Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7w3a_f.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N MET 1.A O no hydrogen 3.056 N/A GLY 5.A N MET 1.A O no hydrogen 3.056 N/A GLN 15.A N GLN 12.A O no hydrogen 3.315 N/A ALA 19.A N GLN 15.A O no hydrogen 2.570 N/A GLY 23.A N ALA 19.A O no hydrogen 3.294 N/A THR 24.A N ALA 20.A O no hydrogen 2.916 N/A THR 24.A OG1 ALA 20.A O no hydrogen 2.592 N/A GLU 26.A N TYR 71.A OH no hydrogen 3.487 N/A LYS 27.A NZ ASP 25.A OD1 no hydrogen 2.477 N/A ARG 33.A NH2 ALA 19.A O no hydrogen 3.437 N/A ARG 34.A N GLY 30.A O no hydrogen 2.925 N/A ARG 34.A NH1 SER 16.A O no hydrogen 2.804 N/A ASP 35.A N LYS 31.A O no hydrogen 2.911 N/A ALA 36.A N GLU 32.A O no hydrogen 2.918 N/A GLY 37.A N ARG 33.A O no hydrogen 2.884 N/A ASP 38.A N ARG 34.A O no hydrogen 2.911 N/A LYS 39.A NZ SER 85.A OG no hydrogen 2.402 N/A LYS 41.A N GLY 37.A O no hydrogen 2.880 N/A LYS 41.A NZ SER 16.A OG no hydrogen 3.091 N/A GLU 42.A N ASP 38.A O no hydrogen 2.911 N/A GLN 43.A N LYS 39.A O no hydrogen 2.910 N/A GLU 44.A N ASP 40.A O no hydrogen 2.908 N/A LEU 45.A N GLU 42.A O no hydrogen 3.229 N/A SER 46.A N GLU 42.A O no hydrogen 2.927 N/A LYS 50.A N GLU 48.A OE1 no hydrogen 2.691 N/A GLU 57.A N ASP 54.A O no hydrogen 3.500 N/A GLU 61.A N MET 58.A O no hydrogen 3.206 N/A GLU 65.A N GLU 61.A O no hydrogen 2.931 N/A LYS 66.A NZ ARG 62.A O no hydrogen 2.434 N/A ASP 67.A N LEU 63.A O no hydrogen 2.879 N/A THR 68.A N GLY 64.A O no hydrogen 2.898 N/A THR 68.A OG1 GLY 64.A O no hydrogen 2.814 N/A SER 69.A N GLU 65.A O no hydrogen 2.920 N/A LEU 70.A N LYS 66.A O no hydrogen 2.909 N/A TYR 71.A N THR 68.A O no hydrogen 3.207 N/A ARG 72.A N THR 68.A O no hydrogen 2.895 N/A ARG 72.A NH1 ARG 72.A O no hydrogen 2.361 N/A LEU 75.A N ARG 72.A O no hydrogen 3.279 N/A ARG 83.A NE TYR 110.A O no hydrogen 3.332 N/A SER 85.A OG GLN 81.A O no hydrogen 3.306 N/A THR 86.A N ILE 82.A O no hydrogen 2.891 N/A THR 86.A N ARG 83.A O no hydrogen 3.253 N/A THR 86.A OG1 ILE 82.A O no hydrogen 2.665 N/A THR 87.A N ARG 83.A O no hydrogen 2.923 N/A THR 87.A OG1 ARG 83.A O no hydrogen 2.634 N/A THR 90.A OG1 THR 87.A O no hydrogen 2.694 N/A SER 91.A N SER 88.A O no hydrogen 3.021 N/A SER 91.A OG THR 87.A O no hydrogen 2.511 N/A LEU 96.A N PRO 93.A O no hydrogen 2.671 N/A LYS 97.A N PRO 93.A O no hydrogen 2.647 N/A ARG 100.A NE ARG 100.A O no hydrogen 2.684 N/A ARG 100.A NH2 TYR 103.A O no hydrogen 2.411 N/A TYR 103.A N ARG 100.A O no hydrogen 3.120 N/A LYS 107.A N GLY 104.A O no hydrogen 3.218 N/A GLU 108.A N LYS 105.A O no hydrogen 3.311 N/A ILE 109.A N LYS 105.A O no hydrogen 2.912 N/A ASN 112.A ND2 GLU 108.A O no hydrogen 3.268 N/A ARG 120.A N GLU 117.A O no hydrogen 3.334 N/A THR 132.A N SER 127.A O no hydrogen 2.523 N/A THR 132.A OG1 SER 127.A O no hydrogen 2.484 N/A SER 134.A N ALA 130.A O no hydrogen 2.923 N/A SER 134.A OG ALA 130.A O no hydrogen 2.308 N/A GLY 135.A N MET 131.A O no hydrogen 2.795 N/A GLU 136.A N THR 132.A O no hydrogen 2.979 N/A ARG 137.A N MET 133.A O no hydrogen 2.917 N/A ARG 137.A NH2 LEU 106.A O no hydrogen 2.583 N/A CYS 139.A N GLY 135.A O no hydrogen 2.896 N/A LEU 140.A N GLU 136.A O no hydrogen 2.907 N/A LYS 141.A N ARG 137.A O no hydrogen 2.887 N/A TYR 142.A OH HIS 156.A ND1 no hydrogen 2.371 N/A ARG 143.A N LEU 140.A O no hydrogen 3.218 N/A ARG 143.A NE ARG 143.A O no hydrogen 3.491 N/A ARG 143.A NH2 GLY 146.A O no hydrogen 2.788 N/A LEU 144.A N LEU 140.A O no hydrogen 3.443 N/A VAL 145.A N TYR 142.A O no hydrogen 3.123 N/A GLY 146.A N TYR 142.A O no hydrogen 2.965 N/A GLN 148.A NE2 GLU 149.A OE1 no hydrogen 3.043 N/A HIS 156.A N SER 153.A O no hydrogen 3.208 N/A TYR 158.A N TRP 154.A O no hydrogen 2.899 N/A VAL 159.A N GLY 155.A O no hydrogen 2.901 N/A ARG 160.A N HIS 156.A O no hydrogen 2.921 N/A HIS 161.A N GLU 157.A O no hydrogen 2.898 N/A LEU 162.A N TYR 158.A O no hydrogen 2.890 N/A ALA 163.A N VAL 159.A O no hydrogen 2.886 N/A GLY 164.A N ARG 160.A O no hydrogen 2.935 N/A GLU 165.A N HIS 161.A O no hydrogen 2.919 N/A VAL 166.A N LEU 162.A O no hydrogen 2.962 N/A ALA 167.A N ALA 163.A O no hydrogen 2.852 N/A LYS 168.A N GLY 164.A O no hydrogen 2.969 N/A LYS 168.A NZ GLU 165.A O no hydrogen 2.433 N/A TRP 170.A N VAL 166.A O no hydrogen 2.877 N/A GLU 172.A N GLU 169.A O no hydrogen 2.927 N/A VAL 179.A N ALA 176.A O no hydrogen 3.245 N/A ARG 181.A N GLU 177.A O no hydrogen 2.908 N/A GLU 182.A N LYS 178.A O no hydrogen 2.892 N/A GLU 182.A N VAL 179.A O no hydrogen 3.341 N/A LEU 185.A N ARG 181.A O no hydrogen 2.974 N/A THR 186.A N GLU 182.A O no hydrogen 2.860 N/A THR 186.A OG1 GLU 182.A O no hydrogen 2.665 N/A THR 186.A OG1 GLU 182.A OE2 no hydrogen 2.631 N/A LEU 187.A N PRO 183.A O no hydrogen 2.911 N/A VAL 192.A N GLU 150.A OE2 no hydrogen 3.021 N/A ASN 195.A ND2 ASN 195.A O no hydrogen 2.584 N/A HIS 198.A N TYR 194.A O no hydrogen 2.886 N/A ASN 199.A N ASN 195.A O no hydrogen 2.916 N/A ASN 199.A N MET 196.A O no hydrogen 3.231 N/A ALA 200.A N ALA 197.A O no hydrogen 3.333 N/A HIS 202.A N HIS 198.A O no hydrogen 2.892 N/A GLU 203.A N ASN 199.A O no hydrogen 2.950 N/A CYS 205.A N GLU 201.A O no hydrogen 3.350 N/A CYS 205.A SG ASP 175.A OD1 no hydrogen 3.305 N/A CYS 205.A SG ASP 175.A OD2 no hydrogen 3.529 N/A LEU 208.A N CYS 205.A O no hydrogen 3.193 N/A VAL 214.A N GLU 210.A O no hydrogen 3.099 N/A VAL 214.A N ILE 211.A O no hydrogen 3.082 N/A ASP 215.A N ILE 211.A O no hydrogen 2.972 N/A LEU 217.A N VAL 214.A O no hydrogen 3.393 N/A LYS 219.A N ASP 215.A O no hydrogen 2.879 N/A LYS 219.A NZ GLN 180.A OE1 no hydrogen 2.486 N/A LYS 219.A NZ ASP 215.A OD2 no hydrogen 3.385 N/A ASP 220.A N MET 216.A O no hydrogen 2.876 N/A ILE 221.A N LEU 217.A O no hydrogen 2.933 N/A ASP 222.A N GLU 218.A O no hydrogen 2.856 N/A GLU 223.A N LYS 219.A O no hydrogen 2.883 N/A GLU 223.A N ASP 220.A O no hydrogen 3.156 N/A ASN 224.A N ASP 222.A O no hydrogen 2.707 N/A LEU 233.A N CYS 230.A O no hydrogen 3.299 N/A THR 234.A N CYS 230.A O no hydrogen 2.937 N/A SER 235.A OG LEU 231.A O no hydrogen 2.730 N/A VAL 237.A N LEU 233.A O no hydrogen 2.915 N/A ASN 238.A N SER 235.A O no hydrogen 3.136 N/A GLU 242.A N TYR 239.A O no hydrogen 3.214 N/A ASN 245.A N PRO 241.A O no hydrogen 2.891 N/A SER 246.A N GLU 242.A O no hydrogen 2.882 N/A SER 246.A OG PRO 243.A O no hydrogen 2.283 N/A LEU 249.A N GLU 244.A O no hydrogen 2.940 N/A LEU 249.A N SER 246.A O no hydrogen 2.731 N/A PHE 256.A N LEU 253.A O no hydrogen 3.047 N/A LYS 258.A NZ GLU 218.A OE2 no hydrogen 2.837 N/A PHE 259.A N VAL 255.A O no hydrogen 2.906 N/A SER 260.A N PHE 256.A O no hydrogen 2.870 N/A ARG 261.A N ARG 257.A O no hydrogen 2.945 N/A PHE 262.A N PHE 259.A O no hydrogen 3.153 N/A GLU 264.A N PHE 262.A O no hydrogen 2.668 N/A LEU 266.A N PRO 263.A O no hydrogen 2.969 N/A ARG 267.A NE GLY 299.A O no hydrogen 2.909 N/A ARG 267.A NH2 GLY 299.A O no hydrogen 2.452 N/A LEU 270.A N LEU 266.A O no hydrogen 2.940 N/A MET 271.A N ARG 267.A O no hydrogen 2.864 N/A LEU 272.A N ARG 267.A O no hydrogen 2.882 N/A ASN 273.A ND2 ALA 269.A O no hydrogen 2.775 N/A ASP 274.A N MET 271.A O no hydrogen 3.201 N/A MET 275.A N MET 271.A O no hydrogen 2.904 N/A SER 284.A N ILE 281.A O no hydrogen 3.083 N/A SER 284.A OG ASP 280.A O no hydrogen 3.400 N/A LYS 286.A NZ LEU 253.A O no hydrogen 3.359 N/A ASP 287.A N SER 284.A O no hydrogen 2.994 N/A VAL 288.A N CYS 285.A O no hydrogen 3.006 N/A VAL 289.A N CYS 285.A O no hydrogen 2.979 N/A VAL 290.A N LYS 286.A O no hydrogen 2.875 N/A LYS 292.A N VAL 288.A O no hydrogen 2.922 N/A LYS 292.A N VAL 289.A O no hydrogen 3.143 N/A ARG 300.A NE ARG 300.A O no hydrogen 2.703 N/A ARG 300.A NH1 GLU 276.A OE2 no hydrogen 3.220 N/A ARG 300.A NH2 GLU 276.A OE2 no hydrogen 2.602 N/A LEU 305.A N HIS 301.A O no hydrogen 2.920 N/A LEU 307.A N VAL 303.A O no hydrogen 3.131 N/A SER 308.A N VAL 303.A O no hydrogen 3.095 N/A SER 308.A OG GLU 313.A O no hydrogen 3.459 N/A TYR 314.A OH GLU 306.A OE1 no hydrogen 2.674 N/A LEU 317.A N GLU 313.A OE2 no hydrogen 2.614 N/A THR 318.A OG1 TYR 314.A O no hydrogen 3.365 N/A THR 318.A OG1 GLU 315.A O no hydrogen 2.803 N/A GLU 319.A N GLU 315.A O no hydrogen 2.902 N/A ILE 320.A N ASP 316.A O no hydrogen 3.413 N/A SER 322.A OG VAL 455.A O no hydrogen 3.398 N/A ASN 323.A ND2 GLY 454.A O no hydrogen 2.384 N/A GLN 325.A NE2 GLN 325.A O no hydrogen 3.611 N/A ASN 327.A N ASN 323.A O no hydrogen 2.859 N/A SER 328.A N VAL 324.A O no hydrogen 2.925 N/A SER 328.A OG VAL 324.A O no hydrogen 3.478 N/A SER 328.A OG GLN 325.A O no hydrogen 2.562 N/A ASN 329.A N GLN 325.A O no hydrogen 2.945 N/A PHE 330.A N LEU 326.A O no hydrogen 2.886 N/A LEU 331.A N ASN 327.A O no hydrogen 2.835 N/A ALA 332.A N SER 328.A O no hydrogen 2.926 N/A LEU 333.A N ASN 329.A O no hydrogen 2.909 N/A ALA 334.A N PHE 330.A O no hydrogen 2.899 N/A ARG 335.A N LEU 331.A O no hydrogen 2.888 N/A ARG 335.A N ALA 332.A O no hydrogen 3.244 N/A ARG 335.A NH1 GLN 387.A OE1 no hydrogen 2.624 N/A GLU 336.A N ALA 332.A O no hydrogen 2.977 N/A ASP 338.A N LEU 333.A O no hydrogen 2.823 N/A LYS 343.A NZ GLN 387.A O no hydrogen 2.410 N/A LYS 343.A NZ LYS 389.A O no hydrogen 3.039 N/A VAL 344.A N ASP 388.A OD1 no hydrogen 2.476 N/A TYR 349.A OH SER 374.A OG no hydrogen 3.137 N/A LYS 350.A N ASP 347.A O no hydrogen 2.965 N/A HIS 352.A N ILE 348.A O no hydrogen 2.933 N/A LEU 353.A N TYR 349.A O no hydrogen 2.926 N/A PHE 358.A N ASN 355.A O no hydrogen 3.491 N/A GLY 360.A N ARG 357.A O no hydrogen 3.474 N/A SER 361.A OG GLY 360.A O no hydrogen 2.676 N/A ASN 371.A ND2 TRP 398.A O no hydrogen 2.714 N/A ASN 371.A ND2 LYS 401.A O no hydrogen 2.769 N/A LEU 372.A N ALA 368.A O no hydrogen 3.084 N/A ALA 373.A N ARG 369.A O no hydrogen 3.080 N/A SER 374.A N MET 370.A O no hydrogen 2.896 N/A SER 374.A OG ASP 347.A OD1 no hydrogen 3.399 N/A SER 374.A OG TYR 349.A OH no hydrogen 3.137 N/A SER 374.A OG MET 370.A O no hydrogen 2.625 N/A SER 375.A N ASN 371.A O no hydrogen 2.920 N/A SER 375.A OG ASN 371.A O no hydrogen 3.103 N/A SER 375.A OG LEU 372.A O no hydrogen 2.588 N/A PHE 376.A N LEU 372.A O no hydrogen 2.952 N/A VAL 377.A N ALA 373.A O no hydrogen 2.890 N/A ASN 378.A N SER 374.A O no hydrogen 2.950 N/A GLY 379.A N SER 375.A O no hydrogen 2.905 N/A PHE 380.A N PHE 376.A O no hydrogen 2.897 N/A PHE 380.A N VAL 377.A O no hydrogen 3.087 N/A VAL 381.A N VAL 377.A O no hydrogen 2.933 N/A ASN 382.A N ASN 378.A O no hydrogen 3.001 N/A ASN 382.A ND2 VAL 344.A O no hydrogen 3.331 N/A ASN 382.A ND2 ASN 378.A OD1 no hydrogen 2.339 N/A PHE 385.A N ILE 417.A O no hydrogen 3.167 N/A LYS 389.A N GLN 387.A O no hydrogen 2.905 N/A LYS 389.A NZ GLY 386.A O no hydrogen 2.769 N/A ASP 394.A N ASP 393.A OD1 no hydrogen 2.811 N/A GLY 395.A N LEU 391.A O no hydrogen 2.883 N/A ASN 396.A N ASP 394.A O no hydrogen 2.849 N/A LEU 399.A N GLY 395.A O no hydrogen 2.883 N/A TYR 400.A N ASN 396.A O no hydrogen 2.899 N/A LYS 401.A N LYS 397.A O no hydrogen 2.903 N/A LYS 401.A N TRP 398.A O no hydrogen 3.324 N/A ASN 402.A ND2 LEU 399.A O no hydrogen 2.607 N/A LYS 403.A NZ ASP 404.A OD1 no hydrogen 2.848 N/A LYS 403.A NZ HIS 405.A ND1 no hydrogen 3.190 N/A HIS 405.A N ASP 404.A OD1 no hydrogen 2.705 N/A MET 407.A N LYS 403.A O no hydrogen 3.060 N/A SER 409.A N HIS 405.A O no hydrogen 2.962 N/A SER 409.A OG HIS 405.A O no hydrogen 3.028 N/A ALA 410.A N GLY 406.A O no hydrogen 2.878 N/A ALA 411.A N MET 407.A O no hydrogen 2.964 N/A ALA 412.A N LEU 408.A O no hydrogen 2.879 N/A SER 413.A N SER 409.A O no hydrogen 2.913 N/A SER 413.A OG SER 375.A O no hydrogen 2.614 N/A LEU 414.A N ALA 410.A O no hydrogen 2.907 N/A GLY 415.A N ALA 411.A O no hydrogen 2.926 N/A MET 416.A N ALA 412.A O no hydrogen 2.871 N/A ILE 417.A N SER 413.A O no hydrogen 2.936 N/A ILE 417.A N LEU 414.A O no hydrogen 3.206 N/A VAL 422.A N ASP 421.A OD1 no hydrogen 2.889 N/A THR 427.A N GLY 424.A O no hydrogen 3.386 N/A THR 427.A OG1 ASP 423.A O no hydrogen 3.541 N/A ASP 430.A N LEU 426.A O no hydrogen 3.368 N/A LEU 433.A N ASP 430.A O no hydrogen 3.117 N/A TYR 434.A N ASP 430.A O no hydrogen 3.443 N/A SER 436.A OG SER 435.A O no hydrogen 2.634 N/A TYR 439.A N ASP 438.A OD1 no hydrogen 2.529 N/A LYS 441.A N GLU 437.A O no hydrogen 2.811 N/A SER 442.A N ASP 438.A O no hydrogen 2.932 N/A SER 442.A OG ASP 438.A O no hydrogen 3.005 N/A SER 442.A OG THR 476.A O no hydrogen 2.707 N/A GLY 443.A N TYR 439.A O no hydrogen 2.910 N/A ALA 444.A N ILE 440.A O no hydrogen 2.880 N/A LEU 445.A N LYS 441.A O no hydrogen 2.911 N/A LEU 446.A N SER 442.A O no hydrogen 2.935 N/A ALA 447.A N GLY 443.A O no hydrogen 2.864 N/A CYS 448.A N ALA 444.A O no hydrogen 2.870 N/A GLY 449.A N LEU 445.A O no hydrogen 2.945 N/A ILE 450.A N LEU 446.A O no hydrogen 2.905 N/A ILE 450.A N ALA 447.A O no hydrogen 3.248 N/A VAL 451.A N ALA 447.A O no hydrogen 2.879 N/A SER 453.A N ILE 450.A O no hydrogen 2.949 N/A ARG 456.A NH1 LEU 298.A O no hydrogen 3.378 N/A ARG 456.A NH2 MET 297.A O no hydrogen 2.558 N/A CYS 459.A SG GLU 458.A OE2 no hydrogen 3.631 N/A ALA 464.A N PRO 461.A O no hydrogen 3.304 N/A LEU 466.A N ALA 462.A O no hydrogen 2.912 N/A SER 467.A OG LEU 463.A O no hydrogen 2.820 N/A ASP 468.A N LEU 465.A O no hydrogen 3.088 N/A SER 474.A N HIS 472.A O no hydrogen 2.922 N/A ASN 475.A N SER 474.A OG no hydrogen 2.573 N/A ARG 478.A NE HIS 472.A O no hydrogen 2.691 N/A ARG 478.A NH2 HIS 472.A O no hydrogen 2.829 N/A LEU 479.A N ASN 475.A O no hydrogen 2.685 N/A GLY 480.A N THR 476.A O no hydrogen 3.197 N/A SER 481.A OG TYR 469.A O no hydrogen 3.060 N/A SER 481.A OG MET 477.A O no hydrogen 3.432 N/A SER 481.A OG ARG 478.A O no hydrogen 3.009 N/A ILE 482.A N ARG 478.A O no hydrogen 3.454 N/A PHE 483.A N LEU 479.A O no hydrogen 3.321 N/A LEU 485.A N SER 481.A O no hydrogen 2.918 N/A GLY 486.A N ILE 482.A O no hydrogen 2.879 N/A LEU 487.A N PHE 483.A O no hydrogen 2.936 N/A ALA 488.A N GLY 484.A O no hydrogen 2.899 N/A TYR 489.A N LEU 485.A O no hydrogen 2.921 N/A SER 492.A OG TYR 489.A O no hydrogen 3.251 N/A THR 499.A N GLU 495.A O no hydrogen 2.912 N/A THR 499.A OG1 GLU 495.A O no hydrogen 2.871 N/A THR 499.A OG1 ASP 496.A O no hydrogen 2.878 N/A LEU 500.A N ASP 496.A O no hydrogen 2.901 N/A LEU 501.A N VAL 497.A O no hydrogen 2.908 N/A LEU 501.A N LEU 498.A O no hydrogen 3.229 N/A LEU 502.A N LEU 498.A O no hydrogen 2.909 N/A MET 505.A N LEU 501.A O no hydrogen 3.051 N/A GLY 506.A N LEU 502.A O no hydrogen 2.891 N/A LYS 509.A NZ ASN 473.A OD1 no hydrogen 2.449 N/A SER 510.A N ASP 507.A O no hydrogen 3.375 N/A SER 510.A OG ASP 507.A O no hydrogen 2.586 N/A SER 511.A OG GLU 513.A OE1 no hydrogen 2.623 N/A SER 511.A OG GLU 513.A OE2 no hydrogen 3.197 N/A GLU 513.A N GLU 513.A OE1 no hydrogen 2.715 N/A ALA 515.A N SER 511.A O no hydrogen 2.896 N/A GLY 516.A N MET 512.A O no hydrogen 2.921 N/A VAL 517.A N GLU 513.A O no hydrogen 2.923 N/A THR 518.A N VAL 514.A O no hydrogen 2.893 N/A ALA 519.A N ALA 515.A O no hydrogen 2.913 N/A LEU 520.A N GLY 516.A O no hydrogen 2.925 N/A ALA 521.A N VAL 517.A O no hydrogen 2.839 N/A CYS 522.A N THR 518.A O no hydrogen 2.899 N/A CYS 522.A SG THR 518.A O no hydrogen 3.330 N/A CYS 522.A SG ALA 519.A O no hydrogen 3.188 N/A GLY 523.A N ALA 519.A O no hydrogen 2.954 N/A MET 524.A N LEU 520.A O no hydrogen 2.864 N/A ILE 525.A N ALA 521.A O no hydrogen 2.913 N/A CYS 530.A N SER 529.A OG no hydrogen 2.835 N/A CYS 530.A SG GLU 495.A OE2 no hydrogen 3.344 N/A CYS 530.A SG ASP 533.A OD1 no hydrogen 3.453 N/A THR 535.A OG1 GLY 532.A O no hydrogen 2.728 N/A THR 537.A N ASP 533.A O no hydrogen 2.875 N/A THR 537.A OG1 ASP 533.A O no hydrogen 2.489 N/A ILE 538.A N VAL 534.A O no hydrogen 2.915 N/A THR 541.A N THR 537.A O no hydrogen 2.887 N/A THR 541.A OG1 THR 537.A O no hydrogen 2.702 N/A ILE 542.A N ILE 538.A O no hydrogen 2.894 N/A MET 543.A N LEU 539.A O no hydrogen 2.893 N/A LYS 545.A NZ GLU 544.A OE1 no hydrogen 3.131 N/A SER 546.A OG GLU 585.A OE2 no hydrogen 2.988 N/A THR 548.A N LYS 545.A O no hydrogen 2.888 N/A THR 548.A OG1 LYS 545.A O no hydrogen 3.363 N/A GLU 549.A N GLU 549.A OE1 no hydrogen 3.068 N/A LYS 551.A N THR 548.A O no hydrogen 3.135 N/A THR 553.A OG1 ASP 552.A O no hydrogen 2.560 N/A TYR 554.A OH GLU 513.A O no hydrogen 2.280 N/A TRP 557.A N TYR 554.A O no hydrogen 3.475 N/A LEU 558.A N ALA 555.A O no hydrogen 3.314 N/A GLY 561.A N TRP 557.A O no hydrogen 3.371 N/A GLY 563.A N PRO 559.A O no hydrogen 2.898 N/A LEU 564.A N LEU 560.A O no hydrogen 2.883 N/A ASN 565.A N GLY 561.A O no hydrogen 2.911 N/A ASN 565.A ND2 CYS 530.A O no hydrogen 2.805 N/A LEU 567.A N LEU 564.A O no hydrogen 3.367 N/A GLY 568.A N ALA 599.A O no hydrogen 2.413 N/A LYS 569.A NZ HIS 566.A ND1 no hydrogen 3.180 N/A ALA 575.A N GLU 571.A O no hydrogen 2.694 N/A LEU 577.A N ILE 573.A O no hydrogen 2.930 N/A ALA 578.A N GLU 574.A O no hydrogen 2.887 N/A ALA 579.A N ALA 575.A O no hydrogen 2.885 N/A LEU 580.A N ILE 576.A O no hydrogen 2.913 N/A GLU 581.A N LEU 577.A O no hydrogen 2.910 N/A SER 584.A N GLU 581.A O no hydrogen 3.431 N/A SER 584.A OG GLU 581.A O no hydrogen 3.064 N/A GLU 585.A N GLU 585.A OE1 no hydrogen 2.922 N/A ARG 588.A N GLU 585.A O no hydrogen 2.913 N/A ARG 588.A NE PHE 587.A O no hydrogen 3.067 N/A ARG 588.A NH2 PHE 587.A O no hydrogen 3.487 N/A ALA 591.A N ARG 588.A O no hydrogen 3.447 N/A THR 593.A N PHE 590.A O no hydrogen 3.280 N/A THR 593.A OG1 ASN 592.A OD1 no hydrogen 3.168 N/A VAL 595.A N ALA 591.A O no hydrogen 2.920 N/A ASP 596.A N ASN 592.A O no hydrogen 2.872 N/A VAL 597.A N THR 593.A O no hydrogen 2.906 N/A CYS 598.A N VAL 595.A O no hydrogen 3.209 N/A ALA 599.A N ASP 596.A O no hydrogen 3.441 N/A SER 603.A OG ASN 605.A OD1 no hydrogen 2.305 N/A LYS 608.A NZ GLU 571.A OE2 no hydrogen 2.338 N/A LYS 608.A NZ ASP 596.A OD1 no hydrogen 2.779 N/A LYS 608.A NZ ASP 596.A OD2 no hydrogen 3.158 N/A GLN 610.A NE2 GLY 604.A O no hydrogen 2.411 N/A GLN 611.A N LEU 607.A O no hydrogen 2.872 N/A LEU 613.A N LYS 608.A O no hydrogen 2.802 N/A ILE 615.A N GLN 611.A O no hydrogen 2.904 N/A CYS 616.A N GLN 611.A O no hydrogen 3.162 N/A HIS 619.A N ILE 615.A O no hydrogen 3.266 N/A SER 622.A OG GLU 624.A OE2 no hydrogen 2.844 N/A GLU 624.A N GLU 624.A OE1 no hydrogen 2.757 N/A LYS 629.A NZ CYS 616.A O no hydrogen 2.365 N/A LYS 631.A N ASP 630.A OD1 no hydrogen 2.836 N/A LYS 631.A NZ GLU 627.A O no hydrogen 3.180 N/A LYS 631.A NZ GLU 627.A OE1 no hydrogen 2.484 N/A LYS 631.A NZ ASP 630.A OD1 no hydrogen 2.839 N/A LYS 631.A NZ ASP 630.A OD2 no hydrogen 2.928 N/A LYS 637.A N ASP 636.A OD1 no hydrogen 2.824 N/A LYS 639.A NZ ASP 596.A O no hydrogen 2.294 N/A MET 646.A N PRO 643.A O no hydrogen 3.327 N/A GLY 651.A N GLY 647.A O no hydrogen 3.349 N/A VAL 652.A N ALA 648.A O no hydrogen 2.944 N/A VAL 654.A N GLN 650.A O no hydrogen 2.891 N/A LEU 655.A N GLY 651.A O no hydrogen 3.017 N/A ILE 657.A N ALA 653.A O no hydrogen 2.891 N/A ALA 658.A N LEU 655.A O no hydrogen 3.325 N/A LEU 659.A N LEU 655.A O no hydrogen 2.881 N/A GLU 665.A N GLU 665.A OE1 no hydrogen 2.781 N/A ALA 668.A N GLU 664.A O no hydrogen 3.100 N/A GLU 669.A N GLU 664.A O no hydrogen 2.754 N/A ALA 671.A N ALA 668.A O no hydrogen 3.327 N/A LEU 672.A N MET 670.A O no hydrogen 2.723 N/A ARG 673.A NH1 MET 670.A O no hydrogen 2.577 N/A THR 674.A OG1 ASP 636.A OD1 no hydrogen 3.145 N/A GLY 676.A N LEU 672.A O no hydrogen 2.924 N/A HIS 677.A N ARG 673.A O no hydrogen 2.895 N/A TYR 681.A OH GLU 683.A OE1 no hydrogen 2.491 N/A THR 685.A OG1 PRO 684.A O no hydrogen 2.553 N/A LEU 692.A N ARG 688.A O no hydrogen 3.097 N/A ALA 693.A N VAL 690.A O no hydrogen 3.271 N/A SER 698.A OG ASN 701.A OD1 no hydrogen 2.542 N/A LEU 704.A N ASN 701.A O no hydrogen 3.181 N/A ILE 706.A N PRO 702.A O no hydrogen 2.957 N/A LEU 707.A N ARG 703.A O no hydrogen 3.251 N/A ASP 708.A N LEU 704.A O no hydrogen 2.876 N/A THR 709.A N ASN 705.A O no hydrogen 2.889 N/A THR 709.A OG1 ASN 705.A O no hydrogen 3.141 N/A THR 709.A OG1 ILE 706.A O no hydrogen 2.524 N/A LEU 710.A N ILE 706.A O no hydrogen 2.966 N/A SER 711.A N LEU 707.A O no hydrogen 2.908 N/A SER 711.A OG ASP 708.A O no hydrogen 2.936 N/A SER 711.A OG ASP 708.A OD1 no hydrogen 3.536 N/A LYS 712.A N ASP 708.A O no hydrogen 2.862 N/A PHE 713.A N THR 709.A O no hydrogen 2.997 N/A SER 714.A N LEU 710.A O no hydrogen 2.890 N/A SER 714.A OG LEU 710.A O no hydrogen 2.341 N/A SER 714.A OG TYR 781.A OH no hydrogen 2.481 N/A HIS 715.A N SER 711.A O no hydrogen 3.285 N/A ASP 716.A N PHE 713.A O no hydrogen 3.445 N/A SER 722.A OG HIS 352.A NE2 no hydrogen 2.516 N/A TYR 723.A N SER 722.A OG no hydrogen 2.837 N/A SER 725.A OG SER 725.A O no hydrogen 2.341 N/A SER 725.A OG TYR 751.A OH no hydrogen 2.752 N/A ALA 728.A N SER 725.A O no hydrogen 3.250 N/A MET 729.A N ILE 726.A O no hydrogen 3.215 N/A MET 731.A N PHE 727.A O no hydrogen 2.879 N/A VAL 732.A N ALA 728.A O no hydrogen 2.911 N/A SER 734.A OG GLY 730.A O no hydrogen 2.314 N/A SER 734.A OG VAL 732.A O no hydrogen 3.394 N/A ARG 740.A NH1 ALA 792.A O no hydrogen 2.842 N/A ARG 740.A NH2 ALA 792.A O no hydrogen 2.847 N/A ALA 743.A N ASN 737.A O no hydrogen 3.108 N/A ALA 743.A N ALA 739.A O no hydrogen 3.300 N/A GLN 747.A N ALA 743.A O no hydrogen 2.947 N/A LEU 748.A N LEU 745.A O no hydrogen 3.207 N/A ALA 749.A N LEU 745.A O no hydrogen 2.884 N/A GLN 750.A N LEU 745.A O no hydrogen 3.257 N/A TYR 751.A OH SER 725.A OG no hydrogen 2.752 N/A HIS 752.A ND1 ALA 749.A O no hydrogen 2.362 N/A LYS 754.A NZ TYR 751.A O no hydrogen 3.319 N/A ASP 755.A N HIS 752.A O no hydrogen 3.161 N/A ASN 758.A ND2 ASP 755.A OD1 no hydrogen 3.153 N/A ASN 758.A ND2 ASP 755.A OD2 no hydrogen 3.364 N/A ARG 763.A NH2 GLU 641.A OE2 no hydrogen 2.820 N/A LEU 764.A N THR 769.A O no hydrogen 2.714 N/A LEU 768.A N GLN 766.A OE1 no hydrogen 3.348 N/A THR 769.A OG1 GLN 766.A OE1 no hydrogen 2.564 N/A GLY 772.A N ALA 295.A O no hydrogen 3.086 N/A GLY 774.A N LEU 771.A O no hydrogen 3.325 N/A LEU 776.A N LYS 773.A O no hydrogen 3.314 N/A LEU 778.A N THR 775.A O no hydrogen 3.103 N/A CYS 779.A N THR 775.A O no hydrogen 2.873 N/A CYS 779.A SG THR 775.A O no hydrogen 3.333 N/A CYS 779.A SG THR 775.A OG1 no hydrogen 2.686 N/A SER 783.A N PRO 780.A O no hydrogen 3.400 N/A SER 783.A OG PRO 780.A O no hydrogen 2.684 N/A GLN 786.A N SER 783.A O no hydrogen 3.417 N/A GLN 786.A NE2 THR 553.A O no hydrogen 3.657 N/A SER 789.A OG MET 788.A O no hydrogen 2.615 N/A GLN 790.A NE2 GLN 790.A O no hydrogen 3.417 N/A GLN 790.A NE2 LEU 797.A O no hydrogen 3.151 N/A ALA 792.A N LEU 787.A O no hydrogen 3.029 N/A LEU 796.A N SER 789.A O no hydrogen 3.205 N/A THR 798.A OG1 SER 802.A OG no hydrogen 3.277 N/A SER 802.A N VAL 799.A O no hydrogen 3.293 N/A SER 802.A OG THR 798.A O no hydrogen 2.370 N/A SER 802.A OG THR 798.A OG1 no hydrogen 3.277 N/A ARG 807.A NH2 LYS 292.A O no hydrogen 2.321 N/A LEU 811.A N GLY 854.A O no hydrogen 2.900 N/A GLY 812.A N GLU 878.A O no hydrogen 2.826 N/A LYS 813.A NZ ASP 851.A O no hydrogen 3.110 N/A HIS 815.A N LEU 818.A O no hydrogen 3.124 N/A TYR 816.A N GLU 881.A OE2 no hydrogen 2.577 N/A VAL 817.A N HIS 815.A O no hydrogen 2.712 N/A GLN 826.A N GLN 826.A OE1 no hydrogen 3.019 N/A VAL 831.A N THR 861.A OG1 no hydrogen 3.195 N/A THR 832.A OG1 LEU 840.A O no hydrogen 2.885 N/A LEU 840.A N ARG 838.A O no hydrogen 2.740 N/A ARG 845.A NH1 ARG 845.A O no hydrogen 3.015 N/A ALA 849.A N GLN 848.A OE1 no hydrogen 2.969 N/A ASP 851.A N ALA 849.A O no hydrogen 3.047 N/A ALA 856.A N ILE 809.A O no hydrogen 3.351 N/A LYS 860.A N LYS 858.A O no hydrogen 2.811 N/A THR 861.A N ARG 828.A O no hydrogen 3.164 N/A THR 863.A N GLN 826.A O no hydrogen 3.486 N/A THR 867.A OG1 GLN 866.A O no hydrogen 2.622 N/A HIS 868.A N PHE 865.A O no hydrogen 2.924 N/A THR 869.A OG1 HIS 868.A O no hydrogen 2.550 N/A LEU 882.A N SER 814.A O no hydrogen 3.124 N/A