Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6b7z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 234.A OE1 no hydrogen 3.414 N/A ASN 7.A ND2 GLU 402.A OE2 no hydrogen 2.699 N/A ASP 15.A N SER 12.A O no hydrogen 2.963 N/A LYS 16.A NZ PRO 13.A O no hydrogen 3.197 N/A ARG 17.A N ASP 15.A OD1 no hydrogen 3.177 N/A ARG 17.A NE TYR 19.A OH no hydrogen 3.435 N/A TYR 19.A OH ASP 15.A OD2 no hydrogen 2.830 N/A ARG 20.A N LEU 32.A O no hydrogen 3.322 N/A LEU 22.A N VAL 30.A O no hydrogen 2.624 N/A LEU 24.A N ILE 28.A O no hydrogen 2.747 N/A ASN 26.A ND2 VAL 233.A O no hydrogen 2.377 N/A GLY 27.A N LEU 24.A O no hydrogen 3.412 N/A LYS 29.A N MET 209.A O no hydrogen 2.528 N/A LYS 29.A NZ MET 209.A O no hydrogen 3.383 N/A LYS 29.A NZ HIS 397.A ND1 no hydrogen 3.221 N/A VAL 30.A N LEU 22.A O no hydrogen 2.616 N/A LEU 31.A N VAL 211.A O no hydrogen 2.891 N/A LEU 32.A N ARG 20.A O no hydrogen 2.802 N/A ILE 33.A N VAL 213.A O no hydrogen 2.835 N/A SER 34.A N GLU 18.A O no hydrogen 3.022 N/A ASP 35.A N GLY 215.A O no hydrogen 2.911 N/A THR 37.A N ASP 35.A OD1 no hydrogen 3.267 N/A THR 37.A OG1 ASP 35.A OD1 no hydrogen 2.273 N/A THR 38.A N ASP 35.A O no hydrogen 3.014 N/A THR 38.A OG1 LYS 40.A O no hydrogen 3.557 N/A SER 41.A OG HIS 110.A O no hydrogen 2.580 N/A SER 42.A OG ALA 43.A O no hydrogen 3.561 N/A SER 42.A OG PHE 106.A O no hydrogen 2.797 N/A ALA 43.A N PHE 106.A O no hydrogen 2.909 N/A ALA 44.A N VAL 212.A O no hydrogen 2.490 N/A LEU 45.A N TYR 104.A O no hydrogen 2.358 N/A ASP 46.A N ALA 210.A O no hydrogen 2.970 N/A VAL 47.A N THR 102.A O no hydrogen 2.494 N/A HIS 48.A N LEU 208.A O no hydrogen 2.699 N/A ILE 49.A N VAL 47.A O no hydrogen 2.741 N/A SER 53.A N GLY 50.A O no hydrogen 3.341 N/A SER 53.A OG GLY 50.A O no hydrogen 3.477 N/A ILE 58.A N PRO 55.A O no hydrogen 3.205 N/A SER 62.A N ASP 54.A OD1 no hydrogen 2.751 N/A SER 62.A N ASP 54.A OD2 no hydrogen 3.356 N/A SER 62.A OG ASP 54.A OD1 no hydrogen 3.416 N/A PHE 64.A N GLY 60.A O no hydrogen 3.009 N/A LEU 65.A N LEU 61.A O no hydrogen 2.882 N/A GLU 66.A N SER 62.A O no hydrogen 2.918 N/A HIS 67.A N HIS 63.A O no hydrogen 2.983 N/A MET 68.A N LEU 65.A O no hydrogen 2.706 N/A THR 73.A N TYR 76.A O no hydrogen 3.252 N/A TYR 76.A N THR 73.A OG1 no hydrogen 2.516 N/A GLN 84.A N ASN 80.A O no hydrogen 2.402 N/A PHE 85.A N GLU 81.A O no hydrogen 2.897 N/A LEU 86.A N TYR 82.A O no hydrogen 2.979 N/A SER 87.A N SER 83.A O no hydrogen 2.767 N/A GLU 88.A N GLN 84.A O no hydrogen 2.860 N/A HIS 89.A N LEU 86.A O no hydrogen 3.141 N/A HIS 89.A ND1 PHE 85.A O no hydrogen 2.393 N/A GLY 91.A N LEU 86.A O no hydrogen 2.860 N/A SER 93.A OG TYR 105.A O no hydrogen 2.837 N/A ASN 94.A N TYR 105.A O no hydrogen 3.161 N/A ALA 95.A N ASN 94.A OD1 no hydrogen 2.585 N/A PHE 96.A N ASN 103.A O no hydrogen 2.852 N/A THR 97.A OG1 THR 102.A OG1 no hydrogen 3.369 N/A SER 98.A N HIS 101.A O no hydrogen 2.384 N/A SER 98.A OG HIS 101.A O no hydrogen 2.920 N/A GLU 100.A N SER 98.A OG no hydrogen 3.076 N/A HIS 101.A N SER 98.A OG no hydrogen 2.604 N/A THR 102.A N VAL 47.A O no hydrogen 2.347 N/A THR 102.A OG1 ILE 49.A O no hydrogen 2.986 N/A THR 102.A OG1 THR 97.A OG1 no hydrogen 3.369 N/A ASN 103.A N PHE 96.A O no hydrogen 2.425 N/A TYR 104.A N LEU 45.A O no hydrogen 2.535 N/A TYR 105.A N ASN 94.A O no hydrogen 3.124 N/A PHE 106.A N ALA 43.A O no hydrogen 3.044 N/A VAL 108.A N SER 41.A O no hydrogen 2.721 N/A HIS 110.A NE2 THR 38.A O no hydrogen 3.242 N/A LEU 113.A N GLU 111.A O no hydrogen 2.691 N/A ALA 116.A N HIS 112.A O no hydrogen 3.200 N/A LEU 117.A N LEU 113.A O no hydrogen 2.929 N/A ASP 118.A N GLU 114.A O no hydrogen 2.813 N/A ARG 119.A N GLY 115.A O no hydrogen 2.937 N/A PHE 120.A N LEU 117.A O no hydrogen 3.375 N/A ALA 121.A N LEU 117.A O no hydrogen 2.886 N/A SER 126.A OG SER 126.A O no hydrogen 2.562 N/A LYS 134.A N ASP 130.A O no hydrogen 2.853 N/A ASP 135.A N GLU 131.A O no hydrogen 2.929 N/A ARG 136.A N SER 132.A O no hydrogen 2.915 N/A ARG 136.A NH2 GLU 79.A OE2 no hydrogen 2.858 N/A GLU 137.A N ALA 133.A O no hydrogen 2.865 N/A VAL 138.A N LYS 134.A O no hydrogen 2.864 N/A ALA 140.A N ARG 136.A O no hydrogen 2.963 N/A VAL 141.A N GLU 137.A O no hydrogen 2.861 N/A ASP 142.A N VAL 138.A O no hydrogen 2.904 N/A SER 143.A N ASN 139.A O no hydrogen 2.879 N/A GLU 144.A N ALA 140.A O no hydrogen 2.824 N/A HIS 145.A N VAL 141.A O no hydrogen 2.873 N/A HIS 145.A NE2 TRP 450.A O no hydrogen 2.560 N/A GLU 146.A N ASP 142.A O no hydrogen 2.885 N/A LYS 147.A N SER 143.A O no hydrogen 2.855 N/A ASN 148.A N GLU 144.A O no hydrogen 2.933 N/A VAL 149.A N GLU 146.A O no hydrogen 3.078 N/A ALA 153.A N ASN 151.A OD1 no hydrogen 3.433 N/A ARG 155.A N ASN 151.A O no hydrogen 3.266 N/A ARG 155.A NH1 ASP 152.A OD1 no hydrogen 3.012 N/A LEU 156.A N ASP 152.A O no hydrogen 2.946 N/A PHE 157.A N ALA 153.A O no hydrogen 2.896 N/A GLN 158.A N TRP 154.A O no hydrogen 2.888 N/A GLN 158.A NE2 LYS 172.A O no hydrogen 3.507 N/A LEU 159.A N ARG 155.A O no hydrogen 2.827 N/A GLU 160.A N LEU 156.A O no hydrogen 2.890 N/A LYS 161.A N PHE 157.A O no hydrogen 2.953 N/A ALA 162.A N GLN 158.A O no hydrogen 2.882 N/A THR 163.A N LEU 159.A O no hydrogen 3.366 N/A THR 163.A OG1 LEU 159.A O no hydrogen 2.365 N/A PHE 170.A N HIS 168.A ND1 no hydrogen 3.331 N/A SER 171.A N HIS 168.A O no hydrogen 3.207 N/A SER 171.A OG PRO 166.A O no hydrogen 2.789 N/A SER 171.A OG HIS 168.A O no hydrogen 3.019 N/A LYS 172.A NZ ASP 54.A O no hydrogen 2.364 N/A LYS 178.A NZ GLU 182.A OE1 no hydrogen 3.523 N/A THR 180.A N ASN 177.A OD1 no hydrogen 2.461 N/A THR 180.A OG1 ASN 177.A OD1 no hydrogen 2.606 N/A GLU 182.A N LYS 178.A O no hydrogen 2.943 N/A THR 183.A N LYS 178.A O no hydrogen 3.273 N/A THR 183.A N TYR 179.A O no hydrogen 2.891 N/A ARG 184.A N TYR 179.A O no hydrogen 3.181 N/A ASN 186.A ND2 GLU 182.A OE2 no hydrogen 3.188 N/A GLU 188.A N PRO 185.A O no hydrogen 3.152 N/A GLY 189.A N ASN 186.A O no hydrogen 3.108 N/A LEU 196.A N VAL 192.A O no hydrogen 2.863 N/A LEU 197.A N ARG 193.A O no hydrogen 2.965 N/A LYS 198.A N GLN 194.A O no hydrogen 2.973 N/A PHE 199.A N GLU 195.A O no hydrogen 2.812 N/A HIS 200.A N LEU 196.A O no hydrogen 2.982 N/A SER 201.A N LEU 197.A O no hydrogen 2.999 N/A SER 201.A OG LEU 197.A O no hydrogen 2.923 N/A SER 201.A OG LYS 198.A O no hydrogen 3.166 N/A ALA 202.A N LYS 198.A O no hydrogen 2.907 N/A TYR 204.A N PHE 199.A O no hydrogen 3.126 N/A SER 205.A N HIS 200.A O no hydrogen 2.983 N/A SER 205.A OG HIS 200.A O no hydrogen 2.947 N/A SER 206.A OG TYR 203.A O no hydrogen 2.630 N/A ALA 210.A N ASP 46.A O no hydrogen 2.412 N/A VAL 211.A N LYS 29.A O no hydrogen 2.424 N/A VAL 212.A N ALA 44.A O no hydrogen 3.002 N/A LEU 214.A N SER 42.A O no hydrogen 2.721 N/A ARG 216.A NE THR 38.A O no hydrogen 2.683 N/A SER 218.A OG ASP 221.A OD2 no hydrogen 2.695 N/A LEU 222.A N SER 218.A O no hydrogen 3.396 N/A THR 223.A N LEU 219.A O no hydrogen 2.947 N/A THR 223.A OG1 LEU 219.A O no hydrogen 2.342 N/A ASN 224.A N ASP 220.A O no hydrogen 2.980 N/A LEU 225.A N ASP 221.A O no hydrogen 2.930 N/A VAL 226.A N LEU 222.A O no hydrogen 2.915 N/A VAL 227.A N THR 223.A O no hydrogen 2.963 N/A PHE 230.A N VAL 226.A O no hydrogen 3.248 N/A SER 231.A N LYS 228.A O no hydrogen 3.414 N/A SER 231.A OG LYS 228.A O no hydrogen 3.146 N/A ASN 237.A N ASN 235.A OD1 no hydrogen 2.644 N/A GLN 249.A N PRO 247.A O no hydrogen 2.886 N/A GLN 249.A NE2 GLU 245.A OE1 no hydrogen 3.045 N/A GLN 249.A NE2 HIS 246.A O no hydrogen 2.433 N/A GLU 251.A N GLN 249.A O no hydrogen 2.858 N/A LYS 254.A N VAL 431.A O no hydrogen 2.391 N/A GLN 255.A NE2 LEU 253.A O no hydrogen 3.451 N/A ILE 259.A N ILE 435.A O no hydrogen 2.532 N/A ILE 262.A N ASP 152.A OD1 no hydrogen 2.848 N/A ILE 262.A N ASP 152.A OD2 no hydrogen 3.098 N/A LYS 263.A N ASP 152.A OD2 no hydrogen 3.346 N/A ARG 266.A NH1 GLU 336.A OE2 no hydrogen 3.282 N/A ASN 267.A N VAL 436.A O no hydrogen 2.740 N/A LEU 268.A N VAL 332.A O no hydrogen 3.452 N/A TYR 269.A N ALA 434.A O no hydrogen 2.428 N/A VAL 270.A N ILE 330.A O no hydrogen 2.879 N/A THR 271.A N ARG 432.A O no hydrogen 2.764 N/A PHE 272.A N PHE 328.A O no hydrogen 2.657 N/A ILE 274.A N MET 326.A O no hydrogen 2.786 N/A GLN 278.A N ASP 276.A OD1 no hydrogen 2.954 N/A TYR 280.A N LEU 277.A O no hydrogen 2.833 N/A SER 283.A N TYR 280.A O no hydrogen 3.273 N/A HIS 287.A N ASN 284.A OD1 no hydrogen 3.250 N/A LEU 289.A N PRO 285.A O no hydrogen 2.854 N/A GLY 290.A N GLY 286.A O no hydrogen 2.888 N/A HIS 291.A N HIS 287.A O no hydrogen 2.886 N/A LEU 292.A N TYR 288.A O no hydrogen 3.026 N/A ILE 293.A N LEU 289.A O no hydrogen 2.752 N/A ILE 293.A N GLY 290.A O no hydrogen 3.127 N/A GLY 294.A N GLY 290.A O no hydrogen 3.021 N/A SER 300.A N GLY 297.A O no hydrogen 2.962 N/A SER 300.A OG HIS 295.A O no hydrogen 2.924 N/A SER 303.A N SER 300.A OG no hydrogen 3.307 N/A SER 303.A OG SER 300.A O no hydrogen 2.334 N/A GLU 304.A N SER 300.A O no hydrogen 2.630 N/A LEU 305.A N LEU 301.A O no hydrogen 2.833 N/A LYS 306.A N LEU 302.A O no hydrogen 2.904 N/A LYS 306.A NZ ASN 312.A O no hydrogen 3.016 N/A SER 307.A N SER 303.A O no hydrogen 2.929 N/A LYS 308.A N GLU 304.A O no hydrogen 2.699 N/A TRP 310.A N LEU 305.A O no hydrogen 2.650 N/A ASN 312.A N ASP 333.A O no hydrogen 2.888 N/A ASN 312.A ND2 ASP 333.A OD1 no hydrogen 3.060 N/A THR 313.A N ASP 333.A O no hydrogen 3.316 N/A VAL 315.A N ASN 331.A O no hydrogen 2.403 N/A GLY 317.A N ILE 329.A O no hydrogen 2.546 N/A LYS 319.A N PHE 327.A O no hydrogen 3.115 N/A LYS 319.A NZ GLU 320.A O no hydrogen 2.511 N/A ARG 323.A NE GLU 242.A OE1 no hydrogen 3.043 N/A MET 326.A N ILE 274.A O no hydrogen 2.851 N/A PHE 327.A N LYS 319.A O no hydrogen 3.152 N/A ILE 329.A N GLY 317.A O no hydrogen 2.634 N/A ILE 330.A N VAL 270.A O no hydrogen 2.816 N/A ASN 331.A N VAL 315.A O no hydrogen 2.358 N/A ASP 333.A N THR 313.A O no hydrogen 2.474 N/A LEU 334.A N ASP 333.A OD1 no hydrogen 2.654 N/A THR 335.A N TRP 310.A O no hydrogen 3.274 N/A THR 335.A OG1 GLY 309.A O no hydrogen 3.542 N/A THR 335.A OG1 TRP 310.A O no hydrogen 2.502 N/A GLY 338.A N THR 335.A OG1 no hydrogen 2.743 N/A LEU 339.A N THR 335.A O no hydrogen 2.382 N/A LEU 340.A N GLU 336.A O no hydrogen 2.687 N/A HIS 341.A N GLY 338.A O no hydrogen 2.984 N/A HIS 341.A ND1 GLU 337.A O no hydrogen 2.281 N/A ILE 345.A N HIS 341.A O no hydrogen 2.988 N/A ILE 346.A N VAL 342.A O no hydrogen 2.941 N/A LEU 347.A N GLU 343.A O no hydrogen 2.837 N/A HIS 348.A N ASP 344.A O no hydrogen 2.757 N/A MET 349.A N ILE 345.A O no hydrogen 2.856 N/A PHE 350.A N ILE 346.A O no hydrogen 2.943 N/A GLN 351.A N LEU 347.A O no hydrogen 2.823 N/A TYR 352.A N HIS 348.A O no hydrogen 2.868 N/A ILE 353.A N MET 349.A O no hydrogen 2.923 N/A GLN 354.A N PHE 350.A O no hydrogen 2.851 N/A LYS 355.A N GLN 351.A O no hydrogen 2.832 N/A LYS 355.A NZ PHE 477.A O no hydrogen 3.298 N/A LEU 356.A N TYR 352.A O no hydrogen 2.920 N/A ARG 357.A N ILE 353.A O no hydrogen 2.822 N/A ALA 358.A N GLN 354.A O no hydrogen 2.898 N/A GLU 359.A N LYS 355.A O no hydrogen 3.106 N/A GLY 360.A N LEU 356.A O no hydrogen 2.556 N/A GLN 367.A N GLU 363.A O no hydrogen 2.814 N/A GLN 367.A NE2 ASP 371.A OD2 no hydrogen 2.797 N/A GLU 368.A N TRP 364.A O no hydrogen 2.946 N/A LEU 369.A N VAL 365.A O no hydrogen 2.965 N/A LYS 370.A N PHE 366.A O no hydrogen 2.796 N/A LYS 370.A NZ GLU 412.A O no hydrogen 2.896 N/A ASP 371.A N GLN 367.A O no hydrogen 2.920 N/A LEU 372.A N GLU 368.A O no hydrogen 2.892 N/A ASN 373.A N LEU 369.A O no hydrogen 2.851 N/A ALA 374.A N LYS 370.A O no hydrogen 2.861 N/A VAL 375.A N ASP 371.A O no hydrogen 2.954 N/A ALA 376.A N LEU 372.A O no hydrogen 2.863 N/A PHE 377.A N ASN 373.A O no hydrogen 2.733 N/A ARG 378.A N ALA 374.A O no hydrogen 2.956 N/A PHE 379.A N VAL 375.A O no hydrogen 2.982 N/A THR 389.A N PRO 385.A O no hydrogen 3.042 N/A SER 390.A OG GLY 387.A O no hydrogen 2.430 N/A LYS 391.A N GLY 387.A O no hydrogen 2.857 N/A ILE 392.A N TYR 388.A O no hydrogen 2.932 N/A ALA 393.A N THR 389.A O no hydrogen 2.836 N/A GLY 394.A N SER 390.A O no hydrogen 2.834 N/A ILE 395.A N LYS 391.A O no hydrogen 3.050 N/A TYR 398.A N ILE 395.A O no hydrogen 3.347 N/A TYR 398.A OH GLU 100.A OE1 no hydrogen 2.399 N/A TYR 398.A OH HIS 101.A NE2 no hydrogen 3.252 N/A TYR 399.A N LEU 396.A O no hydrogen 3.481 N/A GLU 403.A N PRO 400.A O no hydrogen 3.272 N/A GLU 408.A N GLU 408.A OE1 no hydrogen 2.653 N/A GLU 412.A N LYS 282.A O no hydrogen 3.043 N/A ILE 419.A N ARG 415.A O no hydrogen 3.420 N/A GLU 420.A N PRO 416.A O no hydrogen 2.917 N/A MET 421.A N ASP 417.A O no hydrogen 2.878 N/A VAL 422.A N LEU 418.A O no hydrogen 2.942 N/A LEU 423.A N ILE 419.A O no hydrogen 2.889 N/A ASP 424.A N GLU 420.A O no hydrogen 2.842 N/A LEU 426.A N VAL 422.A O no hydrogen 2.715 N/A ARG 427.A NE ASP 424.A O no hydrogen 3.040 N/A ARG 427.A NE ASP 424.A OD1 no hydrogen 2.739 N/A ARG 427.A NH2 ASP 424.A OD1 no hydrogen 2.923 N/A ASN 430.A N ARG 427.A O no hydrogen 2.896 N/A ASN 430.A ND2 LYS 425.A O no hydrogen 2.404 N/A ARG 432.A N THR 271.A O no hydrogen 3.044 N/A ARG 432.A NH2 THR 163.A O no hydrogen 2.415 N/A VAL 433.A N GLN 255.A O no hydrogen 3.025 N/A ALA 434.A N TYR 269.A O no hydrogen 2.697 N/A ILE 435.A N TYR 257.A O no hydrogen 2.588 N/A VAL 436.A N ASN 267.A O no hydrogen 2.441 N/A SER 437.A N ILE 259.A O no hydrogen 2.944 N/A SER 437.A OG SER 439.A OG no hydrogen 2.852 N/A LYS 438.A NZ PRO 261.A O no hydrogen 2.854 N/A LYS 438.A NZ ILE 262.A O no hydrogen 3.107 N/A SER 439.A N SER 437.A OG no hydrogen 3.178 N/A SER 439.A OG SER 437.A OG no hydrogen 2.852 N/A LYS 443.A N GLU 441.A O no hydrogen 3.066 N/A THR 444.A OG1 PHE 440.A O no hydrogen 2.558 N/A THR 444.A OG1 GLN 454.A OE1 no hydrogen 2.582 N/A THR 447.A OG1 ASP 445.A O no hydrogen 2.695 N/A GLU 448.A N THR 453.A O no hydrogen 2.530 N/A GLU 449.A N GLU 449.A OE1 no hydrogen 2.784 N/A THR 453.A OG1 VAL 260.A O no hydrogen 2.964 N/A TYR 455.A N ARG 446.A O no hydrogen 3.130 N/A GLN 457.A NE2 GLN 255.A OE1 no hydrogen 2.626 N/A ILE 460.A N LYS 254.A O no hydrogen 3.457 N/A LYS 466.A N ASP 462.A O no hydrogen 2.889 N/A LYS 467.A N GLU 463.A O no hydrogen 2.843 N/A TRP 468.A N VAL 464.A O no hydrogen 2.766 N/A GLN 469.A N ILE 465.A O no hydrogen 2.953 N/A ASN 470.A N LYS 466.A O no hydrogen 3.340 N/A ASP 472.A N ASN 470.A O no hydrogen 3.016 N/A ILE 486.A N GLU 484.A OE1 no hydrogen 2.917 N/A PHE 490.A N THR 488.A O no hydrogen 2.758 N/A GLU 491.A N GLU 491.A OE1 no hydrogen 2.746 N/A GLU 496.A N GLU 496.A OE1 no hydrogen 2.819 N/A TYR 502.A OH ASP 874.A OD1 no hydrogen 2.270 N/A ILE 506.A N LEU 514.A O no hydrogen 2.991 N/A LYS 507.A NZ LEU 694.A O no hydrogen 2.349 N/A THR 509.A N SER 512.A O no hydrogen 2.952 N/A THR 509.A OG1 SER 512.A OG no hydrogen 2.648 N/A SER 512.A OG THR 509.A OG1 no hydrogen 2.648 N/A LEU 514.A N LYS 507.A O no hydrogen 2.829 N/A TRP 515.A N ALA 682.A O no hydrogen 3.018 N/A LYS 517.A NZ GLN 518.A O no hydrogen 3.485 N/A GLN 518.A NE2 LEU 493.A O no hydrogen 3.438 N/A ALA 527.A N GLY 588.A O no hydrogen 2.480 N/A ASN 528.A N HIS 685.A O no hydrogen 2.905 N/A LEU 529.A N VAL 586.A O no hydrogen 2.678 N/A ASN 530.A N LEU 683.A O no hydrogen 2.499 N/A PHE 531.A N LEU 584.A O no hydrogen 2.948 N/A GLU 532.A N GLU 681.A O no hydrogen 2.705 N/A SER 535.A N TYR 580.A O no hydrogen 3.374 N/A SER 535.A OG LEU 674.A O no hydrogen 3.398 N/A PHE 537.A N SER 535.A OG no hydrogen 3.294 N/A ALA 538.A N SER 535.A O no hydrogen 3.502 N/A TYR 539.A OH THR 646.A OG1 no hydrogen 3.064 N/A TYR 539.A OH GLU 647.A OE1 no hydrogen 3.250 N/A TYR 539.A OH VAL 648.A O no hydrogen 2.553 N/A SER 545.A N ASP 541.A O no hydrogen 3.104 N/A SER 545.A OG ASP 541.A O no hydrogen 3.248 N/A SER 545.A OG PRO 542.A O no hydrogen 2.409 N/A ASN 546.A N PRO 542.A O no hydrogen 2.973 N/A MET 547.A N LEU 543.A O no hydrogen 2.978 N/A ALA 548.A N HIS 544.A O no hydrogen 2.883 N/A TYR 549.A N SER 545.A O no hydrogen 2.788 N/A LEU 550.A N ASN 546.A O no hydrogen 2.884 N/A TYR 551.A N MET 547.A O no hydrogen 2.764 N/A LEU 552.A N ALA 548.A O no hydrogen 2.888 N/A GLU 553.A N TYR 549.A O no hydrogen 2.945 N/A LEU 554.A N LEU 550.A O no hydrogen 2.906 N/A LEU 555.A N TYR 551.A O no hydrogen 2.905 N/A LYS 556.A N LEU 552.A O no hydrogen 2.840 N/A LYS 556.A NZ LEU 575.A O no hydrogen 3.481 N/A ASP 557.A N GLU 553.A O no hydrogen 2.875 N/A SER 558.A N LEU 555.A O no hydrogen 2.783 N/A GLU 561.A N SER 558.A O no hydrogen 3.311 N/A ALA 563.A N LEU 559.A O no hydrogen 2.574 N/A GLU 567.A N ALA 563.A O no hydrogen 2.953 N/A LEU 568.A N TYR 564.A O no hydrogen 2.822 N/A GLY 570.A N GLU 567.A O no hydrogen 2.728 N/A LEU 571.A N GLU 567.A O no hydrogen 3.349 N/A SER 572.A OG LYS 587.A O no hydrogen 3.498 N/A GLN 576.A N TYR 583.A O no hydrogen 2.768 N/A THR 578.A N GLY 581.A O no hydrogen 2.485 N/A THR 578.A OG1 GLY 581.A O no hydrogen 2.741 N/A THR 578.A OG1 MET 582.A O no hydrogen 3.368 N/A TYR 580.A N THR 578.A OG1 no hydrogen 2.981 N/A GLY 581.A N THR 578.A OG1 no hydrogen 2.512 N/A SER 585.A N ASP 574.A O no hydrogen 3.049 N/A SER 585.A OG LEU 529.A O no hydrogen 2.496 N/A SER 585.A OG ASN 530.A OD1 no hydrogen 2.673 N/A VAL 586.A N LEU 529.A O no hydrogen 3.097 N/A LYS 587.A N SER 572.A O no hydrogen 2.715 N/A GLY 588.A N ALA 527.A O no hydrogen 2.768 N/A LYS 592.A NZ GLU 484.A O no hydrogen 3.344 N/A LEU 596.A N LYS 592.A O no hydrogen 2.683 N/A LEU 597.A N GLN 593.A O no hydrogen 2.926 N/A LYS 598.A N PRO 594.A O no hydrogen 2.867 N/A LYS 599.A N ILE 595.A O no hydrogen 2.919 N/A ILE 600.A N LEU 596.A O no hydrogen 2.819 N/A ILE 601.A N LEU 597.A O no hydrogen 2.911 N/A GLU 602.A N LYS 598.A O no hydrogen 2.928 N/A LYS 603.A N LYS 599.A O no hydrogen 2.842 N/A MET 604.A N ILE 600.A O no hydrogen 2.891 N/A ALA 605.A N ILE 601.A O no hydrogen 2.863 N/A THR 606.A N GLU 602.A O no hydrogen 2.842 N/A THR 606.A OG1 GLU 602.A O no hydrogen 3.169 N/A ARG 613.A NE ARG 613.A O no hydrogen 3.207 N/A PHE 614.A N ASP 610.A O no hydrogen 2.754 N/A GLU 615.A N GLU 611.A O no hydrogen 2.909 N/A ILE 616.A N LYS 612.A O no hydrogen 2.885 N/A ILE 617.A N ARG 613.A O no hydrogen 2.966 N/A LYS 618.A N PHE 614.A O no hydrogen 2.932 N/A LYS 618.A NZ LEU 659.A O no hydrogen 3.081 N/A GLU 619.A N GLU 615.A O no hydrogen 2.836 N/A ALA 620.A N ILE 616.A O no hydrogen 2.827 N/A TYR 621.A N ILE 617.A O no hydrogen 3.007 N/A MET 622.A N LYS 618.A O no hydrogen 2.818 N/A ARG 623.A N GLU 619.A O no hydrogen 2.845 N/A SER 624.A N ALA 620.A O no hydrogen 2.946 N/A LEU 625.A N TYR 621.A O no hydrogen 2.853 N/A LEU 625.A N MET 622.A O no hydrogen 3.230 N/A PHE 628.A N LEU 625.A O no hydrogen 2.860 N/A GLN 632.A N GLN 635.A OE1 no hydrogen 3.436 N/A HIS 636.A N GLN 632.A O no hydrogen 2.602 N/A ALA 637.A N PRO 633.A O no hydrogen 2.825 N/A MET 638.A N HIS 634.A O no hydrogen 2.857 N/A TYR 639.A N GLN 635.A O no hydrogen 2.982 N/A TYR 640.A N HIS 636.A O no hydrogen 2.919 N/A LEU 641.A N ALA 637.A O no hydrogen 2.775 N/A ARG 642.A N MET 638.A O no hydrogen 2.921 N/A LEU 644.A N TYR 640.A O no hydrogen 2.766 N/A THR 646.A OG1 TYR 539.A OH no hydrogen 3.064 N/A THR 646.A OG1 VAL 648.A O no hydrogen 3.367 N/A VAL 648.A N TYR 539.A OH no hydrogen 2.577 N/A GLU 654.A N THR 651.A OG1 no hydrogen 2.826 N/A LEU 655.A N THR 651.A O no hydrogen 2.938 N/A LYS 656.A N LYS 652.A O no hydrogen 2.781 N/A GLU 657.A N ASP 653.A O no hydrogen 3.056 N/A LEU 659.A N LEU 655.A O no hydrogen 3.133 N/A ASP 660.A N GLU 657.A O no hydrogen 3.212 N/A ARG 666.A N THR 663.A O no hydrogen 3.224 N/A ARG 666.A N THR 663.A OG1 no hydrogen 3.339 N/A LYS 668.A N LEU 664.A O no hydrogen 2.860 N/A ALA 669.A N PRO 665.A O no hydrogen 2.820 N/A PHE 670.A N ARG 666.A O no hydrogen 2.919 N/A ILE 671.A N LEU 667.A O no hydrogen 2.788 N/A LEU 674.A N PHE 670.A O no hydrogen 2.473 N/A LEU 675.A N ILE 671.A O no hydrogen 2.760 N/A SER 676.A N GLN 673.A O no hydrogen 3.402 N/A SER 676.A OG GLN 673.A O no hydrogen 3.002 N/A GLU 681.A N GLU 532.A OE1 no hydrogen 2.645 N/A ALA 682.A N LYS 513.A O no hydrogen 3.322 N/A LEU 683.A N ASN 530.A O no hydrogen 2.427 N/A LEU 684.A N TRP 515.A O no hydrogen 2.778 N/A ASN 687.A N LYS 526.A O no hydrogen 3.531 N/A ASN 687.A ND2 GLU 491.A O no hydrogen 3.578 N/A ILE 688.A N GLY 686.A O no hydrogen 2.757 N/A ALA 693.A N THR 689.A O no hydrogen 2.612 N/A LEU 694.A N LYS 690.A O no hydrogen 2.917 N/A GLY 695.A N GLN 691.A O no hydrogen 2.990 N/A ILE 696.A N ALA 692.A O no hydrogen 2.848 N/A MET 697.A N ALA 693.A O no hydrogen 2.939 N/A GLN 698.A N LEU 694.A O no hydrogen 2.949 N/A MET 699.A N GLY 695.A O no hydrogen 2.786 N/A VAL 700.A N ILE 696.A O no hydrogen 2.966 N/A GLU 701.A N MET 697.A O no hydrogen 3.062 N/A ASP 702.A N GLN 698.A O no hydrogen 2.921 N/A THR 703.A N MET 699.A O no hydrogen 2.847 N/A THR 703.A OG1 MET 699.A O no hydrogen 2.245 N/A LEU 704.A N VAL 700.A O no hydrogen 3.034 N/A ILE 705.A N GLU 701.A O no hydrogen 3.011 N/A GLU 706.A N ASP 702.A O no hydrogen 2.854 N/A HIS 707.A N THR 703.A O no hydrogen 2.961 N/A HIS 707.A ND1 THR 703.A O no hydrogen 2.563 N/A ALA 708.A N LEU 704.A O no hydrogen 2.988 N/A HIS 709.A N ILE 705.A O no hydrogen 2.946 N/A THR 710.A OG1 LEU 675.A O no hydrogen 2.858 N/A GLN 717.A N LEU 714.A O no hydrogen 3.109 N/A ARG 720.A NH1 ILE 867.A O no hydrogen 2.321 N/A ARG 722.A NE PHE 943.A O no hydrogen 2.956 N/A GLN 725.A N PRO 941.A O no hydrogen 2.643 N/A ARG 729.A N PRO 727.A O no hydrogen 2.716 N/A ARG 737.A NH1 ARG 916.A O no hydrogen 3.123 N/A ASN 738.A N LEU 914.A O no hydrogen 3.267 N/A ASN 738.A ND2 HIS 741.A ND1 no hydrogen 3.328 N/A GLU 739.A N ASN 738.A OD1 no hydrogen 2.595 N/A SER 744.A N SER 807.A O no hydrogen 2.530 N/A SER 744.A OG SER 807.A O no hydrogen 3.347 N/A SER 744.A OG LYS 809.A O no hydrogen 2.649 N/A TYR 749.A N VAL 909.A O no hydrogen 2.852 N/A TYR 749.A OH GLU 723.A OE2 no hydrogen 3.371 N/A GLN 751.A N HIS 907.A O no hydrogen 3.300 N/A GLN 751.A NE2 GLU 723.A OE2 no hydrogen 3.492 N/A GLN 751.A NE2 VAL 724.A O no hydrogen 2.840 N/A THR 752.A OG1 ASP 753.A O no hydrogen 3.418 N/A ASP 753.A N THR 752.A OG1 no hydrogen 2.577 N/A MET 754.A N ASP 753.A OD1 no hydrogen 2.818 N/A GLN 755.A NE2 GLY 797.A O no hydrogen 2.782 N/A SER 756.A N MET 754.A O no hydrogen 2.662 N/A SER 756.A OG SER 758.A OG no hydrogen 3.334 N/A SER 758.A OG SER 756.A OG no hydrogen 3.334 N/A SER 758.A OG GLU 759.A OE2 no hydrogen 2.718 N/A PHE 762.A N SER 758.A O no hydrogen 3.032 N/A LEU 763.A N GLU 759.A O no hydrogen 2.920 N/A GLU 764.A N ASN 760.A O no hydrogen 2.936 N/A LEU 765.A N MET 761.A O no hydrogen 2.851 N/A PHE 766.A N PHE 762.A O no hydrogen 2.904 N/A ALA 767.A N LEU 763.A O no hydrogen 2.790 N/A GLN 768.A N GLU 764.A O no hydrogen 2.835 N/A GLN 768.A NE2 HIS 840.A O no hydrogen 2.805 N/A ILE 769.A N LEU 765.A O no hydrogen 2.886 N/A ILE 770.A N PHE 766.A O no hydrogen 2.896 N/A SER 771.A N GLN 768.A O no hydrogen 3.157 N/A SER 771.A OG GLN 768.A O no hydrogen 2.393 N/A PHE 775.A N SER 771.A O no hydrogen 2.905 N/A ASN 776.A N GLU 772.A O no hydrogen 2.843 N/A THR 777.A N ALA 774.A O no hydrogen 3.062 N/A THR 777.A OG1 PRO 773.A O no hydrogen 2.646 N/A LEU 778.A N ALA 774.A O no hydrogen 2.883 N/A THR 780.A OG1 PHE 775.A O no hydrogen 2.476 N/A LYS 781.A N ASN 776.A O no hydrogen 3.182 N/A GLU 782.A N THR 777.A O no hydrogen 2.632 N/A SER 790.A OG ILE 770.A O no hydrogen 3.246 N/A GLY 791.A N ARG 802.A O no hydrogen 2.891 N/A ARG 793.A N GLY 800.A O no hydrogen 2.807 N/A ALA 795.A N ILE 798.A O no hydrogen 2.568 N/A ASN 796.A ND2 TYR 721.A O no hydrogen 3.083 N/A ILE 798.A N ALA 795.A O no hydrogen 2.594 N/A ARG 802.A N GLY 791.A O no hydrogen 2.676 N/A GLN 806.A N ILE 787.A O no hydrogen 2.675 N/A SER 807.A OG LEU 784.A O no hydrogen 2.799 N/A GLU 808.A N SER 807.A OG no hydrogen 2.605 N/A LYS 809.A N SER 744.A OG no hydrogen 3.247 N/A LEU 814.A N PRO 810.A O no hydrogen 2.858 N/A GLU 815.A N PRO 811.A O no hydrogen 2.788 N/A SER 816.A N HIS 812.A O no hydrogen 2.907 N/A SER 816.A OG HIS 812.A O no hydrogen 2.981 N/A ARG 817.A N TYR 813.A O no hydrogen 2.983 N/A ARG 817.A NH1 TYR 813.A OH no hydrogen 2.535 N/A VAL 818.A N LEU 814.A O no hydrogen 2.896 N/A GLU 819.A N GLU 815.A O no hydrogen 2.784 N/A ALA 820.A N SER 816.A O no hydrogen 2.845 N/A PHE 821.A N ARG 817.A O no hydrogen 2.937 N/A LEU 822.A N VAL 818.A O no hydrogen 2.858 N/A ILE 823.A N GLU 819.A O no hydrogen 2.967 N/A THR 824.A N ALA 820.A O no hydrogen 2.905 N/A THR 824.A OG1 ALA 820.A O no hydrogen 2.807 N/A MET 825.A N PHE 821.A O no hydrogen 2.930 N/A GLU 826.A N LEU 822.A O no hydrogen 2.844 N/A LYS 827.A N ILE 823.A O no hydrogen 2.943 N/A SER 828.A N THR 824.A O no hydrogen 2.863 N/A MET 832.A N SER 828.A O no hydrogen 2.763 N/A ALA 836.A N THR 833.A OG1 no hydrogen 3.346 N/A PHE 837.A N THR 833.A O no hydrogen 3.424 N/A GLN 838.A N GLU 834.A O no hydrogen 2.893 N/A GLN 838.A NE2 GLU 834.A OE2 no hydrogen 3.434 N/A LYS 839.A N GLU 835.A O no hydrogen 2.941 N/A HIS 840.A N ALA 836.A O no hydrogen 2.882 N/A HIS 840.A NE2 LEU 765.A O no hydrogen 3.061 N/A ILE 841.A N PHE 837.A O no hydrogen 2.781 N/A GLN 842.A N GLN 838.A O no hydrogen 2.952 N/A ALA 843.A N LYS 839.A O no hydrogen 2.928 N/A LEU 844.A N HIS 840.A O no hydrogen 3.062 N/A ALA 845.A N ILE 841.A O no hydrogen 2.903 N/A ILE 846.A N GLN 842.A O no hydrogen 2.925 N/A ARG 847.A N ALA 843.A O no hydrogen 2.887 N/A ARG 848.A N LEU 844.A O no hydrogen 2.734 N/A ARG 848.A NE ARG 848.A O no hydrogen 3.185 N/A LEU 849.A N ALA 845.A O no hydrogen 2.456 N/A ALA 860.A N SER 856.A O no hydrogen 3.399 N/A TYR 862.A N GLU 858.A O no hydrogen 2.833 N/A TYR 862.A OH GLU 858.A OE1 no hydrogen 2.766 N/A TRP 863.A N SER 859.A O no hydrogen 2.821 N/A GLY 864.A N ALA 860.A O no hydrogen 2.889 N/A GLU 865.A N LYS 861.A O no hydrogen 3.033 N/A ILE 866.A N TYR 862.A O no hydrogen 2.886 N/A ILE 867.A N TRP 863.A O no hydrogen 2.890 N/A SER 868.A N GLY 864.A O no hydrogen 3.287 N/A SER 868.A OG GLY 864.A O no hydrogen 2.700 N/A SER 868.A OG GLU 865.A O no hydrogen 2.982 N/A GLN 869.A N ILE 866.A O no hydrogen 2.840 N/A GLN 870.A N GLU 865.A O no hydrogen 2.740 N/A TYR 871.A OH GLN 869.A OE1 no hydrogen 2.278 N/A ASP 874.A N ASN 872.A OD1 no hydrogen 3.132 N/A ARG 875.A N ASN 872.A O no hydrogen 2.996 N/A ARG 875.A NH2 GLN 870.A O no hydrogen 3.407 N/A THR 878.A N ASP 874.A O no hydrogen 3.171 N/A THR 878.A OG1 ASP 874.A O no hydrogen 3.328 N/A GLU 879.A N ARG 875.A O no hydrogen 2.837 N/A VAL 880.A N ASP 876.A O no hydrogen 2.907 N/A ALA 881.A N ASN 877.A O no hydrogen 2.905 N/A TYR 882.A N THR 878.A O no hydrogen 2.888 N/A LEU 883.A N GLU 879.A O no hydrogen 2.792 N/A LYS 884.A N VAL 880.A O no hydrogen 2.902 N/A THR 885.A N TYR 882.A O no hydrogen 2.696 N/A THR 885.A OG1 ALA 881.A O no hydrogen 2.290 N/A THR 887.A N ASP 890.A OD2 no hydrogen 2.470 N/A LYS 888.A NZ GLU 830.A O no hydrogen 2.716 N/A LYS 888.A NZ MET 832.A O no hydrogen 2.847 N/A ASP 890.A N THR 887.A O no hydrogen 3.372 N/A ASP 890.A N THR 887.A OG1 no hydrogen 3.121 N/A ILE 891.A N LYS 888.A O no hydrogen 3.236 N/A LYS 893.A N GLU 889.A O no hydrogen 3.155 N/A PHE 894.A N ASP 890.A O no hydrogen 2.475 N/A TYR 895.A N ILE 892.A O no hydrogen 3.007 N/A LYS 896.A N ILE 892.A O no hydrogen 3.201 N/A GLU 897.A N GLU 897.A OE1 no hydrogen 2.682 N/A LEU 899.A N TYR 895.A O no hydrogen 2.829 N/A ARG 905.A N GLU 897.A O no hydrogen 3.061 N/A ARG 906.A N ALA 903.A O no hydrogen 3.353 N/A ARG 906.A NH1 ARG 729.A O no hydrogen 3.230 N/A HIS 907.A NE2 GLN 725.A OE1 no hydrogen 2.683 N/A VAL 909.A N TYR 749.A O no hydrogen 2.651 N/A SER 910.A OG VAL 909.A O no hydrogen 2.702 N/A HIS 912.A N TYR 734.A O no hydrogen 2.568 N/A VAL 913.A N GLY 745.A O no hydrogen 2.534 N/A LEU 924.A N PRO 922.A O no hydrogen 2.899 N/A PHE 936.A N ASN 932.A O no hydrogen 2.478 N/A LYS 937.A N MET 933.A O no hydrogen 2.888 N/A LYS 937.A NZ LEU 643.A O no hydrogen 3.417 N/A