Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9mxv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N TYR 31.A O no hydrogen 2.822 N/A ILE 6.A N LYS 29.A O no hydrogen 2.782 N/A HIS 10.A ND1 PRO 8.A O no hydrogen 2.629 N/A TYR 11.A N MET 44.A O no hydrogen 3.290 N/A ILE 12.A N GLU 25.A O no hydrogen 3.238 N/A VAL 14.A N ARG 23.A O no hydrogen 3.261 N/A LEU 15.A N ARG 38.A O no hydrogen 2.783 N/A ASP 16.A N VAL 21.A O no hydrogen 3.281 N/A ASN 20.A N ASP 16.A O no hydrogen 2.698 N/A SER 22.A OG VAL 14.A O no hydrogen 3.343 N/A ARG 23.A N VAL 14.A O no hydrogen 3.354 N/A ARG 23.A NH2 GLU 25.A OE2 no hydrogen 3.433 N/A GLU 25.A N ILE 12.A O no hydrogen 2.933 N/A LYS 29.A N ILE 6.A O no hydrogen 3.309 N/A LYS 29.A NZ VAL 26.A O no hydrogen 3.227 N/A TYR 31.A N ILE 4.A O no hydrogen 2.543 N/A ARG 33.A N PHE 2.A O no hydrogen 2.963 N/A ARG 33.A NE GLU 1.A O no hydrogen 2.664 N/A ARG 33.A NH2 GLU 1.A O no hydrogen 3.403 N/A GLN 34.A N GLU 37.A OE1 no hydrogen 3.496 N/A ASP 35.A N ASP 35.A OD1 no hydrogen 2.513 N/A ASN 36.A ND2 ASN 18.A OD1 no hydrogen 3.407 N/A ARG 38.A N LEU 15.A O no hydrogen 3.086 N/A LEU 40.A N HIS 13.A O no hydrogen 2.718 N/A MET 44.A N TYR 11.A O no hydrogen 3.324 N/A HIS 53.A ND1 PRO 51.A O no hydrogen 2.503 N/A CYS 55.A N ARG 87.A O no hydrogen 3.065 N/A CYS 55.A SG ARG 87.A O no hydrogen 3.740 N/A THR 56.A N LYS 103.A O no hydrogen 3.383 N/A ASN 59.A N ASP 83.A O no hydrogen 2.734 N/A SER 62.A N ARG 78.A O no hydrogen 2.966 N/A SER 62.A OG ARG 63.A O no hydrogen 3.543 N/A ARG 63.A NH1 GLY 67.A O no hydrogen 3.022 N/A ASP 64.A N LEU 68.A O no hydrogen 3.080 N/A GLY 67.A N ASP 64.A O no hydrogen 2.897 N/A LEU 68.A N ASP 64.A OD1 no hydrogen 2.267 N/A ASP 72.A N GLN 76.A O no hydrogen 2.457 N/A GLY 75.A N ASP 72.A O no hydrogen 3.136 N/A VAL 77.A N GLN 76.A OE1 no hydrogen 3.382 N/A ARG 78.A N LEU 70.A O no hydrogen 2.755 N/A ARG 80.A N PRO 60.A O no hydrogen 2.883 N/A ALA 82.A N ASN 59.A OD1 no hydrogen 2.889 N/A LEU 84.A N ASP 83.A OD1 no hydrogen 2.505 N/A ARG 87.A N CYS 55.A O no hydrogen 3.191 N/A PHE 93.A N ASP 91.A O no hydrogen 2.649 N/A GLU 99.A N TYR 96.A O no hydrogen 3.252 N/A VAL 100.A N ALA 58.A O no hydrogen 3.233 N/A GLU 102.A N THR 56.A O no hydrogen 2.681 N/A LYS 103.A N THR 56.A O no hydrogen 3.119 N/A THR 106.A N TYR 54.A O no hydrogen 3.035 N/A LEU 108.A N ARG 52.A O no hydrogen 3.514 N/A VAL 111.A N GLY 145.A O no hydrogen 2.721 N/A THR 115.A OG1 ILE 159.A O no hydrogen 2.804 N/A ALA 116.A N ILE 159.A O no hydrogen 3.021 N/A LEU 117.A N PHE 141.A O no hydrogen 2.828 N/A HIS 118.A N GLU 157.A O no hydrogen 2.573 N/A LYS 120.A N GLU 154.A O no hydrogen 2.751 N/A ALA 121.A N ASP 137.A O no hydrogen 3.236 N/A LEU 122.A N GLU 152.A O no hydrogen 2.660 N/A LEU 123.A N GLU 152.A O no hydrogen 3.299 N/A PHE 125.A N VAL 133.A O no hydrogen 3.337 N/A ASP 127.A N ASP 131.A O no hydrogen 2.388 N/A LYS 128.A N ASP 127.A OD1 no hydrogen 2.455 N/A GLY 130.A N ASP 127.A O no hydrogen 3.259 N/A LYS 132.A N ASP 131.A OD1 no hydrogen 2.416 N/A VAL 133.A N PHE 125.A O no hydrogen 2.949 N/A GLY 136.A N ALA 121.A O no hydrogen 2.830 N/A ASP 137.A N VAL 134.A O no hydrogen 3.324 N/A TRP 139.A N LEU 119.A O no hydrogen 2.969 N/A PHE 141.A N LEU 117.A O no hydrogen 3.051 N/A LYS 151.A NZ ASP 83.A OD1 no hydrogen 2.431 N/A GLU 152.A N GLU 152.A OE1 no hydrogen 2.371 N/A GLU 154.A N LYS 120.A O no hydrogen 2.904 N/A VAL 156.A N HIS 118.A O no hydrogen 2.399 N/A GLU 157.A N HIS 118.A O no hydrogen 3.371 N/A ILE 159.A N ALA 116.A O no hydrogen 2.822 N/A ALA 161.A N ASN 114.A O no hydrogen 3.401 N/A THR 162.A N TYR 200.A O no hydrogen 2.969 N/A ILE 164.A N GLY 198.A O no hydrogen 2.894 N/A ARG 165.A N GLN 168.A OE1 no hydrogen 2.980 N/A ASN 167.A N GLN 166.A OE1 no hydrogen 3.294 N/A ALA 169.A N VAL 212.A O no hydrogen 2.891 N/A ARG 171.A NE GLU 191.A OE1 no hydrogen 3.280 N/A LEU 172.A N TRP 192.A O no hydrogen 2.780 N/A ARG 173.A N GLU 207.A O no hydrogen 3.167 N/A ARG 173.A NE GLU 207.A OE2 no hydrogen 3.323 N/A ARG 173.A NH1 GLU 191.A OE2 no hydrogen 2.639 N/A ALA 174.A N GLU 190.A O no hydrogen 3.197 N/A ARG 175.A N PHE 205.A O no hydrogen 2.634 N/A ARG 175.A NE GLU 207.A OE1 no hydrogen 3.184 N/A ARG 175.A NH2 GLU 207.A OE1 no hydrogen 3.173 N/A LYS 176.A NZ GLU 177.A O no hydrogen 3.099 N/A CYS 178.A N ARG 186.A O no hydrogen 3.367 N/A CYS 178.A SG TRP 179.A O no hydrogen 3.546 N/A ARG 181.A NH2 LEU 201.A O no hydrogen 2.562 N/A GLY 183.A N ASP 180.A O no hydrogen 2.667 N/A LYS 184.A N ASP 180.A OD1 no hydrogen 2.505 N/A LYS 184.A NZ ASP 180.A OD2 no hydrogen 3.413 N/A ARG 186.A N CYS 178.A O no hydrogen 3.463 N/A ARG 186.A NE ASP 180.A OD2 no hydrogen 3.211 N/A ARG 186.A NH1 GLU 190.A OE2 no hydrogen 2.871 N/A ARG 186.A NH2 ASP 180.A OD2 no hydrogen 3.464 N/A VAL 187.A N GLU 190.A OE1 no hydrogen 3.143 N/A GLU 190.A N VAL 187.A O no hydrogen 3.272 N/A TRP 192.A N LEU 172.A O no hydrogen 3.086 N/A GLY 198.A N ILE 164.A O no hydrogen 2.886 N/A TYR 200.A N THR 162.A O no hydrogen 2.828 N/A TYR 200.A OH GLU 206.A OE1 no hydrogen 2.814 N/A GLU 207.A N ARG 173.A O no hydrogen 3.241 N/A LEU 209.A N ARG 171.A O no hydrogen 3.160 N/A ALA 214.A N ASN 167.A O no hydrogen 3.117 N/A VAL 215.A N HIS 255.A O no hydrogen 2.546 N/A LEU 217.A N GLU 253.A O no hydrogen 2.897 N/A ALA 222.A N VAL 267.A O no hydrogen 3.180 N/A LEU 223.A N VAL 247.A O no hydrogen 3.094 N/A HIS 224.A N GLY 265.A O no hydrogen 2.886 N/A HIS 224.A NE2 GLU 244.A OE1 no hydrogen 2.883 N/A LEU 225.A N TRP 245.A O no hydrogen 3.196 N/A ARG 226.A N GLU 262.A O no hydrogen 2.846 N/A ARG 226.A NE GLU 244.A OE2 no hydrogen 3.478 N/A ARG 226.A NH1 GLU 262.A OE1 no hydrogen 3.538 N/A ARG 226.A NH2 GLU 244.A OE2 no hydrogen 3.469 N/A ALA 227.A N GLU 243.A O no hydrogen 3.286 N/A ARG 228.A N HIS 260.A O no hydrogen 2.935 N/A PHE 231.A N ARG 239.A O no hydrogen 2.953 N/A ARG 232.A NE GLY 236.A O no hydrogen 2.869 N/A ARG 232.A NH2 GLY 236.A O no hydrogen 2.719 N/A ASP 233.A N VAL 237.A O no hydrogen 3.279 N/A ARG 235.A NE ASP 233.A OD2 no hydrogen 3.155 N/A ARG 235.A NH2 ASP 233.A OD2 no hydrogen 2.613 N/A GLY 236.A N ASP 233.A O no hydrogen 2.745 N/A ARG 239.A N PHE 231.A O no hydrogen 2.941 N/A ARG 239.A NH1 SER 238.A O no hydrogen 3.503 N/A ARG 240.A NH1 SER 238.A OG no hydrogen 3.375 N/A THR 241.A N ASN 230.A OD1 no hydrogen 2.598 N/A THR 241.A OG1 ASN 230.A OD1 no hydrogen 2.906 N/A GLY 242.A N ALA 227.A O no hydrogen 3.226 N/A TRP 245.A N LEU 225.A O no hydrogen 3.244 N/A VAL 247.A N LEU 223.A O no hydrogen 3.026 N/A THR 248.A N ASP 251.A OD2 no hydrogen 3.177 N/A THR 248.A OG1 GLN 250.A OE1 no hydrogen 3.386 N/A ASP 251.A N THR 248.A O no hydrogen 2.905 N/A THR 252.A N THR 248.A O no hydrogen 3.374 N/A THR 252.A OG1 ALA 254.A O no hydrogen 2.757 N/A ALA 254.A N THR 252.A OG1 no hydrogen 3.348 N/A HIS 255.A N VAL 215.A O no hydrogen 2.988 N/A HIS 255.A NE2 GLU 261.A OE1 no hydrogen 3.196 N/A VAL 259.A N ASP 258.A OD1 no hydrogen 2.368 N/A GLU 262.A N ARG 226.A O no hydrogen 2.664 N/A LEU 264.A N HIS 224.A O no hydrogen 2.761 N/A VAL 267.A N ALA 222.A O no hydrogen 2.945 N/A THR 270.A N PHE 304.A O no hydrogen 2.980 N/A THR 271.A OG1 SER 303.A OG no hydrogen 3.051 N/A LEU 272.A N LYS 302.A O no hydrogen 2.568 N/A ASN 276.A N GLY 273.A O no hydrogen 2.807 N/A TYR 277.A N GLN 317.A O no hydrogen 3.066 N/A CYS 278.A N VAL 298.A O no hydrogen 2.844 N/A CYS 278.A SG VAL 298.A O no hydrogen 3.667 N/A ILE 280.A N ARG 296.A O no hydrogen 2.737 N/A LEU 281.A N GLN 311.A O no hydrogen 2.562 N/A ASP 282.A N GLN 294.A O no hydrogen 3.121 N/A VAL 284.A N GLU 310.A OE2 no hydrogen 2.879 N/A GLY 285.A N LYS 289.A O no hydrogen 2.795 N/A GLY 288.A N GLY 285.A O no hydrogen 3.271 N/A LYS 289.A N ASP 287.A OD1 no hydrogen 3.179 N/A ASN 290.A ND2 ASP 282.A O no hydrogen 2.978 N/A ASN 290.A ND2 PRO 308.A O no hydrogen 3.287 N/A GLN 291.A N PRO 283.A O no hydrogen 2.631 N/A GLY 293.A N ASP 282.A OD1 no hydrogen 2.788 N/A GLN 294.A N GLN 291.A O no hydrogen 3.404 N/A ARG 296.A N ILE 280.A O no hydrogen 3.015 N/A VAL 298.A N CYS 278.A O no hydrogen 2.936 N/A GLU 301.A N GLU 301.A OE1 no hydrogen 2.546 N/A LYS 302.A N LEU 272.A O no hydrogen 2.633 N/A SER 303.A OG THR 271.A OG1 no hydrogen 3.051 N/A PHE 304.A N THR 270.A O no hydrogen 3.113 N/A GLU 313.A N VAL 279.A O no hydrogen 3.059 N/A GLN 317.A N TYR 277.A O no hydrogen 2.893 N/A VAL 319.A N HIS 275.A O no hydrogen 3.068 N/A TYR 320.A N TYR 361.A O no hydrogen 2.917 N/A LEU 322.A N LEU 359.A O no hydrogen 2.765 N/A SER 323.A N GLN 326.A OE1 no hydrogen 3.367 N/A GLY 327.A N ARG 373.A O no hydrogen 2.851 N/A LEU 328.A N ILE 355.A O no hydrogen 2.893 N/A LEU 329.A N GLU 371.A O no hydrogen 3.125 N/A LEU 330.A N TRP 353.A O no hydrogen 2.788 N/A ARG 331.A N GLU 368.A O no hydrogen 2.837 N/A ARG 331.A NE GLU 368.A OE1 no hydrogen 2.896 N/A ARG 331.A NH2 GLU 368.A OE1 no hydrogen 2.397 N/A ALA 332.A N ASP 351.A O no hydrogen 3.227 N/A LEU 333.A N LYS 366.A O no hydrogen 3.162 N/A LEU 336.A N HIS 347.A O no hydrogen 3.243 N/A GLU 338.A N VAL 345.A O no hydrogen 3.251 N/A GLU 342.A N GLU 342.A OE1 no hydrogen 2.725 N/A LYS 344.A NZ GLU 337.A O no hydrogen 2.371 N/A HIS 347.A N LEU 336.A O no hydrogen 3.044 N/A GLN 348.A N ASP 351.A OD2 no hydrogen 2.764 N/A ASP 351.A N GLN 348.A O no hydrogen 3.141 N/A TRP 353.A N LEU 330.A O no hydrogen 3.076 N/A ILE 355.A N LEU 328.A O no hydrogen 2.806 N/A ARG 356.A NE GLU 324.A O no hydrogen 3.004 N/A ARG 356.A NH2 GLU 324.A O no hydrogen 3.115 N/A LEU 359.A N LEU 322.A O no hydrogen 3.143 N/A TYR 361.A N TYR 320.A O no hydrogen 2.669 N/A GLU 368.A N ARG 331.A O no hydrogen 2.832 N/A VAL 370.A N LEU 329.A O no hydrogen 3.008 N/A ARG 373.A N GLY 327.A O no hydrogen 2.731 N/A ALA 375.A N GLN 325.A O no hydrogen 3.140 N/A ILE 376.A N TYR 402.A O no hydrogen 2.573 N/A ASP 379.A N GLU 382.A OE1 no hydrogen 3.140 N/A ILE 384.A N VAL 397.A O no hydrogen 3.179 N/A TYR 385.A N THR 441.A O no hydrogen 3.170 N/A TYR 385.A OH LEU 475.A O no hydrogen 2.657 N/A VAL 386.A N ARG 395.A O no hydrogen 2.969 N/A GLN 387.A N VAL 409.A O no hydrogen 2.729 N/A GLN 387.A NE2 GLY 392.A O no hydrogen 2.755 N/A ASP 388.A N LYS 393.A O no hydrogen 2.844 N/A VAL 389.A N ASP 407.A O no hydrogen 3.237 N/A LYS 390.A N ASP 388.A OD1 no hydrogen 3.399 N/A GLY 392.A N ASP 388.A O no hydrogen 2.535 N/A ARG 395.A N VAL 386.A O no hydrogen 3.005 N/A ARG 395.A NH1 GLU 408.A OE2 no hydrogen 2.950 N/A ARG 395.A NH2 GLU 408.A OE2 no hydrogen 3.443 N/A VAL 397.A N ILE 384.A O no hydrogen 3.029 N/A GLY 399.A N GLU 382.A O no hydrogen 2.849 N/A THR 401.A OG1 ILE 376.A O no hydrogen 3.313 N/A TYR 402.A N ILE 376.A O no hydrogen 2.824 N/A TYR 402.A OH GLU 408.A OE1 no hydrogen 2.404 N/A GLN 406.A N THR 405.A OG1 no hydrogen 2.714 N/A VAL 409.A N GLN 387.A O no hydrogen 2.904 N/A TRP 411.A N TYR 385.A O no hydrogen 2.825 N/A LYS 413.A N LYS 440.A O no hydrogen 3.083 N/A LYS 413.A NZ GLY 476.A O no hydrogen 3.525 N/A LYS 413.A NZ PRO 477.A O no hydrogen 2.998 N/A LYS 413.A NZ GLU 479.A O no hydrogen 3.183 N/A VAL 419.A N PRO 416.A O no hydrogen 2.953 N/A GLU 421.A N GLU 421.A OE1 no hydrogen 2.224 N/A LEU 423.A N VAL 419.A O no hydrogen 3.074 N/A ASN 424.A N GLU 420.A O no hydrogen 3.028 N/A GLY 426.A N GLU 421.A O no hydrogen 2.677 N/A GLN 427.A N LEU 422.A O no hydrogen 2.855 N/A ARG 438.A NE GLU 420.A OE2 no hydrogen 3.259 N/A ARG 438.A NH2 LYS 413.A O no hydrogen 2.657 N/A VAL 443.A N GLY 383.A O no hydrogen 3.237 N/A VAL 444.A N TYR 385.A OH no hydrogen 3.107 N/A SER 445.A OG SER 474.A OG no hydrogen 2.745 N/A TYR 446.A N VAL 473.A O no hydrogen 2.665 N/A TYR 446.A OH GLN 427.A O no hydrogen 2.989 N/A VAL 448.A N GLU 471.A O no hydrogen 2.576 N/A ALA 453.A N LEU 502.A O no hydrogen 2.934 N/A VAL 454.A N VAL 467.A O no hydrogen 3.248 N/A VAL 456.A N ARG 465.A O no hydrogen 3.192 N/A TYR 457.A N GLN 480.A O no hydrogen 3.166 N/A ASP 458.A N ARG 463.A O no hydrogen 2.959 N/A ARG 460.A N ASP 458.A OD1 no hydrogen 3.235 N/A ARG 460.A NH1 VAL 394.A O no hydrogen 2.852 N/A GLU 461.A N ASP 458.A OD1 no hydrogen 3.430 N/A LYS 462.A NZ TYR 459.A O no hydrogen 2.434 N/A ARG 463.A N ASP 458.A O no hydrogen 3.291 N/A ARG 465.A N VAL 456.A O no hydrogen 3.246 N/A ARG 465.A NE GLU 479.A OE2 no hydrogen 3.234 N/A ARG 465.A NH2 SER 474.A O no hydrogen 3.226 N/A ARG 465.A NH2 GLU 479.A OE1 no hydrogen 2.448 N/A ARG 465.A NH2 GLU 479.A OE2 no hydrogen 3.017 N/A VAL 467.A N VAL 454.A O no hydrogen 3.302 N/A GLY 469.A N ALA 452.A O no hydrogen 2.868 N/A VAL 473.A N TYR 446.A O no hydrogen 2.609 N/A SER 474.A OG SER 445.A OG no hydrogen 2.745 N/A LEU 475.A N VAL 444.A O no hydrogen 2.664 N/A GLY 476.A N GLU 479.A OE1 no hydrogen 3.184 N/A GLN 480.A N TYR 457.A O no hydrogen 2.975 N/A THR 482.A N GLN 455.A O no hydrogen 2.939 N/A THR 482.A OG1 GLN 455.A O no hydrogen 3.380 N/A THR 482.A OG1 GLN 455.A OE1 no hydrogen 3.216 N/A LEU 484.A N ALA 499.A O no hydrogen 2.787 N/A SER 485.A OG HIS 495.A ND1 no hydrogen 2.933 N/A LEU 486.A N ARG 497.A O no hydrogen 2.871 N/A SER 487.A N ASP 552.A OD1 no hydrogen 3.069 N/A SER 487.A OG ASP 552.A OD2 no hydrogen 2.380 N/A ALA 488.A N ARG 493.A O no hydrogen 3.168 N/A ARG 493.A N ALA 488.A O no hydrogen 3.095 N/A HIS 495.A ND1 SER 485.A OG no hydrogen 2.933 N/A ALA 496.A N LEU 486.A O no hydrogen 3.022 N/A ARG 497.A N LEU 486.A O no hydrogen 3.139 N/A ALA 499.A N LEU 484.A O no hydrogen 2.882 N/A CYS 501.A SG TYR 446.A OH no hydrogen 3.717 N/A LEU 502.A N ALA 453.A O no hydrogen 2.533 N/A LEU 504.A N ASN 451.A O no hydrogen 3.123 N/A ASP 507.A N TRP 531.A O no hydrogen 3.320 N/A PHE 508.A N ASP 507.A OD1 no hydrogen 2.650 N/A PHE 509.A N TYR 529.A O no hydrogen 3.199 N/A ASP 511.A N LEU 527.A O no hydrogen 2.832 N/A ILE 513.A N LEU 525.A O no hydrogen 2.933 N/A ILE 515.A N LEU 523.A O no hydrogen 2.964 N/A THR 517.A N ALA 521.A O no hydrogen 3.404 N/A THR 517.A OG1 ALA 521.A O no hydrogen 3.326 N/A ALA 518.A N VAL 572.A O no hydrogen 2.874 N/A HIS 520.A N THR 517.A O no hydrogen 2.807 N/A ALA 521.A N THR 517.A OG1 no hydrogen 3.011 N/A LEU 523.A N ILE 515.A O no hydrogen 3.176 N/A GLN 524.A N GLU 614.A O no hydrogen 2.619 N/A LEU 525.A N ILE 513.A O no hydrogen 3.025 N/A GLN 526.A N SER 612.A O no hydrogen 3.018 N/A LEU 527.A N ASP 511.A O no hydrogen 2.860 N/A ALA 528.A N ASP 609.A O no hydrogen 3.029 N/A TYR 529.A N PHE 509.A O no hydrogen 2.752 N/A ASN 530.A N SER 607.A O no hydrogen 3.098 N/A TRP 531.A N ASP 507.A O no hydrogen 3.083 N/A HIS 532.A N VAL 604.A O no hydrogen 3.344 N/A HIS 532.A NE2 GLU 534.A OE2 no hydrogen 2.351 N/A PHE 533.A N LEU 504.A O no hydrogen 3.362 N/A ASN 536.A N GLU 543.A OE2 no hydrogen 2.756 N/A ASP 537.A N GLU 543.A OE1 no hydrogen 3.123 N/A LYS 539.A N ASP 537.A OD1 no hydrogen 3.014 N/A GLN 542.A N ASP 540.A OD1 no hydrogen 3.214 N/A THR 544.A N ASP 540.A O no hydrogen 3.035 N/A THR 544.A OG1 ARG 538.A O no hydrogen 3.522 N/A THR 544.A OG1 ASP 540.A O no hydrogen 2.555 N/A LYS 546.A N GLU 543.A O no hydrogen 2.902 N/A PHE 548.A N ALA 545.A O no hydrogen 2.995 N/A SER 549.A N LYS 546.A O no hydrogen 3.065 N/A SER 549.A OG LYS 546.A O no hydrogen 3.198 N/A GLY 555.A N ASP 552.A OD1 no hydrogen 3.498 N/A ASP 556.A N ASP 552.A O no hydrogen 3.105 N/A ALA 557.A N PHE 553.A O no hydrogen 3.477 N/A CYS 558.A N VAL 554.A O no hydrogen 3.015 N/A CYS 558.A SG VAL 554.A O no hydrogen 3.290 N/A LYS 559.A N GLY 555.A O no hydrogen 3.119 N/A LYS 559.A NZ ASP 556.A O no hydrogen 3.457 N/A ALA 560.A N ASP 556.A O no hydrogen 3.070 N/A ILE 561.A N ALA 557.A O no hydrogen 3.098 N/A ILE 561.A N CYS 558.A O no hydrogen 3.130 N/A ALA 562.A N CYS 558.A O no hydrogen 2.641 N/A SER 563.A N LYS 559.A O no hydrogen 3.160 N/A SER 563.A OG LYS 559.A O no hydrogen 3.479 N/A SER 563.A OG ALA 560.A O no hydrogen 3.184 N/A VAL 565.A N ILE 561.A O no hydrogen 3.099 N/A ARG 566.A N ALA 562.A O no hydrogen 3.335 N/A GLY 567.A N SER 563.A O no hydrogen 3.145 N/A SER 571.A OG ALA 568.A O no hydrogen 2.613 N/A VAL 572.A N VAL 569.A O no hydrogen 3.284 N/A THR 573.A OG1 ASP 519.A OD2 no hydrogen 2.204 N/A PHE 574.A N ASP 519.A OD2 no hydrogen 3.022 N/A PHE 577.A N THR 573.A O no hydrogen 2.986 N/A PHE 577.A N PHE 574.A O no hydrogen 2.781 N/A HIS 578.A N PHE 574.A O no hydrogen 2.639 N/A ASN 580.A N ASP 576.A O no hydrogen 2.999 N/A ASN 580.A ND2 ASP 576.A O no hydrogen 3.670 N/A ASN 580.A ND2 ASP 576.A OD1 no hydrogen 2.961 N/A ARG 583.A NH1 ASN 580.A OD1 no hydrogen 3.477 N/A ILE 584.A N ASN 580.A O no hydrogen 2.914 N/A ILE 585.A N SER 581.A O no hydrogen 3.154 N/A ARG 586.A N ALA 582.A O no hydrogen 3.250 N/A THR 587.A N ARG 583.A O no hydrogen 3.253 N/A THR 587.A N ILE 584.A O no hydrogen 3.126 N/A THR 587.A OG1 ARG 583.A O no hydrogen 3.367 N/A THR 587.A OG1 ILE 584.A O no hydrogen 2.947 N/A ALA 588.A N ILE 584.A O no hydrogen 3.047 N/A VAL 589.A N ILE 585.A O no hydrogen 3.204 N/A PHE 590.A N ARG 586.A O no hydrogen 2.981 N/A ALA 596.A N VAL 605.A O no hydrogen 3.093 N/A PHE 598.A N LEU 603.A O no hydrogen 2.977 N/A GLY 602.A N PHE 598.A O no hydrogen 2.923 N/A LEU 603.A N ASN 601.A OD1 no hydrogen 3.160 N/A VAL 604.A N HIS 532.A O no hydrogen 3.011 N/A VAL 605.A N ALA 596.A O no hydrogen 2.924 N/A SER 606.A N ASN 530.A O no hydrogen 2.775 N/A ASP 609.A N ALA 528.A O no hydrogen 3.073 N/A GLN 611.A N GLN 526.A O no hydrogen 2.748 N/A GLU 614.A N GLN 524.A O no hydrogen 2.985 N/A VAL 616.A N ARG 522.A O no hydrogen 2.947 N/A ARG 619.A N ASP 617.A OD1 no hydrogen 3.366 N/A ARG 619.A NH2 ASP 617.A OD2 no hydrogen 3.532 N/A ARG 621.A NE ARG 621.A O no hydrogen 3.280 N/A ASP 622.A N GLN 618.A O no hydrogen 2.914 N/A ALA 623.A N ARG 619.A O no hydrogen 3.235 N/A LEU 624.A N THR 620.A O no hydrogen 3.017 N/A GLN 625.A N ASP 622.A O no hydrogen 2.695 N/A ARG 626.A N ASP 622.A O no hydrogen 3.109 N/A ARG 626.A NE ASP 622.A O no hydrogen 3.051 N/A VAL 628.A N GLN 625.A O no hydrogen 3.221 N/A GLN 629.A N GLN 625.A O no hydrogen 3.477 N/A LEU 630.A N ARG 626.A O no hydrogen 3.468 N/A ALA 631.A N SER 627.A O no hydrogen 3.448 N/A ILE 632.A N VAL 628.A O no hydrogen 2.995 N/A GLU 633.A N GLN 629.A O no hydrogen 3.367 N/A ILE 634.A N LEU 630.A O no hydrogen 3.030 N/A THR 635.A N ILE 632.A O no hydrogen 2.898 N/A THR 635.A OG1 ILE 632.A O no hydrogen 2.709 N/A THR 636.A N ILE 632.A O no hydrogen 3.149 N/A THR 636.A OG1 GLU 633.A O no hydrogen 3.139 N/A THR 636.A OG1 GLU 633.A OE1 no hydrogen 3.272 N/A ASN 637.A N GLU 633.A O no hydrogen 3.122 N/A SER 638.A N THR 635.A O no hydrogen 3.368 N/A GLN 639.A N THR 635.A O no hydrogen 3.364 N/A GLU 640.A N THR 636.A O no hydrogen 3.363 N/A ALA 641.A N ASN 637.A O no hydrogen 3.102 N/A ALA 642.A N SER 638.A O no hydrogen 2.997 N/A ALA 643.A N GLN 639.A O no hydrogen 2.782 N/A LYS 644.A N GLU 640.A O no hydrogen 3.379 N/A HIS 645.A N ALA 641.A O no hydrogen 3.348 N/A GLU 646.A N ALA 643.A O no hydrogen 2.980 N/A ALA 647.A N ALA 643.A O no hydrogen 2.837 N/A GLN 648.A N LYS 644.A O no hydrogen 3.008 N/A ARG 649.A N GLU 646.A O no hydrogen 3.250 N/A ARG 649.A NH2 GLU 646.A OE2 no hydrogen 2.305 N/A LEU 650.A N GLU 646.A O no hydrogen 3.192 N/A GLU 651.A N ALA 647.A O no hydrogen 3.053 N/A GLN 652.A N ARG 649.A O no hydrogen 3.345 N/A GLU 653.A N ARG 649.A O no hydrogen 3.216 N/A GLU 653.A N LEU 650.A O no hydrogen 2.722 N/A ALA 654.A N LEU 650.A O no hydrogen 3.074 N/A ARG 655.A N GLU 651.A O no hydrogen 3.405 N/A GLY 656.A N GLN 652.A O no hydrogen 2.943 N/A ARG 657.A N ALA 654.A O no hydrogen 2.692 N/A LEU 658.A N ALA 654.A O no hydrogen 2.695 N/A GLU 659.A N ARG 655.A O no hydrogen 3.078 N/A GLN 661.A N ARG 657.A O no hydrogen 2.687 N/A GLN 661.A NE2 ASP 665.A OD1 no hydrogen 3.281 N/A LYS 662.A N LEU 658.A O no hydrogen 3.298 N/A LEU 664.A N ARG 660.A O no hydrogen 3.153 N/A ASP 665.A N GLN 661.A O no hydrogen 3.013 N/A GLN 666.A N LYS 662.A O no hydrogen 3.176 N/A SER 667.A N ILE 663.A O no hydrogen 3.295 N/A SER 667.A OG LEU 664.A O no hydrogen 2.697 N/A GLU 668.A N ASP 665.A O no hydrogen 2.652 N/A ALA 669.A N ASP 665.A O no hydrogen 2.846 N/A LYS 671.A N SER 667.A O no hydrogen 3.298 N/A LYS 671.A NZ GLU 668.A OE2 no hydrogen 2.944 N/A ARG 673.A NH1 GLU 670.A OE1 no hydrogen 2.784 N/A LYS 674.A N GLU 670.A O no hydrogen 3.064 N/A GLU 675.A N ALA 672.A O no hydrogen 2.754 N/A LEU 676.A N ALA 672.A O no hydrogen 3.030 N/A LEU 677.A N ARG 673.A O no hydrogen 3.144 N/A GLU 678.A N LYS 674.A O no hydrogen 3.105 N/A LEU 679.A N GLU 675.A O no hydrogen 3.234 N/A GLU 680.A N LEU 676.A O no hydrogen 3.277 N/A SER 683.A N LEU 679.A O no hydrogen 3.069 N/A MET 684.A N GLU 680.A O no hydrogen 2.943 N/A ALA 685.A N ALA 681.A O no hydrogen 3.257 N/A VAL 686.A N LEU 682.A O no hydrogen 3.337 N/A GLU 687.A N SER 683.A O no hydrogen 3.216 N/A SER 688.A N ALA 685.A O no hydrogen 3.261 N/A SER 688.A OG MET 684.A O no hydrogen 3.207 N/A THR 689.A N ALA 685.A O no hydrogen 2.838 N/A GLY 690.A N VAL 686.A O no hydrogen 2.919 N/A THR 691.A OG1 GLU 687.A O no hydrogen 2.459 N/A ALA 692.A N SER 688.A O no hydrogen 3.092 N/A LYS 693.A N THR 689.A O no hydrogen 2.998 N/A LYS 693.A NZ GLU 697.A OE2 no hydrogen 3.531 N/A ALA 694.A N GLY 690.A O no hydrogen 3.153 N/A GLU 695.A N THR 691.A O no hydrogen 3.228 N/A ALA 696.A N ALA 692.A O no hydrogen 3.281 N/A GLU 697.A N LYS 693.A O no hydrogen 3.200 N/A SER 698.A N ALA 694.A O no hydrogen 3.267 N/A SER 698.A OG ALA 694.A O no hydrogen 3.570 N/A SER 698.A OG GLU 695.A O no hydrogen 2.971 N/A ARG 699.A NH2 GLU 695.A OE2 no hydrogen 2.759 N/A ALA 700.A N ALA 696.A O no hydrogen 3.162 N/A GLU 701.A N GLU 697.A O no hydrogen 3.241 N/A GLU 701.A N SER 698.A O no hydrogen 3.277 N/A ALA 702.A N SER 698.A O no hydrogen 3.175 N/A ALA 703.A N ARG 699.A O no hydrogen 3.220 N/A ARG 704.A N ALA 700.A O no hydrogen 3.185 N/A ARG 704.A N GLU 701.A O no hydrogen 3.151 N/A ARG 704.A NH1 GLU 708.A OE2 no hydrogen 2.989 N/A ARG 704.A NH2 GLU 701.A OE2 no hydrogen 2.242 N/A ILE 705.A N GLU 701.A O no hydrogen 3.141 N/A GLU 706.A N ALA 702.A O no hydrogen 3.126 N/A GLY 707.A N ALA 703.A O no hydrogen 3.081 N/A GLU 708.A N ARG 704.A O no hydrogen 2.875 N/A GLY 709.A N ILE 705.A O no hydrogen 2.986 N/A SER 710.A N GLU 706.A O no hydrogen 2.971 N/A SER 710.A OG GLU 706.A O no hydrogen 2.727 N/A GLN 713.A N GLY 709.A O no hydrogen 2.619 N/A ALA 714.A N SER 710.A O no hydrogen 2.814 N/A LYS 715.A N LEU 712.A O no hydrogen 2.741 N/A LEU 716.A N LEU 712.A O no hydrogen 3.002 N/A LYS 717.A N GLN 713.A O no hydrogen 3.154 N/A ALA 718.A N LYS 715.A O no hydrogen 3.171 N/A GLN 719.A N LYS 715.A O no hydrogen 3.300 N/A ALA 720.A N LEU 716.A O no hydrogen 3.273 N/A LEU 721.A N LYS 717.A O no hydrogen 3.279 N/A ALA 722.A N ALA 718.A O no hydrogen 3.049 N/A ALA 722.A N GLN 719.A O no hydrogen 3.044 N/A ILE 723.A N GLN 719.A O no hydrogen 2.995 N/A GLU 724.A N ALA 720.A O no hydrogen 3.148 N/A THR 725.A N LEU 721.A O no hydrogen 3.179 N/A THR 725.A OG1 LEU 721.A O no hydrogen 2.409 N/A GLU 726.A N ALA 722.A O no hydrogen 2.892 N/A ALA 727.A N ILE 723.A O no hydrogen 3.031 N/A GLU 728.A N GLU 724.A O no hydrogen 3.148 N/A LEU 729.A N THR 725.A O no hydrogen 3.069 N/A GLN 730.A N GLU 726.A O no hydrogen 3.090 N/A ARG 731.A N ALA 727.A O no hydrogen 3.238 N/A VAL 732.A N GLU 728.A O no hydrogen 2.904 N/A GLN 733.A N LEU 729.A O no hydrogen 2.972 N/A LYS 734.A N GLN 730.A O no hydrogen 3.095 N/A VAL 735.A N ARG 731.A O no hydrogen 2.714 N/A ARG 736.A N VAL 732.A O no hydrogen 2.975 N/A GLU 737.A N GLN 733.A O no hydrogen 3.048 N/A GLU 739.A N VAL 735.A O no hydrogen 2.924 N/A LEU 740.A N ARG 736.A O no hydrogen 3.041 N/A VAL 741.A N LEU 738.A O no hydrogen 3.221 N/A ALA 743.A N GLU 739.A O no hydrogen 2.983 N/A ARG 744.A N LEU 740.A O no hydrogen 3.234 N/A ALA 745.A N VAL 741.A O no hydrogen 3.194 N/A GLN 746.A N TYR 742.A O no hydrogen 3.169 N/A LEU 747.A N ARG 744.A O no hydrogen 3.274 N/A GLU 748.A N ARG 744.A O no hydrogen 3.318 N/A LEU 749.A N ALA 745.A O no hydrogen 3.369 N/A GLU 750.A N GLN 746.A O no hydrogen 2.876 N/A VAL 751.A N LEU 747.A O no hydrogen 2.703 N/A SER 752.A N GLU 748.A O no hydrogen 2.760 N/A LYS 753.A N LEU 749.A O no hydrogen 3.140 N/A ALA 754.A N GLU 750.A O no hydrogen 3.115 N/A GLN 755.A N VAL 751.A O no hydrogen 3.188 N/A GLN 756.A N SER 752.A O no hydrogen 3.281 N/A GLN 756.A N LYS 753.A O no hydrogen 3.035 N/A LEU 757.A N LYS 753.A O no hydrogen 2.876 N/A ALA 758.A N ALA 754.A O no hydrogen 3.276 N/A GLU 761.A N LEU 757.A O no hydrogen 3.269 N/A VAL 762.A N ALA 758.A O no hydrogen 3.190 N/A LYS 763.A N GLU 759.A O no hydrogen 2.877 N/A LYS 764.A N VAL 760.A O no hydrogen 3.227 N/A PHE 765.A N GLU 761.A O no hydrogen 3.007 N/A LYS 766.A N VAL 762.A O no hydrogen 2.689 N/A GLN 767.A N LYS 763.A O no hydrogen 2.913 N/A GLU 770.A N LYS 766.A O no hydrogen 3.443 N/A ALA 771.A N GLN 767.A O no hydrogen 3.362 N/A GLY 773.A N THR 769.A O no hydrogen 3.048 N/A THR 776.A N GLY 773.A O no hydrogen 3.150 N/A ILE 777.A N GLY 773.A O no hydrogen 3.381 N/A ASP 779.A N THR 776.A O no hydrogen 2.819 N/A