Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kfx_L.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N GLY 2.A O no hydrogen 2.770 N/A LYS 6.A NZ ASP 10.A OD2 no hydrogen 3.205 N/A LEU 7.A N ALA 4.A O no hydrogen 3.298 N/A ALA 8.A N ALA 5.A O no hydrogen 2.745 N/A LYS 9.A N ALA 5.A O no hydrogen 3.048 N/A LYS 9.A NZ GLU 147.A OE1 no hydrogen 3.339 N/A GLU 12.A N ALA 8.A O no hydrogen 3.387 N/A ALA 13.A N LYS 9.A O no hydrogen 2.656 N/A ALA 14.A N ASP 10.A O no hydrogen 2.781 N/A GLU 15.A N GLU 12.A O no hydrogen 3.136 N/A GLY 16.A N GLU 12.A O no hydrogen 3.262 N/A GLY 18.A N ARG 22.A O no hydrogen 2.465 N/A SER 19.A N GLY 16.A O no hydrogen 3.212 N/A SER 19.A OG GLY 16.A O no hydrogen 3.306 N/A SER 19.A OG GLU 21.A OE2 no hydrogen 3.326 N/A ILE 24.A N TRP 148.A O no hydrogen 2.780 N/A ASN 28.A N LYS 25.A O no hydrogen 2.686 N/A GLN 29.A NE2 VAL 152.A O no hydrogen 3.629 N/A ALA 33.A N ASP 30.A OD2 no hydrogen 3.113 N/A LEU 34.A N ASP 30.A O no hydrogen 2.823 N/A ARG 35.A N TYR 31.A O no hydrogen 2.554 N/A ASN 36.A N GLU 32.A O no hydrogen 2.676 N/A GLU 37.A N ALA 33.A O no hydrogen 2.595 N/A CYS 38.A SG THR 43.A O no hydrogen 3.566 N/A LEU 39.A N ARG 35.A O no hydrogen 3.153 N/A LEU 39.A N ASN 36.A O no hydrogen 3.275 N/A GLU 40.A N ASN 36.A O no hydrogen 3.382 N/A GLY 42.A N LEU 39.A O no hydrogen 2.891 N/A THR 43.A N CYS 38.A O no hydrogen 2.864 N/A PHE 45.A N ALA 135.A O no hydrogen 2.749 N/A ASP 47.A N ASP 154.A OD1 no hydrogen 3.392 N/A SER 49.A OG GLN 29.A OE1 no hydrogen 2.620 N/A LEU 57.A N PRO 54.A O no hydrogen 2.699 N/A GLY 58.A N PRO 54.A O no hydrogen 3.263 N/A PHE 59.A N GLU 192.A OE2 no hydrogen 2.855 N/A LEU 62.A N GLU 192.A OE2 no hydrogen 3.313 N/A SER 66.A N PRO 64.A O no hydrogen 2.278 N/A SER 66.A OG GLU 61.A O no hydrogen 3.157 N/A LYS 68.A N SER 66.A OG no hydrogen 3.174 N/A THR 69.A OG1 GLY 63.A O no hydrogen 3.114 N/A THR 69.A OG1 SER 66.A O no hydrogen 3.339 N/A ARG 70.A N SER 67.A O no hydrogen 2.961 N/A ARG 73.A N THR 159.A O no hydrogen 3.236 N/A LYS 75.A N LEU 157.A O no hydrogen 3.079 N/A ARG 76.A NH2 PHE 45.A O no hydrogen 2.866 N/A ILE 80.A N PRO 77.A O no hydrogen 2.527 N/A CYS 81.A SG ALA 82.A O no hydrogen 3.890 N/A GLN 85.A N SER 173.A O no hydrogen 2.816 N/A GLN 85.A NE2 ASP 83.A O no hydrogen 3.253 N/A ILE 88.A N GLU 174.A OE2 no hydrogen 2.567 N/A ILE 96.A N THR 94.A OG1 no hydrogen 3.404 N/A CYS 97.A N HIS 168.A O no hydrogen 2.655 N/A CYS 97.A SG HIS 168.A ND1 no hydrogen 2.976 N/A CYS 97.A SG HIS 168.A O no hydrogen 3.109 N/A GLY 99.A N PHE 166.A O no hydrogen 2.707 N/A GLY 102.A N LEU 165.A O no hydrogen 2.776 N/A CYS 104.A SG ASP 103.A OD2 no hydrogen 3.342 N/A TRP 105.A N ASP 103.A OD2 no hydrogen 3.180 N/A TRP 105.A NE1 LEU 194.A O no hydrogen 3.017 N/A ALA 109.A N TRP 105.A O no hydrogen 3.147 N/A ILE 110.A N LEU 106.A O no hydrogen 2.639 N/A ALA 111.A N LEU 107.A O no hydrogen 3.125 N/A SER 112.A N ALA 108.A O no hydrogen 3.195 N/A SER 112.A OG ALA 108.A O no hydrogen 2.886 N/A THR 114.A N ILE 110.A O no hydrogen 3.141 N/A THR 114.A OG1 ILE 110.A O no hydrogen 3.113 N/A THR 114.A OG1 ALA 111.A O no hydrogen 2.762 N/A LEU 115.A N ALA 111.A O no hydrogen 3.210 N/A ASN 116.A N LEU 113.A O no hydrogen 3.035 N/A ILE 119.A N ASN 116.A O no hydrogen 3.222 N/A LEU 120.A N ASN 116.A O no hydrogen 3.402 N/A ARG 122.A N ILE 119.A O no hydrogen 3.259 N/A VAL 124.A N LEU 120.A O no hydrogen 3.041 N/A LEU 126.A N VAL 124.A O no hydrogen 2.817 N/A GLN 128.A NE2 PRO 125.A O no hydrogen 3.636 N/A GLN 128.A NE2 HIS 139.A O no hydrogen 3.159 N/A GLN 131.A N SER 129.A OG no hydrogen 3.344 N/A GLU 132.A N SER 129.A OG no hydrogen 3.130 N/A TYR 134.A OH ASP 155.A OD1 no hydrogen 2.705 N/A TYR 134.A OH ASP 155.A OD2 no hydrogen 2.869 N/A PHE 138.A N VAL 153.A O no hydrogen 2.893 N/A HIS 139.A N GLN 128.A OE1 no hydrogen 2.981 N/A PHE 140.A N VAL 151.A O no hydrogen 3.084 N/A GLN 141.A N VAL 123.A O no hydrogen 2.905 N/A GLN 141.A NE2 HIS 20.A O no hydrogen 3.591 N/A PHE 142.A N VAL 149.A O no hydrogen 2.950 N/A TRP 143.A N ASP 205.A O no hydrogen 2.665 N/A GLN 144.A N GLU 147.A O no hydrogen 3.100 N/A GLU 147.A N GLN 144.A O no hydrogen 2.874 N/A TRP 148.A N GLY 18.A O no hydrogen 2.835 N/A VAL 149.A N PHE 142.A O no hydrogen 2.847 N/A GLU 150.A N ILE 24.A O no hydrogen 2.486 N/A VAL 151.A N PHE 140.A O no hydrogen 2.884 N/A VAL 153.A N PHE 138.A O no hydrogen 2.965 N/A ASP 154.A N ASP 47.A OD2 no hydrogen 3.190 N/A ARG 156.A N ASP 154.A OD2 no hydrogen 2.615 N/A LEU 157.A N LYS 75.A O no hydrogen 3.053 N/A THR 159.A N ARG 73.A O no hydrogen 2.936 N/A THR 159.A OG1 ARG 73.A O no hydrogen 2.892 N/A LYS 160.A NZ ARG 70.A O no hydrogen 3.257 N/A LEU 165.A N PRO 158.A O no hydrogen 3.166 N/A VAL 167.A N GLU 181.A OE2 no hydrogen 3.023 N/A HIS 168.A N CYS 97.A O no hydrogen 2.779 N/A HIS 168.A ND1 SER 169.A O no hydrogen 3.099 N/A SER 169.A OG ASP 95.A OD2 no hydrogen 2.298 N/A SER 169.A OG GLY 172.A O no hydrogen 3.411 N/A ALA 170.A N ASP 95.A O no hydrogen 2.766 N/A GLU 171.A N ASP 95.A OD2 no hydrogen 3.001 N/A TRP 176.A N PHE 86.A O no hydrogen 2.779 N/A LEU 179.A N PHE 175.A O no hydrogen 3.093 N/A LEU 180.A N TRP 176.A O no hydrogen 2.788 N/A GLU 181.A N SER 177.A O no hydrogen 2.977 N/A LYS 182.A N ALA 178.A O no hydrogen 3.004 N/A LYS 182.A NZ ASP 154.A O no hydrogen 2.661 N/A LYS 182.A NZ ARG 156.A O no hydrogen 3.097 N/A ALA 183.A N LEU 179.A O no hydrogen 2.684 N/A TYR 184.A N LEU 180.A O no hydrogen 3.147 N/A TYR 184.A OH ASP 205.A OD2 no hydrogen 2.288 N/A ALA 185.A N GLU 181.A O no hydrogen 3.134 N/A LYS 186.A N LYS 182.A O no hydrogen 3.129 N/A LYS 186.A NZ ASP 47.A OD1 no hydrogen 3.161 N/A LYS 186.A NZ VAL 152.A O no hydrogen 2.716 N/A ILE 187.A N ALA 183.A O no hydrogen 3.183 N/A ASN 188.A N TYR 184.A O no hydrogen 3.189 N/A GLY 189.A N LYS 186.A O no hydrogen 2.438 N/A TYR 191.A N ALA 56.A O no hydrogen 2.947 N/A TYR 191.A OH GLU 181.A OE2 no hydrogen 3.107 N/A GLU 192.A N LEU 57.A O no hydrogen 2.745 N/A ALA 193.A N CYS 190.A O no hydrogen 3.364 N/A LEU 194.A N TYR 191.A O no hydrogen 2.662 N/A SER 195.A N GLU 192.A O no hydrogen 3.271 N/A ALA 198.A N GLU 201.A OE1 no hydrogen 3.269 N/A GLU 201.A N ALA 198.A O no hydrogen 2.740 N/A GLY 202.A N ALA 198.A O no hydrogen 3.191 N/A GLU 204.A N GLU 201.A O no hydrogen 2.544 N/A ASP 205.A N GLU 201.A O no hydrogen 3.148 N/A PHE 206.A N GLY 202.A O no hydrogen 2.992 N/A PHE 206.A N PHE 203.A O no hydrogen 3.106 N/A THR 207.A N GLU 204.A O no hydrogen 3.043 N/A GLY 208.A N GLU 204.A O no hydrogen 2.535 N/A GLY 209.A N THR 207.A OG1 no hydrogen 2.636 N/A ILE 210.A N CYS 296.A O no hydrogen 2.905 N/A ALA 211.A N GLU 204.A OE1 no hydrogen 2.638 N/A GLU 212.A N GLU 294.A O no hydrogen 3.121 N/A TYR 214.A N ARG 292.A O no hydrogen 2.940 N/A TYR 214.A OH GLU 212.A OE2 no hydrogen 2.374 N/A TYR 214.A OH GLU 294.A OE1 no hydrogen 2.935 N/A LYS 218.A N GLU 215.A O no hydrogen 3.096 N/A LEU 223.A N PRO 220.A O no hydrogen 2.849 N/A GLN 228.A N PHE 224.A O no hydrogen 3.515 N/A ALA 230.A N ILE 226.A O no hydrogen 2.303 N/A LEU 231.A N ILE 227.A O no hydrogen 2.765 N/A GLN 232.A N GLN 228.A O no hydrogen 2.609 N/A LYS 233.A N ALA 230.A O no hydrogen 2.505 N/A LYS 233.A NZ GLU 447.A OE1 no hydrogen 3.177 N/A LYS 233.A NZ GLU 447.A OE2 no hydrogen 3.083 N/A GLY 234.A N ALA 230.A O no hydrogen 3.216 N/A LEU 236.A N ILE 295.A O no hydrogen 3.464 N/A GLY 238.A N LEU 293.A O no hydrogen 3.073 N/A SER 240.A N SER 291.A O no hydrogen 3.220 N/A HIS 245.A NE2 ASN 269.A OD1 no hydrogen 2.680 N/A TYR 247.A N CYS 239.A O no hydrogen 2.937 N/A SER 248.A N ARG 268.A O no hydrogen 3.254 N/A VAL 249.A N LEU 237.A O no hydrogen 2.599 N/A THR 250.A N ARG 266.A O no hydrogen 3.032 N/A THR 250.A OG1 ARG 266.A O no hydrogen 2.736 N/A VAL 255.A N GLU 253.A O no hydrogen 2.743 N/A SER 257.A OG SER 260.A OG no hydrogen 3.015 N/A LEU 264.A N GLU 253.A O no hydrogen 3.410 N/A ARG 266.A N GLY 251.A O no hydrogen 2.733 N/A ILE 267.A N ILE 265.A O no hydrogen 3.167 N/A ARG 268.A N SER 248.A O no hydrogen 2.765 N/A TRP 271.A NE1 ILE 96.A O no hydrogen 2.964 N/A GLY 272.A N ASN 269.A O no hydrogen 3.447 N/A LEU 287.A N SER 284.A O no hydrogen 3.206 N/A ARG 288.A N ASP 285.A O no hydrogen 2.473 N/A ARG 288.A NH2 LEU 287.A O no hydrogen 3.528 N/A HIS 289.A N ASP 285.A O no hydrogen 2.561 N/A TYR 290.A N SER 240.A O no hydrogen 3.221 N/A SER 291.A N SER 240.A O no hydrogen 2.983 N/A ARG 292.A N TYR 214.A O no hydrogen 3.288 N/A LEU 293.A N GLY 238.A O no hydrogen 3.456 N/A GLU 294.A N GLU 212.A O no hydrogen 3.095 N/A ILE 295.A N LEU 236.A O no hydrogen 2.845 N/A CYS 296.A SG ILE 210.A O no hydrogen 3.942 N/A CYS 296.A SG GLU 212.A OE1 no hydrogen 3.120 N/A ASN 297.A ND2 GLY 234.A O no hydrogen 3.313 N/A ASP 301.A N LEU 298.A O no hydrogen 3.018 N/A THR 302.A OG1 THR 302.A O no hydrogen 2.465 N/A LEU 303.A N GLU 118.A OE2 no hydrogen 3.248 N/A THR 307.A OG1 SER 305.A O no hydrogen 3.186 N/A LYS 309.A N GLN 232.A O no hydrogen 2.907 N/A LYS 315.A NZ GLY 146.A O no hydrogen 2.804 N/A MET 316.A N ILE 442.A O no hydrogen 3.134 N/A GLY 318.A N PHE 440.A O no hydrogen 3.253 N/A ASN 319.A ND2 GLN 584.A OE1 no hydrogen 3.687 N/A TRP 320.A N GLY 438.A O no hydrogen 3.095 N/A ARG 321.A N THR 325.A OG1 no hydrogen 2.597 N/A ARG 321.A NH1 ASP 439.A OD1 no hydrogen 3.088 N/A ARG 321.A NH2 ASP 439.A OD1 no hydrogen 2.461 N/A ARG 321.A NH2 ASP 439.A OD2 no hydrogen 3.424 N/A ARG 322.A N ASP 437.A OD1 no hydrogen 3.153 N/A ARG 322.A NH2 ASP 593.A O no hydrogen 3.115 N/A THR 325.A N ARG 321.A O no hydrogen 2.829 N/A THR 325.A OG1 ARG 321.A O no hydrogen 3.553 N/A THR 325.A OG1 GLN 584.A OE1 no hydrogen 3.517 N/A ALA 326.A N ARG 321.A O no hydrogen 3.234 N/A ARG 330.A NH1 ARG 400.A O no hydrogen 3.041 N/A TYR 332.A N CYS 329.A O no hydrogen 2.897 N/A THR 335.A N TYR 332.A O no hydrogen 3.159 N/A THR 335.A OG1 TYR 332.A O no hydrogen 3.302 N/A PHE 336.A N TYR 332.A O no hydrogen 2.950 N/A MET 338.A N THR 335.A O no hydrogen 2.390 N/A ASN 339.A N PHE 336.A O no hydrogen 3.353 N/A ASN 339.A ND2 PHE 336.A O no hydrogen 3.078 N/A GLN 341.A NE2 TRP 337.A O no hydrogen 2.842 N/A TYR 342.A OH ASP 317.A O no hydrogen 3.058 N/A LEU 343.A N GLN 453.A O no hydrogen 2.901 N/A ILE 344.A N TYR 425.A O no hydrogen 3.284 N/A LYS 345.A N ASP 451.A O no hydrogen 3.232 N/A LYS 345.A NZ GLU 424.A OE2 no hydrogen 3.081 N/A CYS 352.A SG ASP 350.A OD2 no hydrogen 2.645 N/A CYS 352.A SG THR 353.A O no hydrogen 3.316 N/A CYS 352.A SG THR 353.A OG1 no hydrogen 3.432 N/A THR 353.A N ASP 350.A OD2 no hydrogen 3.205 N/A THR 353.A OG1 ASP 350.A OD1 no hydrogen 2.556 N/A THR 353.A OG1 ASP 350.A OD2 no hydrogen 2.729 N/A PHE 354.A N PHE 418.A O no hydrogen 2.775 N/A LEU 355.A N PHE 445.A O no hydrogen 2.296 N/A GLY 357.A N ARG 443.A O no hydrogen 3.397 N/A LEU 358.A N VAL 414.A O no hydrogen 2.577 N/A ILE 359.A N CYS 441.A O no hydrogen 3.195 N/A GLN 360.A NE2 HIS 374.A O no hydrogen 2.655 N/A GLN 360.A NE2 LEU 411.A O no hydrogen 3.567 N/A LYS 361.A NZ ASP 317.A OD2 no hydrogen 2.944 N/A LYS 361.A NZ PHE 440.A O no hydrogen 2.951 N/A ARG 363.A NH2 ASP 372.A O no hydrogen 2.956 N/A GLN 366.A NE2 ASP 372.A O no hydrogen 3.097 N/A MET 369.A N ALA 193.A O no hydrogen 3.026 N/A GLU 371.A N MET 369.A O no hydrogen 2.873 N/A HIS 374.A N GLN 360.A OE1 no hydrogen 3.239 N/A HIS 374.A NE2 ASP 437.A O no hydrogen 3.265 N/A ILE 376.A N HIS 374.A O no hydrogen 3.159 N/A GLY 377.A N SER 430.A O no hydrogen 3.122 N/A TYR 381.A N ILE 426.A O no hydrogen 2.299 N/A VAL 383.A N GLU 424.A O no hydrogen 3.317 N/A GLU 385.A N GLU 386.A OE1 no hydrogen 2.796 N/A HIS 390.A N ASP 457.A OD1 no hydrogen 3.369 N/A HIS 390.A ND1 VAL 455.A O no hydrogen 3.278 N/A LEU 397.A N LYS 393.A O no hydrogen 2.942 N/A THR 398.A N ASN 394.A O no hydrogen 2.734 N/A THR 398.A OG1 ASN 394.A O no hydrogen 2.996 N/A ARG 400.A NH1 ARG 400.A O no hydrogen 3.233 N/A SER 405.A N PHE 378.A O no hydrogen 2.856 N/A SER 405.A OG THR 407.A O no hydrogen 3.556 N/A ASP 406.A N ASN 416.A OD1 no hydrogen 3.187 N/A THR 407.A N SER 405.A O no hydrogen 2.754 N/A ARG 412.A NH1 ASP 205.A OD1 no hydrogen 3.260 N/A ASN 416.A N VAL 356.A O no hydrogen 3.165 N/A ASN 416.A ND2 ASP 406.A OD1 no hydrogen 3.345 N/A ARG 417.A NE GLU 212.A OE2 no hydrogen 2.931 N/A ARG 417.A NH2 GLU 212.A OE1 no hydrogen 2.749 N/A ARG 417.A NH2 GLU 212.A OE2 no hydrogen 3.362 N/A PHE 418.A N PHE 354.A O no hydrogen 3.218 N/A LEU 420.A N CYS 352.A O no hydrogen 2.591 N/A TYR 425.A N ILE 344.A O no hydrogen 3.120 N/A TYR 425.A OH PRO 421.A O no hydrogen 2.505 N/A ILE 426.A N TYR 381.A O no hydrogen 2.647 N/A LEU 427.A N TYR 342.A O no hydrogen 3.452 N/A VAL 428.A N GLY 379.A O no hydrogen 2.564 N/A THR 431.A OG1 GLU 433.A O no hydrogen 3.342 N/A ASN 435.A N ALA 326.A O no hydrogen 2.780 N/A LYS 436.A NZ GLU 433.A OE1 no hydrogen 3.459 N/A GLY 438.A N TRP 320.A O no hydrogen 3.396 N/A PHE 440.A N GLY 318.A O no hydrogen 3.016 N/A CYS 441.A N ILE 359.A O no hydrogen 3.263 N/A CYS 441.A SG MET 316.A O no hydrogen 3.461 N/A CYS 441.A SG ASP 317.A OD2 no hydrogen 3.803 N/A ILE 442.A N MET 316.A O no hydrogen 3.092 N/A ARG 443.A N GLY 357.A O no hydrogen 3.167 N/A ARG 443.A NH2 GLY 208.A O no hydrogen 2.879 N/A PHE 445.A N LEU 355.A O no hydrogen 2.698 N/A SER 446.A N LYS 312.A O no hydrogen 3.091 N/A SER 446.A OG LYS 448.A O no hydrogen 3.395 N/A GLN 453.A N LEU 343.A O no hydrogen 2.510 N/A VAL 455.A N GLN 341.A O no hydrogen 2.333 N/A ASP 456.A N THR 387.A O no hydrogen 3.200 N/A ASP 457.A N ASP 456.A OD2 no hydrogen 2.996 N/A GLU 460.A N LYS 577.A O no hydrogen 2.745 N/A ASN 462.A N GLY 575.A O no hydrogen 3.405 N/A SER 469.A OG ASP 467.A O no hydrogen 3.461 N/A GLY 476.A N ASP 474.A O no hydrogen 2.340 N/A ARG 479.A N ASP 475.A O no hydrogen 2.501 N/A LEU 480.A N GLY 476.A O no hydrogen 3.472 N/A PHE 481.A N ARG 479.A O no hydrogen 2.758 N/A LEU 484.A N PHE 481.A O no hydrogen 2.521 N/A ALA 485.A N ALA 482.A O no hydrogen 3.118 N/A ILE 491.A N LEU 532.A O no hydrogen 3.045 N/A LEU 496.A N SER 492.A O no hydrogen 2.350 N/A GLN 497.A N ALA 493.A O no hydrogen 2.797 N/A GLN 497.A NE2 PHE 512.A O no hydrogen 3.573 N/A THR 498.A N PHE 494.A O no hydrogen 3.108 N/A THR 498.A OG1 PHE 494.A O no hydrogen 3.419 N/A THR 498.A OG1 GLU 495.A O no hydrogen 3.122 N/A ILE 499.A N GLU 495.A O no hydrogen 2.758 N/A LEU 500.A N LEU 496.A O no hydrogen 2.708 N/A ARG 501.A N GLN 497.A O no hydrogen 2.873 N/A ARG 502.A N THR 498.A O no hydrogen 2.749 N/A VAL 503.A N LEU 500.A O no hydrogen 2.568 N/A ARG 507.A NH2 GLN 548.A OE1 no hydrogen 2.699 N/A SER 513.A N ASP 600.A OD1 no hydrogen 2.779 N/A SER 513.A OG GLU 515.A OE1 no hydrogen 3.375 N/A SER 513.A OG THR 516.A OG1 no hydrogen 3.103 N/A SER 513.A OG ASP 600.A OD1 no hydrogen 3.027 N/A THR 516.A OG1 SER 513.A OG no hydrogen 3.103 N/A THR 516.A OG1 ASP 600.A OD1 no hydrogen 3.463 N/A THR 516.A OG1 ASP 600.A OD2 no hydrogen 2.356 N/A CYS 517.A SG SER 513.A O no hydrogen 3.575 N/A LYS 518.A N ILE 514.A O no hydrogen 2.484 N/A ILE 519.A N GLU 515.A O no hydrogen 2.943 N/A ILE 519.A N THR 516.A O no hydrogen 2.359 N/A MET 520.A N THR 516.A O no hydrogen 2.668 N/A VAL 521.A N CYS 517.A O no hydrogen 2.842 N/A ASP 522.A N LYS 518.A O no hydrogen 3.312 N/A MET 523.A N ILE 519.A O no hydrogen 2.796 N/A MET 523.A N MET 520.A O no hydrogen 3.075 N/A LEU 524.A N VAL 521.A O no hydrogen 2.573 N/A ASP 525.A N VAL 521.A O no hydrogen 2.833 N/A SER 529.A N ASP 525.A OD2 no hydrogen 2.952 N/A SER 529.A N ASP 527.A OD1 no hydrogen 2.681 N/A SER 529.A OG ASP 525.A OD2 no hydrogen 3.444 N/A SER 529.A OG ASP 527.A OD1 no hydrogen 2.487 N/A SER 529.A OG LYS 531.A O no hydrogen 3.277 N/A LYS 531.A N SER 529.A OG no hydrogen 3.197 N/A LEU 532.A N ILE 491.A O no hydrogen 2.994 N/A GLY 533.A N GLU 536.A OE1 no hydrogen 2.845 N/A GLU 536.A N GLU 536.A OE2 no hydrogen 3.013 N/A PHE 537.A N GLY 533.A O no hydrogen 2.971 N/A TYR 538.A N LEU 534.A O no hydrogen 2.718 N/A ILE 539.A N LYS 535.A O no hydrogen 2.993 N/A LEU 540.A N GLU 536.A O no hydrogen 2.798 N/A TRP 541.A N PHE 537.A O no hydrogen 2.973 N/A THR 542.A N TYR 538.A O no hydrogen 2.872 N/A LYS 543.A N ILE 539.A O no hydrogen 2.604 N/A ILE 544.A N LEU 540.A O no hydrogen 2.678 N/A GLN 545.A N TRP 541.A O no hydrogen 2.893 N/A LYS 546.A N THR 542.A O no hydrogen 2.937 N/A TYR 547.A N LYS 543.A O no hydrogen 2.861 N/A GLN 548.A N ILE 544.A O no hydrogen 2.832 N/A LYS 549.A N GLN 545.A O no hydrogen 3.206 N/A LYS 549.A N LYS 546.A O no hydrogen 2.620 N/A ILE 550.A N TYR 547.A O no hydrogen 2.725 N/A TYR 551.A N TYR 547.A O no hydrogen 3.457 N/A TYR 551.A OH ILE 597.A O no hydrogen 2.824 N/A ARG 552.A N GLN 548.A O no hydrogen 3.338 N/A GLU 553.A N LYS 549.A O no hydrogen 2.799 N/A ILE 554.A N TYR 551.A O no hydrogen 3.151 N/A ASP 555.A N TYR 551.A O no hydrogen 2.528 N/A VAL 556.A N ILE 554.A O no hydrogen 2.539 N/A ASP 557.A N ASP 555.A O no hydrogen 2.347 N/A SER 559.A OG ASP 555.A OD1 no hydrogen 2.506 N/A SER 559.A OG ASP 555.A OD2 no hydrogen 2.711 N/A SER 559.A OG THR 561.A O no hydrogen 2.931 N/A SER 559.A OG THR 561.A OG1 no hydrogen 2.928 N/A THR 561.A N ASP 555.A OD2 no hydrogen 2.650 N/A THR 561.A N SER 559.A OG no hydrogen 3.039 N/A THR 561.A OG1 SER 559.A OG no hydrogen 2.928 N/A MET 562.A N ILE 597.A O no hydrogen 3.471 N/A SER 564.A N LEU 595.A O no hydrogen 3.166 N/A SER 564.A OG LEU 595.A O no hydrogen 2.367 N/A TYR 565.A OH ALA 326.A O no hydrogen 3.165 N/A GLU 566.A N ASN 563.A O no hydrogen 3.086 N/A LYS 569.A NZ GLU 572.A OE2 no hydrogen 2.545 N/A ALA 570.A N GLU 566.A O no hydrogen 2.911 N/A LEU 571.A N MET 567.A O no hydrogen 2.912 N/A GLU 572.A N ARG 568.A O no hydrogen 3.296 N/A GLU 572.A N LYS 569.A O no hydrogen 2.473 N/A GLU 573.A N LYS 569.A O no hydrogen 3.336 N/A ALA 574.A N ALA 570.A O no hydrogen 3.043 N/A GLY 575.A N GLU 572.A O no hydrogen 2.929 N/A PHE 576.A N LEU 571.A O no hydrogen 2.633 N/A LYS 577.A N GLU 460.A O no hydrogen 2.881 N/A LYS 577.A NZ GLU 572.A OE1 no hydrogen 2.665 N/A CYS 580.A N ASP 456.A OD1 no hydrogen 2.710 N/A CYS 580.A SG ASP 456.A OD1 no hydrogen 2.991 N/A GLN 584.A N CYS 580.A O no hydrogen 3.446 N/A VAL 585.A N GLN 581.A O no hydrogen 3.130 N/A ILE 586.A N LEU 582.A O no hydrogen 2.482 N/A VAL 587.A N HIS 583.A O no hydrogen 2.693 N/A VAL 587.A N GLN 584.A O no hydrogen 2.684 N/A ALA 588.A N GLN 584.A O no hydrogen 2.632 N/A ARG 589.A N VAL 585.A O no hydrogen 2.717 N/A ARG 589.A NH1 ARG 589.A O no hydrogen 2.511 N/A ALA 591.A N VAL 587.A O no hydrogen 2.971 N/A LEU 595.A N ASP 592.A O no hydrogen 3.059 N/A ILE 597.A N MET 562.A O no hydrogen 2.999 N/A ASN 601.A N ASP 598.A OD1 no hydrogen 2.710 N/A PHE 602.A N ASP 598.A O no hydrogen 3.104 N/A VAL 603.A N PHE 599.A O no hydrogen 3.034 N/A ARG 604.A N ASP 600.A O no hydrogen 2.590 N/A CYS 605.A N ASN 601.A O no hydrogen 2.855 N/A LEU 606.A N PHE 602.A O no hydrogen 3.214 N/A VAL 607.A N VAL 603.A O no hydrogen 2.851 N/A ARG 608.A N ARG 604.A O no hydrogen 3.010 N/A LEU 609.A N CYS 605.A O no hydrogen 2.651 N/A GLU 610.A N LEU 606.A O no hydrogen 3.188 N/A THR 611.A N VAL 607.A O no hydrogen 2.971 N/A THR 611.A OG1 VAL 607.A O no hydrogen 3.079 N/A THR 611.A OG1 ARG 608.A O no hydrogen 3.424 N/A LEU 612.A N ARG 608.A O no hydrogen 2.953 N/A PHE 613.A N LEU 609.A O no hydrogen 2.752 N/A LYS 614.A N GLU 610.A O no hydrogen 2.911 N/A ILE 615.A N THR 611.A O no hydrogen 2.802 N/A PHE 616.A N LEU 612.A O no hydrogen 2.889 N/A LYS 617.A N PHE 613.A O no hydrogen 2.546 N/A GLN 618.A N LYS 614.A O no hydrogen 2.446 N/A LEU 619.A N ILE 615.A O no hydrogen 2.946 N/A ASP 620.A N PHE 616.A O no hydrogen 2.989 N/A ASP 620.A N LYS 617.A O no hydrogen 2.797 N/A ASN 623.A N ASP 620.A O no hydrogen 2.857 N/A THR 624.A N ASP 620.A OD2 no hydrogen 3.133 N/A THR 624.A OG1 ASP 620.A OD1 no hydrogen 3.504 N/A THR 624.A OG1 ASP 620.A OD2 no hydrogen 2.624 N/A THR 624.A OG1 THR 626.A O no hydrogen 3.462 N/A GLY 625.A N ASP 620.A OD1 no hydrogen 2.801 N/A ASP 630.A N SER 633.A OG no hydrogen 3.275 N/A SER 633.A N ASP 630.A OD1 no hydrogen 3.037 N/A SER 633.A OG ASP 630.A O no hydrogen 3.181 N/A SER 633.A OG ASP 630.A OD1 no hydrogen 2.378 N/A TRP 634.A N ASP 630.A O no hydrogen 2.990 N/A LEU 635.A N LEU 631.A O no hydrogen 2.715 N/A CYS 636.A N ILE 632.A O no hydrogen 3.037 N/A CYS 636.A N SER 633.A O no hydrogen 3.246 N/A CYS 636.A SG ILE 632.A O no hydrogen 3.471 N/A PHE 637.A N SER 633.A O no hydrogen 3.390 N/A SER 638.A N TRP 634.A O no hydrogen 2.715 N/A SER 638.A OG TRP 634.A O no hydrogen 2.280 N/A VAL 639.A N LEU 635.A O no hydrogen 3.333 N/A