen 2.992 N/A PHE 198.A N GLY 194.A O no hydrogen 2.558 N/A GLU 199.A N LEU 196.A O no hydrogen 3.345 N/A CYS 200.A N LEU 196.A O no hydrogen 3.184 N/A CYS 200.A SG LEU 196.A O no hydrogen 3.218 N/A ILE 201.A N ALA 197.A O no hydrogen 2.862 N/A THR 202.A N PHE 198.A O no hydrogen 3.321 N/A THR 202.A OG1 PHE 198.A O no hydrogen 2.647 N/A PHE 204.A N THR 202.A OG1 no hydrogen 2.954 N/A ARG 205.A NH1 GLN 172.A OE1 no hydrogen 3.014 N/A VAL 220.A N TRP 216.A O no hydrogen 2.682 N/A SER 224.A OG VAL 220.A O no hydrogen 3.484 N/A SER 224.A OG GLN 222.A O no hydrogen 2.985 N/A SER 224.A OG LYS 223.A O no hydrogen 2.571 N/A ASP 227.A N SER 224.A O no hydrogen 2.898 N/A ILE 228.A N SER 241.A O no hydrogen 3.056 N/A SER 231.A OG GLU 232.A OE1 no hydrogen 3.117 N/A LYS 239.A N SER 231.A O no hydrogen 2.670 N/A SER 241.A N VAL 229.A O no hydrogen 3.139 N/A SER 241.A OG SER 243.A O no hydrogen 3.206 N/A ASN 248.A N TYR 246.A O no hydrogen 2.740 N/A ASN 248.A ND2 PRO 245.A O no hydrogen 3.362 N/A ASN 249.A ND2 ARG 103.A O no hydrogen 2.963 N/A ASN 249.A ND2 ASN 249.A O no hydrogen 2.728 N/A LEU 250.A N ASN 248.A OD1 no hydrogen 3.027 N/A VAL 253.A N ASN 251.A OD1 no hydrogen 2.981 N/A LEU 254.A N ASN 251.A OD1 no hydrogen 3.406 N/A ALA 255.A N ASN 251.A O no hydrogen 2.889 N/A ARG 257.A N LEU 254.A O no hydrogen 2.998 N/A LEU 258.A N LEU 254.A O no hydrogen 3.000 N/A LYS 260.A N ARG 257.A O no hydrogen 3.069 N/A LYS 260.A NZ GLU 256.A O no hydrogen 2.813 N/A LEU 262.A N LEU 258.A O no hydrogen 2.708 N/A GLN 263.A N LYS 260.A O no hydrogen 3.191 N/A LEU 264.A N LYS 260.A O no hydrogen 2.680 N/A MET 265.A N TRP 261.A O no hydrogen 2.511 N/A LEU 266.A N LEU 264.A O no hydrogen 2.448 N/A ARG 271.A NH1 GLN 263.A O no hydrogen 3.317 N/A ARG 271.A NH2 GLN 263.A O no hydrogen 2.711 N/A THR 272.A OG1 ARG 271.A O no hydrogen 2.253 N/A THR 275.A OG1 ASP 273.A O no hydrogen 2.715 N/A GLY 277.A N PRO 274.A O no hydrogen 2.970 N/A LYS 283.A NZ TYR 276.A O no hydrogen 2.598 N/A LYS 283.A NZ ASP 287.A OD2 no hydrogen 2.849 N/A ALA 284.A N GLY 280.A O no hydrogen 2.915 N/A ASP 287.A N LYS 283.A O no hydrogen 3.132 N/A LEU 289.A N LEU 285.A O no hydrogen 2.970 N/A ASN 290.A N ASP 286.A O no hydrogen 3.183 N/A LYS 292.A NZ GLU 311.A OE2 no hydrogen 3.197 N/A VAL 294.A N TYR 307.A O no hydrogen 2.927 N/A ILE 296.A N HIS 305.A O no hydrogen 2.823 N/A LEU 297.A N LEU 359.A O no hydrogen 3.389 N/A MET 299.A N PHE 361.A O no hydrogen 3.171 N/A THR 301.A N ASN 298.A O no hydrogen 2.785 N/A THR 301.A OG1 PRO 370.A O no hydrogen 3.454 N/A TYR 307.A N VAL 294.A O no hydrogen 3.078 N/A THR 310.A OG1 ASP 312.A OD1 no hydrogen 3.508 N/A ASP 312.A N THR 310.A OG1 no hydrogen 3.161 N/A SER 317.A N SER 314.A O no hydrogen 2.676 N/A SER 317.A OG GLU 313.A OE1 no hydrogen 2.831 N/A LYS 319.A N LEU 315.A O no hydrogen 3.195 N/A ARG 321.A N SER 317.A O no hydrogen 3.031 N/A ARG 321.A NH1 PRO 308.A O no hydrogen 3.232 N/A ILE 322.A N LEU 318.A O no hydrogen 2.831 N/A GLN 323.A N LYS 319.A O no hydrogen 3.244 N/A GLN 324.A N ALA 320.A O no hydrogen 3.151 N/A ASP 325.A N ILE 322.A O no hydrogen 2.928 N/A THR 326.A N ILE 322.A O no hydrogen 2.946 N/A GLN 333.A N GLU 331.A O no hydrogen 2.605 N/A GLN 333.A NE2 LYS 319.A O no hydrogen 3.105 N/A GLN 333.A NE2 ILE 328.A O no hydrogen 3.038 N/A GLU 334.A N LEU 362.A O no hydrogen 2.878 N/A LEU 336.A N VAL 360.A O no hydrogen 2.955 N/A GLN 337.A N LEU 341.A O no hydrogen 3.006 N/A LEU 343.A N LEU 335.A O no hydrogen 3.206 N/A LYS 347.A N ILE 344.A O no hydrogen 3.390 N/A CYS 352.A SG ALA 349.A O no hydrogen 3.307 N/A CYS 352.A SG THR 350.A O no hydrogen 3.664 N/A ILE 353.A N THR 350.A O no hydrogen 3.064 N/A ASP 355.A N ILE 353.A O no hydrogen 2.598 N/A LEU 359.A N HIS 295.A O no hydrogen 2.967 N/A PHE 361.A N LEU 297.A O no hydrogen 3.260 N/A LEU 362.A N GLU 334.A O no hydrogen 2.690 N/A SER 366.A OG ASN 365.A O no hydrogen 2.340 N/A LYS 367.A NZ TYR 568.A O no hydrogen 3.065 N/A ARG 371.A NE ARG 371.A O no hydrogen 2.859 N/A SER 376.A OG GLU 375.A O no hydrogen 2.582 N/A SER 376.A OG VAL 377.A O no hydrogen 3.132 N/A SER 378.A OG GLN 399.A OE1 no hydrogen 3.090 N/A CYS 379.A N VAL 377.A O no hydrogen 2.552 N/A CYS 379.A SG GLU 375.A O no hydrogen 3.080 N/A CYS 379.A SG SER 376.A O no hydrogen 3.401 N/A CYS 379.A SG SER 376.A OG no hydrogen 3.758 N/A CYS 379.A SG VAL 377.A O no hydrogen 3.332 N/A GLN 382.A N CYS 379.A O no hydrogen 2.785 N/A GLN 382.A NE2 GLN 382.A O no hydrogen 2.631 N/A LYS 385.A N GLN 382.A O no hydrogen 3.215 N/A ARG 386.A NH1 ASN 387.A OD1 no hydrogen 3.568 N/A ARG 394.A N PHE 391.A O no hydrogen 2.661 N/A LYS 395.A N GLN 392.A O no hydrogen 2.931 N/A VAL 396.A N GLN 392.A O no hydrogen 3.233 N/A TRP 397.A N LEU 393.A O no hydrogen 2.885 N/A GLN 399.A N LYS 395.A O no hydrogen 2.832 N/A VAL 400.A N TRP 397.A O no hydrogen 3.060 N/A VAL 400.A N GLY 398.A O no hydrogen 2.463 N/A HIS 402.A N GLY 398.A O no hydrogen 3.413 N/A SER 403.A N VAL 400.A O no hydrogen 2.651 N/A SER 403.A OG GLU 375.A OE2 no hydrogen 3.284 N/A ILE 404.A N VAL 400.A O no hydrogen 2.736 N/A GLN 405.A N TRP 401.A O no hydrogen 2.540 N/A THR 406.A N SER 403.A O no hydrogen 3.315 N/A THR 406.A OG1 HIS 402.A O no hydrogen 2.513 N/A LEU 407.A N SER 403.A O no hydrogen 3.182 N/A LEU 407.A N ILE 404.A O no hydrogen 2.746 N/A LYS 408.A N ILE 404.A O no hydrogen 2.876 N/A LYS 408.A NZ GLU 523.A OE2 no hydrogen 2.891 N/A GLU 409.A N GLN 405.A O no hydrogen 3.049 N/A ASP 410.A N THR 406.A O no hydrogen 2.754 N/A CYS 411.A N LEU 407.A O no hydrogen 2.772 N/A ASN 412.A N LYS 408.A O no hydrogen 3.267 N/A ARG 413.A N ASP 410.A O no hydrogen 2.985 N/A LEU 414.A N ASP 410.A O no hydrogen 3.334 N/A GLN 415.A N CYS 411.A O no hydrogen 2.773 N/A GLN 416.A N ASN 412.A O no hydrogen 2.941 N/A GLY 417.A N LEU 414.A O no hydrogen 2.890 N/A GLN 418.A N LEU 414.A O no hydrogen 3.116 N/A ARG 419.A N GLN 415.A O no hydrogen 2.843 N/A ALA 420.A N GLY 417.A O no hydrogen 3.322 N/A ALA 421.A N GLY 417.A O no hydrogen 2.712 N/A MET 422.A N GLN 418.A O no hydrogen 2.885 N/A ASN 424.A N ALA 420.A O no hydrogen 3.344 N/A ASN 424.A N ALA 421.A O no hydrogen 2.884 N/A LEU 426.A N MET 422.A O no hydrogen 3.236 N/A ARG 427.A N ASN 424.A O no hydrogen 3.141 N/A ASN 428.A N ASN 424.A O no hydrogen 3.226 N/A ASN 429.A ND2 GLN 508.A OE1 no hydrogen 3.308 N/A SER 430.A N LEU 426.A O no hydrogen 3.286 N/A SER 433.A N CYS 431.A O no hydrogen 2.526 N/A LYS 434.A N ASN 429.A O no hydrogen 2.545 N/A MET 435.A N CYS 431.A O no hydrogen 3.276 N/A ASN 437.A N SER 433.A O no hydrogen 2.600 N/A ASN 437.A ND2 LYS 434.A O no hydrogen 3.654 N/A SER 438.A N LYS 434.A O no hydrogen 3.146 N/A SER 438.A OG LYS 434.A O no hydrogen 3.243 N/A MET 439.A N MET 435.A O no hydrogen 3.095 N/A ALA 440.A N LYS 436.A O no hydrogen 3.038 N/A ALA 440.A N ASN 437.A O no hydrogen 3.024 N/A SER 441.A N SER 438.A O no hydrogen 3.344 N/A SER 441.A OG SER 438.A O no hydrogen 2.741 N/A MET 442.A N MET 439.A O no hydrogen 3.050 N/A SER 443.A N ALA 440.A O no hydrogen 3.206 N/A GLN 444.A N SER 441.A O no hydrogen 3.010 N/A GLN 444.A NE2 SER 441.A O no hydrogen 3.266 N/A GLN 445.A N MET 442.A O no hydrogen 2.756 N/A LEU 446.A N MET 442.A O no hydrogen 2.839 N/A LYS 447.A N SER 443.A O no hydrogen 2.904 N/A ALA 448.A N GLN 444.A O no hydrogen 3.263 N/A LYS 449.A N GLN 445.A O no hydrogen 2.815 N/A LEU 450.A N LEU 446.A O no hydrogen 3.243 N/A ASP 451.A N ALA 448.A O no hydrogen 3.091 N/A PHE 452.A N LYS 449.A O no hydrogen 2.748 N/A PHE 453.A N LEU 450.A O no hydrogen 3.211 N/A LYS 454.A N ASP 451.A O no hydrogen 2.996 N/A THR 455.A N PHE 452.A O no hydrogen 2.808 N/A ILE 457.A N PHE 453.A O no hydrogen 3.218 N/A LEU 461.A N GLN 458.A O no hydrogen 3.189 N/A LYS 463.A NZ GLU 469.A OE2 no hydrogen 2.977 N/A TYR 464.A N LEU 461.A O no hydrogen 3.380 N/A SER 465.A OG LEU 461.A O no hydrogen 3.077 N/A GLY 471.A N GLN 467.A OE1 no hydrogen 3.225 N/A TRP 481.A N LEU 478.A O no hydrogen 3.081 N/A MET 484.A N ALA 480.A O no hydrogen 3.000 N/A GLU 485.A N ARG 482.A O no hydrogen 3.228 N/A GLN 486.A NE2 GLU 485.A OE2 no hydrogen 3.501 N/A ALA 487.A N MET 484.A O no hydrogen 3.193 N/A VAL 488.A N MET 484.A O no hydrogen 2.886 N/A GLU 489.A N GLU 485.A O no hydrogen 3.248 N/A LEU 490.A N ALA 487.A O no hydrogen 2.975 N/A CYS 491.A SG ALA 487.A O no hydrogen 3.432 N/A CYS 491.A SG VAL 488.A O no hydrogen 3.215 N/A CYS 491.A SG CYS 491.A O no hydrogen 2.817 N/A LEU 499.A N GLU 496.A O no hydrogen 2.914 N/A VAL 501.A N VAL 497.A O no hydrogen 3.256 N/A GLU 502.A N LYS 498.A O no hydrogen 3.223 N/A ARG 503.A N LEU 499.A O no hydrogen 3.274 N/A MET 504.A N LEU 500.A O no hydrogen 2.536 N/A MET 505.A N VAL 501.A O no hydrogen 2.612 N/A ALA 506.A N ARG 503.A O no hydrogen 3.163 N/A GLN 508.A N MET 504.A O no hydrogen 3.047 N/A THR 509.A N ALA 506.A O no hydrogen 3.199 N/A THR 509.A OG1 MET 505.A O no hydrogen 3.453 N/A THR 509.A OG1 ALA 506.A O no hydrogen 2.785 N/A ASP 510.A N ALA 506.A O no hydrogen 2.579 N/A ILE 511.A N LEU 507.A O no hydrogen 3.036 N/A LEU 514.A N ILE 511.A O no hydrogen 3.314 N/A ASP 521.A N THR 518.A O no hydrogen 2.923 N/A LEU 522.A N THR 518.A O no hydrogen 3.153 N/A GLU 523.A N LEU 519.A O no hydrogen 3.209 N/A GLN 525.A N ASP 521.A O no hydrogen 2.766 N/A ALA 526.A N LEU 522.A O no hydrogen 2.844 N/A ARG 527.A N GLU 523.A O no hydrogen 3.212 N/A ARG 527.A NH2 GLU 523.A OE1 no hydrogen 2.873 N/A GLU 528.A N GLU 524.A O no hydrogen 3.324 N/A GLU 528.A N GLN 525.A O no hydrogen 3.178 N/A LEU 529.A N ALA 526.A O no hydrogen 2.794 N/A TYR 530.A OH TRP 397.A O no hydrogen 3.117 N/A ARG 531.A N ARG 527.A O no hydrogen 3.126 N/A ARG 531.A NE GLU 528.A OE1 no hydrogen 3.448 N/A ARG 531.A NH2 GLU 528.A OE1 no hydrogen 3.436 N/A ARG 531.A NH2 GLU 528.A OE2 no hydrogen 3.378 N/A ARG 532.A N LEU 529.A O no hydrogen 2.990 N/A LEU 533.A N TYR 530.A O no hydrogen 2.891 N/A ARG 534.A N TYR 530.A O no hydrogen 2.700 N/A LYS 536.A N LEU 533.A O no hydrogen 2.814 N/A ARG 538.A NH1 ASP 539.A OD1 no hydrogen 3.037 N/A ASP 539.A N PRO 537.A O no hydrogen 2.409 N/A GLN 540.A N PRO 537.A O no hydrogen 3.050 N/A THR 542.A OG1 PHE 390.A O no hydrogen 3.193 N/A SER 546.A N ASP 545.A OD1 no hydrogen 2.693 N/A SER 546.A OG ARG 386.A O no hydrogen 3.317 N/A GLN 547.A N ASP 545.A OD1 no hydrogen 2.934 N/A VAL 550.A N SER 546.A O no hydrogen 2.897 N/A ARG 551.A N GLN 547.A O no hydrogen 3.292 N/A LEU 552.A N GLU 548.A O no hydrogen 3.117 N/A LEU 552.A N MET 549.A O no hydrogen 3.117 N/A LEU 553.A N MET 549.A O no hydrogen 3.101 N/A LEU 554.A N VAL 550.A O no hydrogen 3.043 N/A GLN 555.A N ARG 551.A O no hydrogen 3.383 N/A GLN 555.A NE2 ARG 551.A O no hydrogen 2.770 N/A ALA 556.A N LEU 552.A O no hydrogen 2.912 N/A ILE 557.A N LEU 553.A O no hydrogen 3.431 N/A GLN 558.A N LEU 554.A O no hydrogen 2.989 N/A SER 559.A N ALA 556.A O no hydrogen 3.205 N/A PHE 560.A N ILE 557.A O no hydrogen 2.722 N/A GLU 561.A N ILE 557.A O no hydrogen 2.869 N/A LYS 563.A N SER 559.A O no hydrogen 3.266 N/A VAL 564.A N PHE 560.A O no hydrogen 2.924 N/A ARG 565.A N GLU 561.A O no hydrogen 3.296 N/A VAL 566.A N LYS 562.A O no hydrogen 3.382 N/A ILE 567.A N LYS 563.A O no hydrogen 2.876 N/A TYR 568.A N VAL 564.A O no hydrogen 2.953 N/A TYR 568.A OH MET 299.A O no hydrogen 3.160 N/A THR 569.A N ARG 565.A O no hydrogen 2.882 N/A THR 569.A OG1 ARG 565.A O no hydrogen 2.795 N/A GLN 570.A N VAL 566.A O no hydrogen 2.907 N/A LEU 571.A N ILE 567.A O no hydrogen 2.869 N/A SER 572.A N TYR 568.A O no hydrogen 2.859 N/A SER 572.A OG SER 366.A O no hydrogen 2.978 N/A LYS 573.A NZ THR 569.A O no hydrogen 3.308 N/A THR 574.A N GLN 570.A O no hydrogen 3.252 N/A THR 574.A N LEU 571.A O no hydrogen 2.818 N/A THR 574.A OG1 GLN 570.A O no hydrogen 3.544 N/A THR 574.A OG1 LEU 571.A O no hydrogen 2.577 N/A VAL 575.A N LEU 571.A O no hydrogen 2.995 N/A CYS 577.A N THR 574.A O no hydrogen 3.271 N/A CYS 577.A SG LYS 573.A O no hydrogen 3.691 N/A LYS 578.A N THR 574.A O no hydrogen 3.073 N/A GLN 579.A N VAL 575.A O no hydrogen 3.056 N/A LYS 580.A N VAL 576.A O no hydrogen 3.011 N/A LYS 580.A NZ ASP 510.A OD2 no hydrogen 2.884 N/A ALA 581.A N LYS 578.A O no hydrogen 3.417 N/A LEU 582.A N LYS 578.A O no hydrogen 2.760 N/A GLU 583.A N GLN 579.A O no hydrogen 3.252 N/A VAL 588.A N LEU 585.A O no hydrogen 2.686 N/A GLU 589.A N PRO 586.A O no hydrogen 2.913 N/A GLU 590.A N PRO 586.A O no hydrogen 2.967 N/A SER 593.A OG GLU 597.A OE2 no hydrogen 2.967 N/A LEU 594.A N GLU 590.A O no hydrogen 2.705 N/A ASP 598.A N LEU 594.A O no hydrogen 3.154 N/A GLU 599.A N MET 595.A O no hydrogen 2.813 N/A LYS 600.A N MET 595.A O no hydrogen 2.942 N/A THR 601.A OG1 ASN 596.A O no hydrogen 3.490 N/A THR 601.A OG1 GLU 597.A O no hydrogen 2.756 N/A VAL 603.A N GLU 599.A O no hydrogen 2.812 N/A ARG 604.A N LYS 600.A O no hydrogen 2.732 N/A LEU 605.A N THR 601.A O no hydrogen 3.459 N/A GLN 610.A N GLU 607.A O no hydrogen 3.221 N/A LYS 611.A N LYS 608.A O no hydrogen 2.984 N/A GLU 612.A N LYS 608.A O no hydrogen 2.772 N/A TRP 614.A N LYS 611.A O no hydrogen 2.614 N/A LYS 618.A N ASN 615.A O no hydrogen 2.850 N/A ILE 619.A N ASN 615.A O no hydrogen 2.607 N/A CYS 621.A SG LEU 617.A O no hydrogen 3.048 N/A SER 622.A OG LYS 618.A O no hydrogen 3.232 N/A VAL 624.A N CYS 621.A O no hydrogen 3.030 N/A