Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hvr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N HIS 1.A O no hydrogen 2.697 N/A LYS 4.A NZ TYR 295.A OH no hydrogen 2.767 N/A THR 5.A N ALA 294.A O no hydrogen 3.162 N/A THR 5.A OG1 GLY 3.A O no hydrogen 3.504 N/A VAL 7.A N ALA 292.A O no hydrogen 2.820 N/A LEU 9.A N VAL 290.A O no hydrogen 3.144 N/A ARG 11.A N LEU 9.A O no hydrogen 2.679 N/A ALA 13.A N GLU 288.A O no hydrogen 3.067 N/A LEU 14.A N PHE 161.A O no hydrogen 3.016 N/A ARG 15.A N LEU 284.A O no hydrogen 2.928 N/A ARG 15.A NE GLY 283.A O no hydrogen 3.207 N/A ARG 15.A NH1 GLU 21.A OE2 no hydrogen 3.348 N/A ARG 15.A NH2 GLU 21.A OE1 no hydrogen 2.897 N/A ARG 15.A NH2 GLU 21.A OE2 no hydrogen 3.088 N/A LEU 17.A N GLY 159.A O no hydrogen 2.946 N/A ASN 18.A N GLU 21.A OE2 no hydrogen 3.046 N/A GLU 20.A N ASN 18.A OD1 no hydrogen 2.914 N/A GLU 21.A N ASN 18.A O no hydrogen 3.032 N/A GLU 21.A N ASN 18.A OD1 no hydrogen 3.236 N/A LEU 22.A N PRO 19.A O no hydrogen 3.225 N/A ARG 23.A N GLU 20.A O no hydrogen 3.010 N/A TRP 25.A N SER 64.A O no hydrogen 2.771 N/A ARG 26.A N GLY 92.A O no hydrogen 3.011 N/A LEU 27.A N LEU 62.A O no hydrogen 3.090 N/A GLU 28.A N TYR 89.A O no hydrogen 2.774 N/A VAL 30.A N ARG 87.A O no hydrogen 2.875 N/A ASP 32.A N ALA 85.A O no hydrogen 2.984 N/A GLU 39.A N GLY 36.A O no hydrogen 2.886 N/A LEU 43.A N VAL 40.A O no hydrogen 2.787 N/A LEU 44.A N VAL 40.A O no hydrogen 2.632 N/A ALA 45.A N TYR 41.A O no hydrogen 3.261 N/A GLN 46.A N LEU 43.A O no hydrogen 2.888 N/A GLN 46.A NE2 ALA 78.A O no hydrogen 3.388 N/A VAL 47.A N LEU 43.A O no hydrogen 3.082 N/A ARG 49.A N ALA 45.A O no hydrogen 3.284 N/A ARG 50.A N GLN 46.A O no hydrogen 3.235 N/A ARG 50.A NH1 THR 76.A O no hydrogen 2.776 N/A ALA 51.A N VAL 47.A O no hydrogen 2.799 N/A ALA 51.A N ALA 48.A O no hydrogen 2.912 N/A VAL 54.A N SER 66.A OG no hydrogen 3.346 N/A THR 55.A N GLY 53.A O no hydrogen 3.019 N/A THR 55.A OG1 ALA 48.A O no hydrogen 3.522 N/A VAL 56.A N ALA 63.A O no hydrogen 2.808 N/A MET 58.A N GLY 61.A O no hydrogen 2.602 N/A GLY 61.A N MET 58.A O no hydrogen 2.867 N/A LEU 62.A N LEU 27.A O no hydrogen 3.386 N/A ALA 63.A N VAL 56.A O no hydrogen 3.024 N/A SER 64.A N TRP 25.A O no hydrogen 2.803 N/A SER 64.A OG SER 66.A O no hydrogen 3.230 N/A TRP 65.A N VAL 54.A O no hydrogen 3.030 N/A TRP 65.A NE1 GLU 21.A O no hydrogen 2.851 N/A SER 66.A N SER 64.A OG no hydrogen 2.887 N/A VAL 70.A N PRO 67.A O no hydrogen 2.816 N/A LEU 71.A N PRO 68.A O no hydrogen 3.022 N/A VAL 72.A N ALA 51.A O no hydrogen 2.957 N/A THR 76.A OG1 TYR 84.A O no hydrogen 3.514 N/A ARG 79.A N GLN 82.A O no hydrogen 3.312 N/A ALA 85.A N ASP 32.A O no hydrogen 3.266 N/A TYR 86.A N GLY 75.A O no hydrogen 3.379 N/A TYR 86.A OH VAL 72.A O no hydrogen 3.308 N/A LEU 88.A N LEU 73.A O no hydrogen 2.744 N/A TYR 89.A N GLU 28.A O no hydrogen 2.842 N/A LYS 91.A N ARG 26.A O no hydrogen 2.899 N/A ARG 93.A NE ARG 23.A O no hydrogen 2.922 N/A ARG 93.A NH1 GLU 20.A O no hydrogen 3.530 N/A ARG 93.A NH1 GLU 20.A OE1 no hydrogen 2.903 N/A ARG 93.A NH1 ARG 23.A O no hydrogen 2.832 N/A ARG 93.A NH2 GLU 20.A OE1 no hydrogen 3.512 N/A LEU 96.A N LEU 22.A O no hydrogen 2.786 N/A LYS 99.A N ASP 97.A OD2 no hydrogen 3.160 N/A ASP 100.A N ASP 97.A O no hydrogen 2.979 N/A GLU 103.A N ASP 100.A OD2 no hydrogen 2.865 N/A ARG 104.A N ASP 100.A O no hydrogen 3.040 N/A SER 105.A OG GLY 102.A O no hydrogen 2.362 N/A VAL 106.A N GLU 103.A O no hydrogen 3.208 N/A SER 108.A N ARG 104.A O no hydrogen 3.046 N/A SER 108.A OG ARG 104.A O no hydrogen 3.290 N/A ALA 109.A N SER 105.A O no hydrogen 3.330 N/A LEU 110.A N VAL 106.A O no hydrogen 2.937 N/A ALA 111.A N LEU 107.A O no hydrogen 2.913 N/A ARG 112.A N SER 108.A O no hydrogen 3.066 N/A ARG 113.A N ALA 109.A O no hydrogen 3.062 N/A LEU 114.A N LEU 110.A O no hydrogen 2.686 N/A LEU 115.A N ALA 111.A O no hydrogen 2.976 N/A GLN 116.A N ARG 112.A O no hydrogen 2.937 N/A GLU 117.A N ARG 113.A O no hydrogen 2.791 N/A ARG 118.A N LEU 114.A O no hydrogen 2.845 N/A LEU 119.A N LEU 115.A O no hydrogen 3.095 N/A ARG 120.A N GLN 116.A O no hydrogen 3.091 N/A ARG 121.A NE GLU 117.A O no hydrogen 3.186 N/A LEU 122.A N LEU 119.A O no hydrogen 3.203 N/A ALA 131.A N GLU 128.A O no hydrogen 3.318 N/A VAL 132.A N ALA 149.A O no hydrogen 2.770 N/A TYR 133.A N TRP 126.A O no hydrogen 3.474 N/A HIS 137.A N VAL 145.A O no hydrogen 2.790 N/A ALA 138.A N VAL 145.A O no hydrogen 3.189 N/A ARG 144.A N LEU 172.A O no hydrogen 2.707 N/A VAL 145.A N ALA 138.A O no hydrogen 2.863 N/A ALA 149.A N VAL 132.A O no hydrogen 2.759 N/A VAL 150.A N ASP 166.A O no hydrogen 2.853 N/A LEU 151.A N LEU 130.A O no hydrogen 2.863 N/A ASP 152.A N GLU 164.A O no hydrogen 3.118 N/A TRP 154.A N LEU 162.A O no hydrogen 2.886 N/A VAL 155.A N SER 108.A OG no hydrogen 2.911 N/A SER 156.A N ALA 160.A O no hydrogen 3.320 N/A SER 156.A OG SER 158.A OG no hydrogen 3.177 N/A SER 156.A OG ALA 160.A O no hydrogen 3.209 N/A SER 158.A OG SER 156.A OG no hydrogen 3.177 N/A ALA 160.A N SER 156.A OG no hydrogen 3.333 N/A PHE 161.A N ARG 15.A O no hydrogen 3.308 N/A LEU 162.A N TRP 154.A O no hydrogen 2.691 N/A LEU 163.A N PHE 12.A O no hydrogen 2.966 N/A GLU 164.A N ASP 152.A O no hydrogen 2.778 N/A VAL 165.A N ASN 10.A O no hydrogen 3.067 N/A ASP 166.A N VAL 150.A O no hydrogen 3.108 N/A ALA 168.A N GLY 148.A O no hydrogen 2.767 N/A ARG 170.A N LEU 146.A O no hydrogen 2.835 N/A LEU 172.A N ARG 144.A O no hydrogen 2.853 N/A CYS 173.A SG PRO 253.A O no hydrogen 4.006 N/A LEU 177.A N LEU 251.A O no hydrogen 3.335 N/A GLU 178.A N SER 176.A OG no hydrogen 3.388 N/A TRP 180.A N SER 176.A O no hydrogen 3.027 N/A ALA 182.A N GLU 178.A O no hydrogen 2.727 N/A GLN 183.A N ALA 179.A O no hydrogen 2.858 N/A HIS 185.A ND1 TRP 180.A O no hydrogen 3.012 N/A VAL 191.A N TRP 200.A O no hydrogen 3.092 N/A ARG 192.A N VAL 252.A O no hydrogen 2.508 N/A ALA 194.A N LEU 250.A O no hydrogen 2.672 N/A ARG 198.A N ASP 196.A OD2 no hydrogen 2.651 N/A TRP 200.A N VAL 191.A O no hydrogen 2.608 N/A GLU 201.A N ALA 241.A O no hydrogen 3.398 N/A LEU 203.A N TRP 239.A O no hydrogen 3.112 N/A LEU 213.A N PRO 210.A O no hydrogen 3.373 N/A LEU 215.A N LEU 217.A O no hydrogen 3.082 N/A LEU 219.A N LEU 213.A O no hydrogen 3.274 N/A LEU 220.A N PRO 210.A O no hydrogen 3.354 N/A ASP 221.A N SER 218.A O no hydrogen 2.666 N/A TYR 222.A N SER 218.A O no hydrogen 2.781 N/A SER 225.A N ASP 221.A O no hydrogen 2.759 N/A LYS 226.A N TYR 222.A O no hydrogen 3.186 N/A GLY 227.A N ALA 224.A O no hydrogen 2.969 N/A ARG 228.A N HIS 223.A O no hydrogen 3.037 N/A TRP 239.A N ARG 204.A O no hydrogen 3.043 N/A VAL 240.A N ALA 238.A O no hydrogen 3.207 N/A VAL 240.A N ILE 245.A O no hydrogen 3.113 N/A THR 248.A OG1 ARG 236.A O no hydrogen 3.461 N/A VAL 252.A N ARG 192.A O no hydrogen 2.833 N/A VAL 254.A N ARG 190.A O no hydrogen 2.767 N/A ARG 267.A N TRP 264.A O no hydrogen 3.423 N/A ARG 267.A NH1 PRO 167.A O no hydrogen 3.463 N/A THR 271.A N ARG 267.A O no hydrogen 2.985 N/A THR 271.A OG1 ARG 267.A O no hydrogen 2.749 N/A ARG 272.A N ARG 268.A O no hydrogen 3.327 N/A GLU 273.A N ARG 269.A O no hydrogen 3.161 N/A ILE 274.A N ARG 270.A O no hydrogen 3.202 N/A SER 276.A N ARG 272.A O no hydrogen 2.853 N/A SER 276.A OG ARG 272.A O no hydrogen 3.308 N/A TRP 277.A N GLU 273.A O no hydrogen 2.984 N/A ILE 278.A N ILE 274.A O no hydrogen 2.880 N/A GLY 279.A N ALA 275.A O no hydrogen 2.945 N/A ARG 280.A N SER 276.A O no hydrogen 2.962 N/A ARG 281.A N TRP 277.A O no hydrogen 3.132 N/A LEU 284.A N GLY 279.A O no hydrogen 2.784 N/A GLU 288.A N ALA 13.A O no hydrogen 3.115 N/A VAL 290.A N ARG 11.A O no hydrogen 3.309 N/A ALA 292.A N VAL 7.A O no hydrogen 3.012 N/A GLN 293.A NE2 GLN 293.A O no hydrogen 3.223 N/A ALA 294.A N THR 5.A O no hydrogen 3.015 N/A ARG 296.A N GLY 3.A O no hydrogen 3.125 N/A LEU 297.A N GLY 569.A O no hydrogen 3.274 N/A MET 303.A N ALA 445.A O no hydrogen 2.971 N/A ARG 305.A N GLY 318.A O no hydrogen 3.340 N/A ARG 305.A NH2 VAL 317.A O no hydrogen 3.450 N/A VAL 308.A N LEU 302.A O no hydrogen 3.018 N/A SER 309.A OG ASP 313.A OD2 no hydrogen 3.049 N/A ALA 312.A N GLY 621.A O no hydrogen 3.030 N/A ASP 313.A N LYS 310.A O no hydrogen 2.788 N/A ALA 314.A N PRO 311.A O no hydrogen 3.008 N/A LEU 315.A N ALA 312.A O no hydrogen 3.178 N/A ARG 316.A N ASP 313.A O no hydrogen 3.265 N/A GLY 318.A N ALA 314.A O no hydrogen 2.927 N/A TYR 320.A N VAL 443.A O no hydrogen 3.206 N/A THR 325.A N SER 356.A O no hydrogen 3.413 N/A ALA 328.A N ALA 386.A O no hydrogen 2.884 N/A LEU 330.A N LEU 388.A O no hydrogen 2.881 N/A ARG 331.A NE GLY 337.A O no hydrogen 3.384 N/A ARG 331.A NH2 ASP 333.A OD1 no hydrogen 3.386 N/A LEU 332.A N LEU 390.A O no hydrogen 2.979 N/A TRP 338.A NE1 HIS 360.A O no hydrogen 2.824 N/A ARG 343.A N GLU 340.A O no hydrogen 3.249 N/A ARG 344.A N GLU 340.A O no hydrogen 3.072 N/A ALA 345.A N PHE 341.A O no hydrogen 2.814 N/A LEU 346.A N ARG 343.A O no hydrogen 3.108 N/A LEU 347.A N ARG 343.A O no hydrogen 3.036 N/A ARG 348.A N ARG 344.A O no hydrogen 3.147 N/A ALA 349.A N ALA 345.A O no hydrogen 3.409 N/A PHE 350.A N LEU 346.A O no hydrogen 2.991 N/A GLY 351.A N LEU 347.A O no hydrogen 2.638 N/A ALA 352.A N ARG 348.A O no hydrogen 2.789 N/A SER 353.A N ALA 349.A O no hydrogen 2.940 N/A GLY 354.A N PHE 350.A O no hydrogen 3.006 N/A HIS 360.A N LEU 327.A O no hydrogen 3.045 N/A LEU 362.A N LEU 329.A O no hydrogen 3.015 N/A SER 367.A N HIS 365.A ND1 no hydrogen 3.179 N/A GLN 368.A N HIS 365.A O no hydrogen 3.025 N/A GLY 369.A N PRO 366.A O no hydrogen 2.871 N/A PHE 372.A N GLY 369.A O no hydrogen 2.981 N/A ARG 373.A N LEU 370.A O no hydrogen 3.187 N/A ARG 373.A NE GLU 409.A OE2 no hydrogen 2.940 N/A GLU 374.A N LEU 370.A O no hydrogen 3.392 N/A ALA 375.A N ALA 371.A O no hydrogen 3.273 N/A LEU 376.A N PHE 372.A O no hydrogen 3.331 N/A LEU 376.A N ARG 373.A O no hydrogen 3.093 N/A ARG 377.A N ARG 373.A O no hydrogen 2.982 N/A LYS 378.A N GLU 374.A O no hydrogen 2.931 N/A ALA 379.A N ALA 375.A O no hydrogen 3.222 N/A LYS 380.A N LEU 376.A O no hydrogen 2.807 N/A GLU 381.A N ARG 377.A O no hydrogen 2.908 N/A GLU 382.A N LYS 378.A O no hydrogen 2.895 N/A GLY 383.A N LYS 380.A O no hydrogen 2.714 N/A VAL 384.A N ALA 379.A O no hydrogen 3.040 N/A GLN 385.A N ALA 326.A O no hydrogen 3.011 N/A GLN 385.A NE2 ALA 439.A O no hydrogen 3.290 N/A VAL 387.A N PRO 412.A O no hydrogen 3.189 N/A LEU 388.A N ALA 328.A O no hydrogen 2.964 N/A VAL 389.A N GLN 414.A O no hydrogen 2.990 N/A LEU 390.A N LEU 330.A O no hydrogen 2.911 N/A THR 391.A N LEU 416.A O no hydrogen 3.111 N/A THR 391.A OG1 PRO 392.A O no hydrogen 2.874 N/A ARG 399.A N ALA 395.A O no hydrogen 2.731 N/A ARG 399.A NH1 ASN 400.A OD1 no hydrogen 3.419 N/A ARG 399.A NH1 GLU 640.A OE1 no hydrogen 3.285 N/A ARG 399.A NH1 GLU 640.A OE2 no hydrogen 3.039 N/A ARG 399.A NH2 GLU 640.A OE1 no hydrogen 3.084 N/A ASN 400.A N TRP 396.A O no hydrogen 3.061 N/A ARG 401.A N GLU 397.A O no hydrogen 3.217 N/A ARG 401.A NH1 ASP 398.A OD1 no hydrogen 2.831 N/A LEU 402.A N ASP 398.A O no hydrogen 3.229 N/A LYS 403.A N ARG 399.A O no hydrogen 2.984 N/A ALA 404.A N ASN 400.A O no hydrogen 2.743 N/A LEU 405.A N ARG 401.A O no hydrogen 2.816 N/A LEU 406.A N LEU 402.A O no hydrogen 3.087 N/A LEU 407.A N LYS 403.A O no hydrogen 3.094 N/A ARG 408.A N ALA 404.A O no hydrogen 3.077 N/A ARG 408.A NE ALA 404.A O no hydrogen 3.355 N/A GLU 409.A N LEU 406.A O no hydrogen 2.669 N/A GLY 410.A N LEU 407.A O no hydrogen 2.870 N/A LEU 411.A N LEU 406.A O no hydrogen 3.093 N/A GLN 414.A N VAL 387.A O no hydrogen 3.062 N/A GLN 414.A NE2 ILE 415.A O no hydrogen 3.083 N/A LEU 416.A N VAL 389.A O no hydrogen 2.918 N/A ARG 421.A N GLU 424.A OE2 no hydrogen 2.742 N/A GLU 424.A N ARG 421.A O no hydrogen 2.756 N/A TRP 428.A N GLU 424.A O no hydrogen 3.463 N/A TRP 428.A NE1 GLU 422.A O no hydrogen 2.944 N/A GLU 429.A N ARG 425.A O no hydrogen 2.830 N/A ASN 430.A N HIS 426.A O no hydrogen 3.003 N/A ALA 431.A N ARG 427.A O no hydrogen 3.083 N/A LEU 432.A N TRP 428.A O no hydrogen 2.950 N/A LEU 433.A N GLU 429.A O no hydrogen 3.245 N/A GLY 434.A N ASN 430.A O no hydrogen 2.888 N/A LEU 435.A N ALA 431.A O no hydrogen 2.919 N/A LEU 436.A N LEU 432.A O no hydrogen 2.794 N/A ALA 437.A N LEU 433.A O no hydrogen 2.922 N/A LYS 438.A N GLY 434.A O no hydrogen 3.218 N/A LYS 438.A NZ SER 413.A O no hydrogen 2.828 N/A LYS 438.A NZ VAL 660.A O no hydrogen 3.188 N/A ALA 439.A N LEU 435.A O no hydrogen 2.812 N/A GLY 440.A N LEU 436.A O no hydrogen 3.219 N/A GLY 440.A N ALA 437.A O no hydrogen 3.274 N/A LEU 441.A N LEU 436.A O no hydrogen 3.160 N/A ALA 445.A N MET 303.A O no hydrogen 3.278 N/A SER 447.A N LYS 301.A O no hydrogen 3.106 N/A GLU 453.A N ARG 518.A O no hydrogen 3.095 N/A VAL 456.A N LEU 520.A O no hydrogen 3.022 N/A PHE 458.A N LEU 522.A O no hydrogen 2.922 N/A ASP 459.A N GLY 470.A O no hydrogen 3.053 N/A GLY 461.A N PHE 468.A O no hydrogen 2.805 N/A ARG 467.A N GLN 487.A O no hydrogen 2.899 N/A GLY 469.A N GLU 485.A O no hydrogen 2.765 N/A GLY 470.A N ASP 459.A O no hydrogen 3.383 N/A ALA 472.A N GLY 457.A O no hydrogen 3.232 N/A VAL 475.A N HIS 478.A O no hydrogen 2.998 N/A LEU 480.A N CYS 473.A O no hydrogen 3.532 N/A TRP 481.A N ARG 654.A O no hydrogen 3.180 N/A TRP 481.A NE1 LYS 656.A O no hydrogen 2.644 N/A THR 482.A OG1 ALA 471.A O no hydrogen 3.089 N/A GLU 485.A N GLY 469.A O no hydrogen 2.860 N/A GLN 487.A N ARG 467.A O no hydrogen 2.659 N/A GLN 487.A NE2 GLU 485.A O no hydrogen 3.673 N/A ARG 491.A NH1 GLN 529.A O no hydrogen 3.381 N/A ARG 491.A NH2 GLN 529.A O no hydrogen 2.740 N/A ILE 492.A N GLU 531.A OE2 no hydrogen 3.086 N/A GLN 494.A NE2 ASP 530.A O no hydrogen 2.700 N/A GLU 495.A N GLU 495.A OE1 no hydrogen 2.505 N/A VAL 497.A N PRO 493.A O no hydrogen 3.070 N/A TRP 498.A N GLN 494.A O no hydrogen 3.483 N/A ASP 499.A N GLU 495.A O no hydrogen 3.039 N/A LEU 500.A N VAL 496.A O no hydrogen 2.991 N/A LEU 501.A N VAL 497.A O no hydrogen 2.826 N/A GLU 502.A N TRP 498.A O no hydrogen 2.647 N/A GLU 503.A N ASP 499.A O no hydrogen 3.131 N/A THR 504.A N LEU 501.A O no hydrogen 2.794 N/A THR 504.A OG1 LEU 501.A O no hydrogen 2.603 N/A LEU 505.A N LEU 501.A O no hydrogen 3.039 N/A TRP 506.A N GLU 502.A O no hydrogen 2.917 N/A ALA 507.A N GLU 503.A O no hydrogen 2.838 N/A PHE 508.A N THR 504.A O no hydrogen 2.927 N/A ARG 509.A N LEU 505.A O no hydrogen 2.884 N/A ARG 509.A NE ARG 509.A O no hydrogen 2.995 N/A ARG 510.A N TRP 506.A O no hydrogen 3.041 N/A LYS 511.A N ALA 507.A O no hydrogen 3.134 N/A ALA 512.A N PHE 508.A O no hydrogen 2.802 N/A ARG 514.A NH1 GLU 453.A OE1 no hydrogen 3.046 N/A ARG 514.A NH1 GLU 453.A OE2 no hydrogen 2.880 N/A ARG 514.A NH2 GLU 453.A OE1 no hydrogen 2.621 N/A SER 517.A N GLU 453.A OE2 no hydrogen 3.454 N/A ARG 518.A NE ASP 547.A OD2 no hydrogen 3.119 N/A ARG 518.A NE THR 601.A OG1 no hydrogen 3.425 N/A VAL 519.A N ALA 545.A O no hydrogen 2.903 N/A LEU 520.A N LEU 454.A O no hydrogen 2.809 N/A LEU 521.A N ASP 547.A O no hydrogen 2.746 N/A LEU 522.A N VAL 456.A O no hydrogen 2.894 N/A ARG 523.A N VAL 549.A O no hydrogen 3.129 N/A ARG 523.A NH1 GLU 531.A OE2 no hydrogen 2.952 N/A ARG 523.A NH2 GLU 490.A O no hydrogen 3.520 N/A ASP 524.A N PHE 458.A O no hydrogen 3.101 N/A GLY 525.A N VAL 551.A O no hydrogen 2.800 N/A GLU 531.A N PRO 528.A O no hydrogen 2.975 N/A ALA 533.A N ASP 530.A O no hydrogen 3.384 N/A LEU 534.A N GLN 494.A OE1 no hydrogen 3.265 N/A LEU 536.A N PHE 532.A O no hydrogen 3.042 N/A GLU 537.A N ALA 533.A O no hydrogen 3.106 N/A ALA 538.A N LEU 534.A O no hydrogen 3.345 N/A LEU 539.A N ALA 535.A O no hydrogen 3.287 N/A ALA 540.A N LEU 536.A O no hydrogen 3.095 N/A ARG 541.A N GLU 537.A O no hydrogen 3.198 N/A GLU 542.A N ALA 538.A O no hydrogen 2.832 N/A GLY 543.A N ALA 540.A O no hydrogen 2.777 N/A ILE 544.A N LEU 539.A O no hydrogen 3.000 N/A ALA 545.A N SER 517.A O no hydrogen 2.875 N/A ASP 547.A N VAL 519.A O no hydrogen 3.090 N/A LEU 548.A N ALA 598.A O no hydrogen 2.885 N/A VAL 549.A N LEU 521.A O no hydrogen 2.963 N/A SER 550.A N VAL 595.A O no hydrogen 2.942 N/A SER 550.A OG GLY 525.A O no hydrogen 3.463 N/A VAL 551.A N ARG 523.A O no hydrogen 2.923 N/A ARG 552.A N LYS 593.A O no hydrogen 3.165 N/A ARG 558.A NE ASP 166.A OD1 no hydrogen 3.160 N/A ARG 558.A NE ASP 166.A OD2 no hydrogen 3.424 N/A ARG 558.A NH1 THR 588.A O no hydrogen 2.916 N/A TYR 560.A N PHE 8.A O no hydrogen 3.017 N/A GLY 569.A N LEU 582.A O no hydrogen 3.068 N/A TYR 571.A N TYR 295.A O no hydrogen 2.840 N/A LEU 574.A N THR 578.A O no hydrogen 3.036 N/A PHE 579.A N LEU 594.A O no hydrogen 3.220 N/A LEU 580.A N VAL 572.A O no hydrogen 2.858 N/A LEU 581.A N LEU 592.A O no hydrogen 2.995 N/A LEU 582.A N LEU 570.A O no hydrogen 3.395 N/A THR 588.A OG1 LEU 262.A O no hydrogen 3.324 N/A LEU 592.A N LEU 581.A O no hydrogen 2.949 N/A LYS 593.A N ARG 552.A O no hydrogen 2.964 N/A LEU 594.A N PHE 579.A O no hydrogen 3.062 N/A VAL 595.A N SER 550.A O no hydrogen 2.949 N/A GLU 597.A N LEU 548.A O no hydrogen 2.919 N/A THR 601.A N ASP 547.A OD1 no hydrogen 3.372 N/A THR 601.A OG1 ASP 547.A OD1 no hydrogen 2.910 N/A THR 601.A OG1 ASP 547.A OD2 no hydrogen 2.943 N/A ALA 605.A N PRO 602.A O no hydrogen 2.759 N/A LEU 606.A N PRO 602.A O no hydrogen 3.182 N/A ALA 607.A N LEU 603.A O no hydrogen 2.910 N/A HIS 608.A N GLU 604.A O no hydrogen 3.182 N/A GLN 609.A N ALA 605.A O no hydrogen 3.153 N/A GLN 609.A NE2 ALA 452.A O no hydrogen 3.151 N/A ILE 610.A N LEU 606.A O no hydrogen 2.832 N/A PHE 611.A N ALA 607.A O no hydrogen 2.862 N/A HIS 612.A N HIS 608.A O no hydrogen 2.993 N/A LEU 613.A N GLN 609.A O no hydrogen 2.863 N/A THR 614.A N PHE 611.A O no hydrogen 3.198 N/A THR 614.A OG1 ILE 610.A O no hydrogen 3.533 N/A ARG 615.A N HIS 612.A O no hydrogen 2.989 N/A ARG 615.A NH2 ASP 568.A OD1 no hydrogen 3.234 N/A ARG 615.A NH2 THR 583.A O no hydrogen 3.339 N/A LEU 616.A N LEU 613.A O no hydrogen 3.070 N/A SER 620.A OG TYR 617.A O no hydrogen 2.857 N/A PHE 622.A N SER 620.A O no hydrogen 2.993 N/A ARG 626.A NH1 ARG 590.A O no hydrogen 2.857 N/A ALA 629.A N LEU 613.A O no hydrogen 3.282 N/A HIS 632.A N PRO 628.A O no hydrogen 2.786 N/A LEU 633.A N ALA 629.A O no hydrogen 2.758 N/A ALA 634.A N PRO 630.A O no hydrogen 2.941 N/A ASP 635.A N LEU 631.A O no hydrogen 3.175 N/A ARG 636.A N HIS 632.A O no hydrogen 3.366 N/A LEU 637.A N LEU 633.A O no hydrogen 3.048 N/A VAL 638.A N ALA 634.A O no hydrogen 3.067 N/A LYS 639.A N ASP 635.A O no hydrogen 2.841 N/A LYS 639.A NZ ASP 635.A OD1 no hydrogen 3.401 N/A GLU 640.A N ARG 636.A O no hydrogen 2.820 N/A VAL 641.A N LEU 637.A O no hydrogen 2.933 N/A GLY 642.A N VAL 638.A O no hydrogen 3.223 N/A ARG 643.A N LYS 639.A O no hydrogen 2.966 N/A LEU 644.A N GLU 640.A O no hydrogen 2.855 N/A LEU 649.A N ILE 646.A O no hydrogen 3.348 N/A LYS 656.A N ASP 653.A O no hydrogen 3.027 N/A LYS 656.A NZ GLN 385.A O no hydrogen 3.284 N/A LEU 657.A N ALA 437.A O no hydrogen 3.486 N/A