Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7w39_f.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N ASP 7.A OD2 no hydrogen 2.636 N/A GLN 14.A N VAL 11.A O no hydrogen 3.205 N/A GLN 15.A N GLN 12.A O no hydrogen 3.309 N/A SER 16.A N GLN 12.A O no hydrogen 2.918 N/A SER 16.A OG GLN 12.A O no hydrogen 2.389 N/A SER 16.A OG GLN 12.A OE1 no hydrogen 2.889 N/A ALA 19.A N GLN 15.A O no hydrogen 2.699 N/A ALA 20.A N PRO 17.A O no hydrogen 3.263 N/A GLY 23.A N ALA 19.A O no hydrogen 2.733 N/A THR 24.A N PRO 21.A O no hydrogen 3.068 N/A THR 24.A OG1 ALA 20.A O no hydrogen 2.294 N/A ASP 25.A N PRO 21.A O no hydrogen 2.956 N/A LYS 27.A N THR 24.A O no hydrogen 3.478 N/A LYS 31.A N LYS 27.A O no hydrogen 2.944 N/A GLU 32.A N PRO 28.A O no hydrogen 2.880 N/A ARG 33.A N SER 29.A O no hydrogen 2.915 N/A ARG 34.A N GLY 30.A O no hydrogen 2.933 N/A ASP 35.A N LYS 31.A O no hydrogen 2.872 N/A ALA 36.A N GLU 32.A O no hydrogen 2.892 N/A GLY 37.A N ARG 33.A O no hydrogen 2.914 N/A ASP 38.A N ARG 34.A O no hydrogen 2.895 N/A LYS 39.A N ASP 35.A O no hydrogen 2.869 N/A ASP 40.A N ALA 36.A O no hydrogen 2.951 N/A GLU 42.A N ASP 38.A O no hydrogen 2.907 N/A GLN 43.A N LYS 39.A O no hydrogen 2.917 N/A GLU 44.A N ASP 40.A O no hydrogen 2.922 N/A LEU 45.A N LYS 41.A O no hydrogen 2.935 N/A SER 46.A N GLN 43.A O no hydrogen 3.421 N/A GLU 47.A N GLN 43.A O no hydrogen 2.908 N/A ASP 54.A N GLU 57.A OE2 no hydrogen 3.014 N/A GLU 57.A N GLU 57.A OE1 no hydrogen 3.181 N/A LEU 59.A N LEU 56.A O no hydrogen 3.109 N/A VAL 60.A N LEU 56.A O no hydrogen 2.953 N/A GLU 61.A N GLU 61.A OE1 no hydrogen 2.785 N/A ARG 62.A NH1 MET 58.A O no hydrogen 3.294 N/A ARG 62.A NH1 LEU 59.A O no hydrogen 3.109 N/A GLY 64.A N VAL 60.A O no hydrogen 2.916 N/A GLU 65.A N GLU 61.A O no hydrogen 2.923 N/A ASP 67.A N LEU 63.A O no hydrogen 2.930 N/A THR 68.A N GLY 64.A O no hydrogen 2.895 N/A SER 69.A N GLU 65.A O no hydrogen 2.877 N/A SER 69.A OG GLU 65.A O no hydrogen 2.674 N/A LEU 70.A N LYS 66.A O no hydrogen 2.920 N/A ARG 72.A N THR 68.A O no hydrogen 2.893 N/A LEU 75.A N TYR 71.A O no hydrogen 3.026 N/A ARG 79.A NH1 GLN 81.A OE1 no hydrogen 3.002 N/A ARG 79.A NH2 GLN 81.A OE1 no hydrogen 2.672 N/A ARG 80.A NE ARG 80.A O no hydrogen 3.009 N/A ARG 83.A N ARG 79.A O no hydrogen 2.972 N/A SER 84.A N ARG 80.A O no hydrogen 2.972 N/A SER 84.A OG ARG 80.A O no hydrogen 3.162 N/A SER 84.A OG GLN 81.A O no hydrogen 2.541 N/A SER 85.A N GLN 81.A O no hydrogen 2.918 N/A SER 85.A OG GLN 81.A O no hydrogen 2.876 N/A THR 86.A N ILE 82.A O no hydrogen 2.902 N/A THR 86.A OG1 ILE 82.A O no hydrogen 2.805 N/A THR 86.A OG1 ARG 83.A O no hydrogen 2.936 N/A THR 87.A N ARG 83.A O no hydrogen 2.947 N/A THR 87.A OG1 ARG 83.A O no hydrogen 2.695 N/A THR 87.A OG1 SER 84.A O no hydrogen 2.754 N/A SER 88.A N SER 84.A O no hydrogen 2.926 N/A SER 88.A OG SER 84.A O no hydrogen 2.959 N/A SER 88.A OG ASN 118.A OD1 no hydrogen 2.467 N/A MET 89.A N SER 85.A O no hydrogen 2.903 N/A THR 90.A N THR 86.A O no hydrogen 2.914 N/A SER 91.A OG THR 87.A O no hydrogen 2.633 N/A LYS 94.A NZ GLU 136.A OE1 no hydrogen 3.452 N/A LEU 96.A N PRO 93.A O no hydrogen 3.035 N/A LYS 97.A N PRO 93.A O no hydrogen 2.695 N/A HIS 102.A N ARG 100.A O no hydrogen 2.712 N/A LYS 105.A N HIS 102.A O no hydrogen 3.357 N/A LYS 107.A NZ GLU 111.A O no hydrogen 3.007 N/A ILE 109.A N LEU 106.A O no hydrogen 3.212 N/A TYR 110.A N LEU 106.A O no hydrogen 2.876 N/A GLU 111.A N LEU 106.A O no hydrogen 2.717 N/A MET 113.A N ASN 112.A OD1 no hydrogen 2.447 N/A LYS 119.A NZ TYR 110.A OH no hydrogen 2.659 N/A LYS 119.A NZ GLU 165.A OE2 no hydrogen 3.016 N/A ARG 120.A N GLU 117.A O no hydrogen 3.323 N/A ARG 120.A NH1 GLU 42.A OE1 no hydrogen 2.667 N/A ARG 120.A NH1 GLU 42.A OE2 no hydrogen 3.335 N/A ARG 120.A NH2 GLU 42.A OE1 no hydrogen 2.811 N/A ALA 122.A N LYS 119.A O no hydrogen 3.174 N/A ALA 123.A N ARG 120.A O no hydrogen 3.364 N/A SER 127.A OG SER 127.A O no hydrogen 2.388 N/A THR 132.A OG1 VAL 128.A O no hydrogen 2.785 N/A MET 133.A N LEU 129.A O no hydrogen 2.894 N/A SER 134.A N ALA 130.A O no hydrogen 2.938 N/A SER 134.A OG ALA 130.A O no hydrogen 3.436 N/A SER 134.A OG MET 131.A O no hydrogen 2.822 N/A GLY 135.A N MET 131.A O no hydrogen 2.855 N/A GLU 136.A N THR 132.A O no hydrogen 2.915 N/A ARG 137.A N SER 134.A O no hydrogen 3.252 N/A ARG 137.A NH1 GLU 111.A OE2 no hydrogen 2.308 N/A GLU 138.A N SER 134.A O no hydrogen 2.926 N/A LYS 141.A N ARG 137.A O no hydrogen 3.004 N/A LYS 141.A NZ TYR 103.A O no hydrogen 2.426 N/A LYS 141.A NZ GLU 136.A O no hydrogen 2.907 N/A LYS 141.A NZ ARG 137.A O no hydrogen 3.480 N/A TYR 142.A OH VAL 188.A O no hydrogen 2.760 N/A ARG 143.A NH2 TYR 142.A OH no hydrogen 3.080 N/A LEU 144.A N LEU 140.A O no hydrogen 2.900 N/A VAL 145.A N LYS 141.A O no hydrogen 2.973 N/A GLY 146.A N TYR 142.A O no hydrogen 2.856 N/A SER 147.A N LEU 144.A O no hydrogen 3.270 N/A SER 147.A OG ARG 143.A O no hydrogen 2.374 N/A GLN 148.A N LEU 144.A O no hydrogen 2.945 N/A GLU 149.A N VAL 145.A O no hydrogen 3.102 N/A GLU 150.A N GLU 150.A OE1 no hydrogen 2.937 N/A GLY 155.A N SER 153.A OG no hydrogen 3.320 N/A HIS 156.A N SER 153.A O no hydrogen 3.074 N/A GLU 157.A N GLU 157.A OE1 no hydrogen 3.278 N/A TYR 158.A N TRP 154.A O no hydrogen 2.912 N/A VAL 159.A N GLY 155.A O no hydrogen 2.849 N/A ARG 160.A N HIS 156.A O no hydrogen 2.938 N/A HIS 161.A N GLU 157.A O no hydrogen 2.846 N/A LEU 162.A N TYR 158.A O no hydrogen 2.889 N/A ALA 163.A N VAL 159.A O no hydrogen 2.848 N/A GLY 164.A N ARG 160.A O no hydrogen 2.922 N/A GLU 165.A N HIS 161.A O no hydrogen 2.881 N/A VAL 166.A N LEU 162.A O no hydrogen 2.883 N/A ALA 167.A N ALA 163.A O no hydrogen 2.920 N/A LYS 168.A N GLY 164.A O no hydrogen 2.899 N/A GLU 169.A N GLU 165.A O no hydrogen 2.864 N/A TRP 170.A N VAL 166.A O no hydrogen 2.900 N/A GLN 171.A N ALA 167.A O no hydrogen 2.913 N/A GLN 171.A NE2 GLU 182.A OE1 no hydrogen 2.706 N/A GLU 172.A N LYS 168.A O no hydrogen 2.886 N/A GLN 180.A NE2 ASP 215.A OD1 no hydrogen 2.973 N/A GLN 180.A NE2 ASP 834.A O no hydrogen 2.409 N/A ARG 181.A N LYS 178.A O no hydrogen 3.495 N/A ARG 181.A NH1 GLU 835.A OE2 no hydrogen 3.158 N/A GLU 182.A N VAL 179.A O no hydrogen 2.751 N/A LEU 185.A N ARG 181.A O no hydrogen 3.114 N/A THR 186.A N GLU 182.A O no hydrogen 2.863 N/A THR 186.A OG1 GLU 182.A O no hydrogen 2.335 N/A LEU 187.A N PRO 183.A O no hydrogen 2.889 N/A LYS 189.A N THR 186.A O no hydrogen 3.230 N/A LYS 189.A NZ GLU 190.A OE1 no hydrogen 2.625 N/A LYS 189.A NZ GLU 190.A OE2 no hydrogen 3.405 N/A GLU 190.A N TYR 142.A OH no hydrogen 2.358 N/A TYR 194.A N ILE 191.A O no hydrogen 3.261 N/A ALA 197.A N PRO 193.A O no hydrogen 2.904 N/A HIS 198.A N TYR 194.A O no hydrogen 2.901 N/A ASN 199.A N ASN 195.A O no hydrogen 2.918 N/A ALA 200.A N MET 196.A O no hydrogen 2.870 N/A GLU 201.A N ALA 197.A O no hydrogen 2.977 N/A HIS 202.A N HIS 198.A O no hydrogen 2.865 N/A GLU 203.A N ASN 199.A O no hydrogen 2.908 N/A ALA 204.A N ALA 200.A O no hydrogen 2.926 N/A CYS 205.A N GLU 201.A O no hydrogen 2.936 N/A CYS 205.A SG GLN 171.A O no hydrogen 3.247 N/A CYS 205.A SG ASP 175.A OD1 no hydrogen 3.772 N/A GLN 213.A N GLN 213.A OE1 no hydrogen 2.827 N/A ASP 215.A N GLU 212.A O no hydrogen 3.363 N/A LEU 217.A N GLN 213.A O no hydrogen 2.881 N/A GLU 218.A N VAL 214.A O no hydrogen 2.902 N/A LYS 219.A N ASP 215.A O no hydrogen 2.916 N/A ASP 220.A N MET 216.A O no hydrogen 2.872 N/A ILE 221.A N LEU 217.A O no hydrogen 2.912 N/A ASP 222.A N GLU 218.A O no hydrogen 2.894 N/A GLU 223.A N LYS 219.A O no hydrogen 2.946 N/A ASN 224.A N ILE 221.A O no hydrogen 3.313 N/A TYR 226.A OH ASP 222.A OD1 no hydrogen 3.286 N/A THR 234.A OG1 ASN 224.A O no hydrogen 3.010 N/A THR 234.A OG1 ASN 224.A OD1 no hydrogen 2.622 N/A SER 235.A OG LEU 231.A O no hydrogen 3.383 N/A VAL 237.A N LEU 233.A O no hydrogen 3.150 N/A ASN 238.A N SER 235.A O no hydrogen 3.268 N/A ASN 238.A ND2 PHE 259.A O no hydrogen 3.561 N/A TYR 239.A N SER 235.A O no hydrogen 2.886 N/A VAL 240.A N CYS 236.A O no hydrogen 2.933 N/A GLU 244.A N GLU 244.A OE1 no hydrogen 2.625 N/A ASN 245.A N PRO 241.A O no hydrogen 2.925 N/A SER 246.A N GLU 242.A O no hydrogen 2.955 N/A SER 246.A OG ASP 274.A OD2 no hydrogen 2.586 N/A ALA 247.A N PRO 243.A O no hydrogen 2.860 N/A LEU 248.A N PRO 243.A O no hydrogen 3.473 N/A LEU 249.A N SER 246.A O no hydrogen 3.402 N/A CYS 251.A SG ASP 274.A OD1 no hydrogen 3.584 N/A PHE 256.A N LEU 253.A O no hydrogen 2.840 N/A PHE 259.A N VAL 255.A O no hydrogen 2.882 N/A SER 260.A N PHE 256.A O no hydrogen 2.876 N/A ARG 261.A N ARG 257.A O no hydrogen 2.891 N/A ARG 261.A N LYS 258.A O no hydrogen 3.367 N/A GLU 264.A N PHE 262.A O no hydrogen 2.742 N/A LEU 270.A N LEU 266.A O no hydrogen 3.516 N/A LEU 272.A N ARG 267.A O no hydrogen 3.031 N/A ASN 273.A ND2 ALA 269.A O no hydrogen 3.151 N/A ASP 274.A N MET 271.A O no hydrogen 3.153 N/A MET 275.A N MET 271.A O no hydrogen 2.894 N/A GLU 276.A N GLU 276.A OE1 no hydrogen 2.631 N/A LEU 277.A N ASP 274.A O no hydrogen 3.378 N/A SER 284.A N ILE 281.A O no hydrogen 3.217 N/A LYS 286.A NZ MET 275.A O no hydrogen 3.001 N/A ASP 287.A N SER 284.A O no hydrogen 2.565 N/A VAL 288.A N CYS 285.A O no hydrogen 3.149 N/A VAL 289.A N CYS 285.A O no hydrogen 2.888 N/A VAL 290.A N LYS 286.A O no hydrogen 2.957 N/A LYS 292.A N VAL 288.A O no hydrogen 2.858 N/A PHE 296.A N GLN 293.A O no hydrogen 2.976 N/A ARG 300.A N MET 297.A O no hydrogen 3.268 N/A ARG 300.A NE ARG 300.A O no hydrogen 2.832 N/A ARG 300.A NH1 GLU 276.A OE1 no hydrogen 2.754 N/A ARG 300.A NH1 GLU 276.A OE2 no hydrogen 3.064 N/A ARG 300.A NH2 GLU 276.A OE2 no hydrogen 2.712 N/A HIS 301.A N MET 297.A O no hydrogen 2.923 N/A HIS 301.A ND1 MET 297.A O no hydrogen 2.389 N/A LEU 305.A N HIS 301.A O no hydrogen 2.904 N/A GLU 306.A N GLY 302.A O no hydrogen 2.916 N/A LEU 307.A N VAL 303.A O no hydrogen 2.896 N/A SER 308.A N PHE 304.A O no hydrogen 2.919 N/A GLU 313.A N GLU 313.A OE1 no hydrogen 2.832 N/A GLU 315.A N GLU 315.A OE1 no hydrogen 2.845 N/A LEU 317.A N GLU 313.A O no hydrogen 2.900 N/A THR 318.A N TYR 314.A O no hydrogen 2.872 N/A THR 318.A OG1 TYR 314.A O no hydrogen 2.629 N/A GLU 319.A N GLU 315.A O no hydrogen 2.911 N/A ILE 320.A N ASP 316.A O no hydrogen 2.918 N/A MET 321.A N LEU 317.A O no hydrogen 2.934 N/A SER 322.A N THR 318.A O no hydrogen 2.926 N/A SER 322.A OG THR 318.A O no hydrogen 2.990 N/A GLN 325.A N GLN 325.A OE1 no hydrogen 2.647 N/A LEU 326.A N ASN 323.A O no hydrogen 3.307 N/A ASN 327.A N ASN 323.A O no hydrogen 3.527 N/A SER 328.A OG VAL 324.A O no hydrogen 3.291 N/A SER 328.A OG GLN 325.A O no hydrogen 2.919 N/A ASN 329.A N GLN 325.A O no hydrogen 2.888 N/A PHE 330.A N LEU 326.A O no hydrogen 2.903 N/A LEU 331.A N ASN 327.A O no hydrogen 2.919 N/A ALA 332.A N SER 328.A O no hydrogen 2.889 N/A LEU 333.A N ASN 329.A O no hydrogen 2.861 N/A ALA 334.A N PHE 330.A O no hydrogen 2.940 N/A ARG 335.A N ALA 332.A O no hydrogen 3.168 N/A GLU 336.A N ALA 332.A O no hydrogen 2.918 N/A GLU 341.A N ILE 339.A O no hydrogen 2.900 N/A LYS 343.A NZ GLN 387.A O no hydrogen 2.399 N/A LYS 343.A NZ GLN 387.A OE1 no hydrogen 2.443 N/A ASN 355.A ND2 SER 734.A OG no hydrogen 3.148 N/A ASN 356.A ND2 GLY 733.A O no hydrogen 2.399 N/A GLY 360.A N ASN 355.A O no hydrogen 2.879 N/A GLY 362.A N ASN 356.A O no hydrogen 2.749 N/A SER 363.A OG SER 363.A O no hydrogen 2.588 N/A ASN 371.A N SER 367.A O no hydrogen 2.938 N/A LEU 372.A N ALA 368.A O no hydrogen 2.877 N/A ALA 373.A N ARG 369.A O no hydrogen 2.924 N/A SER 374.A N MET 370.A O no hydrogen 2.859 N/A SER 374.A OG MET 370.A O no hydrogen 3.006 N/A SER 375.A N ASN 371.A O no hydrogen 2.882 N/A SER 375.A OG LEU 372.A O no hydrogen 2.366 N/A PHE 376.A N LEU 372.A O no hydrogen 2.956 N/A VAL 377.A N ALA 373.A O no hydrogen 2.901 N/A ASN 378.A N SER 374.A O no hydrogen 2.865 N/A GLY 379.A N SER 375.A O no hydrogen 2.927 N/A PHE 380.A N PHE 376.A O no hydrogen 2.907 N/A VAL 381.A N VAL 377.A O no hydrogen 2.909 N/A ASN 382.A N ASN 378.A O no hydrogen 2.922 N/A ASN 382.A ND2 VAL 344.A O no hydrogen 3.620 N/A ASN 382.A ND2 ASN 378.A OD1 no hydrogen 2.545 N/A PHE 385.A N ILE 417.A O no hydrogen 2.919 N/A GLN 387.A NE2 GLU 341.A OE2 no hydrogen 3.206 N/A LYS 389.A N GLN 387.A O no hydrogen 2.850 N/A LYS 389.A NZ GLY 386.A O no hydrogen 2.583 N/A ASP 394.A N ASP 393.A OD1 no hydrogen 2.868 N/A LEU 399.A N GLY 395.A O no hydrogen 2.899 N/A TYR 400.A N ASN 396.A O no hydrogen 2.877 N/A LYS 401.A N LYS 397.A O no hydrogen 2.908 N/A ASN 402.A N TYR 400.A O no hydrogen 2.808 N/A ASN 402.A ND2 LEU 399.A O no hydrogen 3.588 N/A HIS 405.A N ASP 404.A OD1 no hydrogen 2.835 N/A MET 407.A N LYS 403.A O no hydrogen 2.877 N/A SER 409.A N HIS 405.A O no hydrogen 2.929 N/A SER 409.A OG HIS 405.A O no hydrogen 3.034 N/A ALA 410.A N GLY 406.A O no hydrogen 2.862 N/A ALA 411.A N MET 407.A O no hydrogen 2.972 N/A ALA 412.A N LEU 408.A O no hydrogen 2.892 N/A SER 413.A N SER 409.A O no hydrogen 2.907 N/A SER 413.A OG SER 409.A O no hydrogen 3.518 N/A SER 413.A OG ALA 410.A O no hydrogen 2.579 N/A LEU 414.A N ALA 410.A O no hydrogen 2.902 N/A GLY 415.A N ALA 411.A O no hydrogen 2.919 N/A MET 416.A N ALA 412.A O no hydrogen 2.920 N/A ILE 417.A N SER 413.A O no hydrogen 2.940 N/A THR 427.A N ASP 423.A O no hydrogen 2.945 N/A THR 427.A OG1 ASP 423.A O no hydrogen 2.947 N/A ILE 429.A N GLY 425.A O no hydrogen 2.925 N/A ASP 430.A N LEU 426.A O no hydrogen 2.910 N/A TYR 432.A N GLN 428.A O no hydrogen 3.406 N/A SER 435.A OG SER 435.A O no hydrogen 2.505 N/A SER 436.A OG SER 435.A O no hydrogen 2.677 N/A TYR 439.A N ASP 438.A OD1 no hydrogen 2.800 N/A LYS 441.A N GLU 437.A O no hydrogen 2.924 N/A LYS 441.A NZ TYR 469.A OH no hydrogen 3.381 N/A SER 442.A N ASP 438.A O no hydrogen 2.925 N/A SER 442.A OG ASP 438.A O no hydrogen 2.670 N/A SER 442.A OG THR 476.A O no hydrogen 3.462 N/A GLY 443.A N TYR 439.A O no hydrogen 2.891 N/A ALA 444.A N ILE 440.A O no hydrogen 2.838 N/A LEU 445.A N LYS 441.A O no hydrogen 2.925 N/A LEU 446.A N SER 442.A O no hydrogen 2.928 N/A ALA 447.A N GLY 443.A O no hydrogen 2.832 N/A CYS 448.A N ALA 444.A O no hydrogen 2.855 N/A GLY 449.A N LEU 445.A O no hydrogen 2.943 N/A ILE 450.A N LEU 446.A O no hydrogen 2.888 N/A VAL 451.A N ALA 447.A O no hydrogen 2.842 N/A ASN 452.A N CYS 448.A O no hydrogen 2.975 N/A SER 453.A N ILE 450.A O no hydrogen 3.227 N/A SER 453.A OG GLY 449.A O no hydrogen 2.955 N/A SER 453.A OG ILE 450.A O no hydrogen 2.840 N/A SER 453.A OG LEU 487.A O no hydrogen 2.546 N/A ARG 456.A NH2 HIS 301.A NE2 no hydrogen 3.075 N/A CYS 459.A SG GLU 458.A OE2 no hydrogen 3.326 N/A ASP 460.A N ASN 457.A O no hydrogen 3.025 N/A LEU 466.A N ALA 462.A O no hydrogen 2.925 N/A SER 467.A N LEU 463.A O no hydrogen 2.862 N/A SER 467.A OG LEU 463.A O no hydrogen 2.787 N/A SER 467.A OG ALA 464.A O no hydrogen 2.984 N/A ASP 468.A N ALA 464.A O no hydrogen 2.908 N/A TYR 469.A N LEU 465.A O no hydrogen 2.949 N/A SER 474.A OG THR 476.A OG1 no hydrogen 3.053 N/A THR 476.A OG1 SER 474.A OG no hydrogen 3.053 N/A ARG 478.A N SER 474.A O no hydrogen 2.872 N/A ARG 478.A NE HIS 472.A O no hydrogen 2.662 N/A ARG 478.A NH2 HIS 472.A O no hydrogen 2.883 N/A LEU 479.A N ASN 475.A O no hydrogen 2.880 N/A SER 481.A N MET 477.A O no hydrogen 2.920 N/A SER 481.A OG TYR 469.A O no hydrogen 3.412 N/A ILE 482.A N LEU 479.A O no hydrogen 3.444 N/A PHE 483.A N LEU 479.A O no hydrogen 2.912 N/A GLY 484.A N GLY 480.A O no hydrogen 2.919 N/A GLY 486.A N ILE 482.A O no hydrogen 2.914 N/A LEU 487.A N PHE 483.A O no hydrogen 2.925 N/A ALA 488.A N GLY 484.A O no hydrogen 2.859 N/A TYR 489.A N LEU 485.A O no hydrogen 2.932 N/A TYR 489.A OH ASP 460.A OD1 no hydrogen 2.591 N/A VAL 497.A N ASP 496.A OD1 no hydrogen 2.714 N/A THR 499.A N GLU 495.A O no hydrogen 2.896 N/A THR 499.A OG1 GLU 495.A O no hydrogen 3.059 N/A THR 499.A OG1 ASP 496.A O no hydrogen 2.959 N/A LEU 500.A N ASP 496.A O no hydrogen 2.916 N/A LEU 501.A N VAL 497.A O no hydrogen 2.888 N/A LEU 502.A N LEU 498.A O no hydrogen 2.911 N/A GLY 506.A N LEU 502.A O no hydrogen 2.920 N/A ASP 507.A N PRO 503.A O no hydrogen 2.884 N/A SER 510.A OG ASP 507.A O no hydrogen 3.522 N/A SER 511.A OG GLU 513.A OE1 no hydrogen 2.643 N/A GLU 513.A N GLU 513.A OE1 no hydrogen 3.113 N/A GLY 516.A N MET 512.A O no hydrogen 2.893 N/A VAL 517.A N GLU 513.A O no hydrogen 2.916 N/A THR 518.A N VAL 514.A O no hydrogen 2.954 N/A THR 518.A OG1 LEU 501.A O no hydrogen 3.290 N/A ALA 519.A N ALA 515.A O no hydrogen 2.878 N/A LEU 520.A N GLY 516.A O no hydrogen 2.916 N/A ALA 521.A N VAL 517.A O no hydrogen 2.874 N/A CYS 522.A N THR 518.A O no hydrogen 2.907 N/A CYS 522.A SG THR 518.A O no hydrogen 3.747 N/A CYS 522.A SG ALA 519.A O no hydrogen 3.160 N/A GLY 523.A N ALA 519.A O no hydrogen 2.908 N/A MET 524.A N LEU 520.A O no hydrogen 2.930 N/A ILE 525.A N ALA 521.A O no hydrogen 2.899 N/A ILE 525.A N CYS 522.A O no hydrogen 3.267 N/A ALA 526.A N CYS 522.A O no hydrogen 2.919 N/A CYS 530.A SG ASP 533.A OD2 no hydrogen 3.687 N/A VAL 534.A N CYS 530.A O no hydrogen 2.995 N/A THR 535.A N ASN 531.A O no hydrogen 2.871 N/A THR 535.A OG1 ASN 531.A O no hydrogen 2.981 N/A THR 535.A OG1 GLY 532.A O no hydrogen 2.501 N/A SER 536.A N GLY 532.A O no hydrogen 2.902 N/A THR 537.A N ASP 533.A O no hydrogen 2.848 N/A THR 537.A OG1 ASP 533.A O no hydrogen 2.515 N/A ILE 538.A N VAL 534.A O no hydrogen 2.973 N/A LEU 539.A N THR 535.A O no hydrogen 2.883 N/A GLN 540.A N SER 536.A O no hydrogen 2.893 N/A THR 541.A N THR 537.A O no hydrogen 2.924 N/A THR 541.A OG1 THR 537.A O no hydrogen 2.621 N/A ILE 542.A N ILE 538.A O no hydrogen 2.901 N/A MET 543.A N LEU 539.A O no hydrogen 2.911 N/A THR 548.A OG1 GLU 547.A OE2 no hydrogen 3.297 N/A GLU 549.A N GLU 549.A OE1 no hydrogen 2.920 N/A LYS 551.A N GLU 547.A O no hydrogen 2.890 N/A ASP 552.A N THR 548.A O no hydrogen 2.899 N/A THR 553.A OG1 ASP 552.A O no hydrogen 2.694 N/A THR 553.A OG1 GLN 786.A OE1 no hydrogen 3.205 N/A LEU 558.A N ALA 555.A O no hydrogen 3.451 N/A LEU 560.A N ARG 556.A O no hydrogen 2.954 N/A GLY 561.A N TRP 557.A O no hydrogen 2.829 N/A LEU 562.A N LEU 558.A O no hydrogen 3.005 N/A GLY 563.A N PRO 559.A O no hydrogen 2.861 N/A LEU 564.A N LEU 560.A O no hydrogen 2.906 N/A ASN 565.A N GLY 561.A O no hydrogen 2.875 N/A HIS 566.A N LEU 562.A O no hydrogen 2.943 N/A HIS 566.A N GLY 563.A O no hydrogen 3.267 N/A HIS 566.A ND1 GLU 574.A OE2 no hydrogen 2.759 N/A HIS 566.A NE2 ASN 531.A OD1 no hydrogen 3.059 N/A LYS 569.A NZ GLY 528.A O no hydrogen 2.395 N/A GLU 574.A N GLY 570.A O no hydrogen 3.321 N/A ALA 578.A N GLU 574.A O no hydrogen 2.916 N/A ALA 579.A N ALA 575.A O no hydrogen 2.903 N/A LEU 580.A N ILE 576.A O no hydrogen 2.919 N/A VAL 583.A N LEU 580.A O no hydrogen 3.345 N/A SER 584.A N GLU 581.A O no hydrogen 3.480 N/A GLU 585.A N GLU 585.A OE1 no hydrogen 2.858 N/A ARG 588.A N GLU 585.A O no hydrogen 2.781 N/A PHE 590.A N PHE 587.A O no hydrogen 3.210 N/A ALA 591.A N PHE 587.A O no hydrogen 2.935 N/A ASN 592.A N ARG 588.A O no hydrogen 2.876 N/A THR 593.A OG1 SER 589.A O no hydrogen 3.227 N/A THR 593.A OG1 ASN 592.A OD1 no hydrogen 3.157 N/A LEU 594.A N PHE 590.A O no hydrogen 2.934 N/A VAL 595.A N ALA 591.A O no hydrogen 2.919 N/A ASP 596.A N ASN 592.A O no hydrogen 2.869 N/A VAL 597.A N THR 593.A O no hydrogen 2.936 N/A CYS 598.A N LEU 594.A O no hydrogen 2.910 N/A CYS 598.A SG GLY 563.A O no hydrogen 3.322 N/A SER 603.A N LYS 639.A O no hydrogen 3.033 N/A SER 603.A OG GLY 602.A O no hydrogen 2.757 N/A VAL 606.A N GLY 604.A O no hydrogen 2.976 N/A LYS 608.A NZ TYR 600.A OH no hydrogen 3.394 N/A VAL 609.A N ASN 605.A O no hydrogen 2.967 N/A GLN 610.A N VAL 606.A O no hydrogen 2.866 N/A GLN 611.A N LEU 607.A O no hydrogen 2.908 N/A LEU 612.A N LYS 608.A O no hydrogen 2.930 N/A LEU 613.A N VAL 609.A O no hydrogen 2.900 N/A HIS 614.A N GLN 610.A O no hydrogen 2.875 N/A HIS 614.A N GLN 611.A O no hydrogen 3.314 N/A ILE 615.A N GLN 611.A O no hydrogen 2.931 N/A CYS 616.A SG GLN 611.A O no hydrogen 3.770 N/A CYS 616.A SG LEU 612.A O no hydrogen 3.282 N/A GLU 618.A N HIS 614.A O no hydrogen 2.866 N/A HIS 619.A N ILE 615.A O no hydrogen 2.949 N/A PHE 620.A N SER 617.A O no hydrogen 3.340 N/A ASP 621.A N SER 617.A O no hydrogen 2.917 N/A LYS 625.A NZ GLU 626.A O no hydrogen 2.398 N/A LYS 629.A NZ PHE 620.A O no hydrogen 3.040 N/A LYS 629.A NZ LYS 625.A O no hydrogen 2.397 N/A LYS 632.A N ASP 628.A O no hydrogen 2.915 N/A LYS 632.A NZ CYS 616.A O no hydrogen 2.942 N/A GLU 633.A N LYS 629.A O no hydrogen 2.967 N/A LYS 634.A N ASP 630.A O no hydrogen 2.876 N/A LYS 635.A N LYS 631.A O no hydrogen 2.935 N/A LYS 637.A NZ GLY 651.A O no hydrogen 3.038 N/A LYS 639.A N ASP 638.A OD1 no hydrogen 2.712 N/A LYS 639.A NZ ASN 605.A OD1 no hydrogen 2.524 N/A LYS 640.A N LYS 637.A O no hydrogen 3.238 N/A LYS 640.A NZ SER 603.A O no hydrogen 3.507 N/A GLY 651.A N GLY 647.A O no hydrogen 2.922 N/A VAL 652.A N ALA 648.A O no hydrogen 2.897 N/A ALA 653.A N HIS 649.A O no hydrogen 2.925 N/A VAL 654.A N GLN 650.A O no hydrogen 2.933 N/A LEU 655.A N GLY 651.A O no hydrogen 2.883 N/A GLY 656.A N VAL 652.A O no hydrogen 2.891 N/A ILE 657.A N ALA 653.A O no hydrogen 2.918 N/A ALA 658.A N VAL 654.A O no hydrogen 2.898 N/A LEU 659.A N LEU 655.A O no hydrogen 3.204 N/A ILE 660.A N LEU 655.A O no hydrogen 3.397 N/A GLU 669.A N GLU 664.A O no hydrogen 2.848 N/A LEU 672.A N MET 670.A O no hydrogen 2.884 N/A ARG 673.A NH1 MET 670.A O no hydrogen 3.050 N/A THR 674.A OG1 GLU 633.A O no hydrogen 3.341 N/A THR 674.A OG1 LYS 634.A O no hydrogen 3.170 N/A HIS 677.A N ARG 673.A O no hydrogen 2.864 N/A LEU 678.A N THR 674.A O no hydrogen 2.983 N/A TYR 681.A OH GLU 683.A OE2 no hydrogen 2.741 N/A THR 685.A OG1 PRO 684.A O no hydrogen 2.635 N/A LEU 692.A N ARG 688.A O no hydrogen 2.939 N/A ALA 693.A N ALA 689.A O no hydrogen 2.912 N/A ALA 695.A N LEU 692.A O no hydrogen 3.338 N/A SER 698.A OG ASN 701.A OD1 no hydrogen 3.498 N/A VAL 699.A N ILE 697.A O no hydrogen 2.712 N/A ASN 705.A N ASN 701.A O no hydrogen 2.949 N/A ILE 706.A N PRO 702.A O no hydrogen 2.874 N/A LEU 707.A N ARG 703.A O no hydrogen 2.878 N/A ASP 708.A N LEU 704.A O no hydrogen 2.899 N/A THR 709.A OG1 ILE 706.A O no hydrogen 3.017 N/A LEU 710.A N ILE 706.A O no hydrogen 2.968 N/A SER 711.A N LEU 707.A O no hydrogen 2.822 N/A SER 711.A OG LEU 707.A O no hydrogen 3.545 N/A SER 711.A OG ASP 708.A O no hydrogen 3.079 N/A LYS 712.A N ASP 708.A O no hydrogen 2.887 N/A PHE 713.A N THR 709.A O no hydrogen 2.954 N/A SER 714.A OG LEU 710.A O no hydrogen 3.549 N/A HIS 715.A N SER 711.A O no hydrogen 2.854 N/A ASP 716.A N LYS 712.A O no hydrogen 2.924 N/A ASN 724.A ND2 ASP 716.A O no hydrogen 3.697 N/A PHE 727.A N TYR 723.A O no hydrogen 2.893 N/A ALA 728.A N ASN 724.A O no hydrogen 2.915 N/A MET 729.A N SER 725.A O no hydrogen 2.883 N/A GLY 730.A N ILE 726.A O no hydrogen 2.883 N/A MET 731.A N PHE 727.A O no hydrogen 2.934 N/A VAL 732.A N ALA 728.A O no hydrogen 2.927 N/A SER 734.A N VAL 732.A O no hydrogen 2.839 N/A ASN 737.A N GLY 735.A O no hydrogen 2.832 N/A ARG 740.A NH2 SER 367.A OG no hydrogen 2.386 N/A ALA 743.A N ARG 740.A O no hydrogen 3.207 N/A ARG 746.A N ALA 742.A O no hydrogen 2.957 N/A GLN 747.A N ALA 743.A O no hydrogen 2.983 N/A LEU 748.A N MET 744.A O no hydrogen 2.940 N/A ALA 749.A N LEU 745.A O no hydrogen 2.920 N/A GLN 750.A N ARG 746.A O no hydrogen 2.877 N/A GLN 750.A NE2 ALA 749.A O no hydrogen 3.329 N/A TYR 751.A N GLN 747.A O no hydrogen 2.968 N/A HIS 752.A ND1 LEU 748.A O no hydrogen 2.376 N/A ASN 757.A N ASP 755.A O no hydrogen 2.726 N/A ASN 758.A N ASP 718.A OD2 no hydrogen 3.037 N/A ARG 763.A NH1 LEU 768.A O no hydrogen 3.492 N/A GLN 766.A NE2 GLN 766.A O no hydrogen 3.050 N/A GLY 767.A N LEU 764.A O no hydrogen 2.703 N/A LEU 771.A N VAL 762.A O no hydrogen 3.188 N/A THR 775.A N LEU 771.A O no hydrogen 2.964 N/A THR 775.A OG1 GLU 641.A OE2 no hydrogen 3.502 N/A TYR 781.A N THR 777.A O no hydrogen 2.948 N/A TYR 781.A OH ARG 673.A O no hydrogen 2.340 N/A HIS 782.A N LEU 778.A O no hydrogen 3.328 N/A SER 783.A N PRO 780.A O no hydrogen 3.220 N/A ARG 785.A N HIS 782.A O no hydrogen 3.215 N/A SER 789.A OG MET 788.A O no hydrogen 2.626 N/A LEU 800.A N LEU 797.A O no hydrogen 3.166 N/A SER 802.A N VAL 799.A O no hydrogen 3.127 N/A SER 802.A OG VAL 799.A O no hydrogen 2.971 N/A ASP 805.A N PHE 803.A O no hydrogen 2.779 N/A GLY 812.A N GLU 878.A O no hydrogen 2.925 N/A LYS 813.A NZ VAL 852.A O no hydrogen 2.393 N/A SER 814.A N ALA 880.A O no hydrogen 3.301 N/A SER 814.A OG HIS 815.A O no hydrogen 3.087 N/A SER 814.A OG LEU 818.A O no hydrogen 2.754 N/A ARG 828.A NE THR 863.A OG1 no hydrogen 2.354 N/A GLU 835.A N ASP 834.A OD1 no hydrogen 2.705 N/A GLU 835.A N GLU 836.A OE1 no hydrogen 3.213 N/A ARG 838.A NH1 GLU 177.A OE1 no hydrogen 3.461 N/A ARG 845.A N SER 843.A OG no hydrogen 3.106 N/A GLN 848.A N VAL 846.A O no hydrogen 2.653 N/A THR 867.A OG1 GLN 866.A O no hydrogen 2.668 N/A THR 869.A OG1 HIS 868.A O no hydrogen 2.696 N/A LEU 882.A N SER 814.A O no hydrogen 2.531 N/A GLU 886.A N GLU 886.A OE1 no hydrogen 2.661 N/A