Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cf1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N ARG 2.A O no hydrogen 3.369 N/A ASN 16.A ND2 TYR 118.A OH no hydrogen 3.535 N/A ASN 16.A ND2 LEU 133.A O no hydrogen 2.742 N/A VAL 19.A N ILE 50.A O no hydrogen 2.746 N/A LEU 21.A N LEU 52.A O no hydrogen 2.859 N/A SER 22.A OG ASP 59.A OD1 no hydrogen 2.522 N/A LYS 25.A N SER 22.A O no hydrogen 3.001 N/A LYS 25.A NZ GLU 28.A OE1 no hydrogen 2.940 N/A MET 26.A N SER 22.A O no hydrogen 3.192 N/A ASP 27.A N GLN 23.A O no hydrogen 3.438 N/A GLU 28.A N LYS 25.A O no hydrogen 2.830 N/A LEU 29.A N LYS 25.A O no hydrogen 3.186 N/A LEU 29.A N MET 26.A O no hydrogen 2.776 N/A LEU 31.A N MET 26.A O no hydrogen 3.255 N/A THR 36.A OG1 CYS 85.A O no hydrogen 3.340 N/A VAL 37.A N CYS 49.A O no hydrogen 2.963 N/A LEU 38.A N GLN 83.A O no hydrogen 2.495 N/A LEU 39.A N ALA 47.A O no hydrogen 2.989 N/A ARG 44.A N GLY 41.A O no hydrogen 3.011 N/A ARG 45.A NH2 GLY 129.A O no hydrogen 3.030 N/A ALA 47.A N LEU 39.A O no hydrogen 2.980 N/A THR 56.A OG1 ASP 54.A OD1 no hydrogen 2.695 N/A CYS 57.A SG SER 58.A O no hydrogen 3.376 N/A CYS 57.A SG LYS 61.A O no hydrogen 4.037 N/A LYS 61.A NZ ASP 9.A OD1 no hydrogen 3.137 N/A ILE 62.A N ILE 7.A O no hydrogen 2.922 N/A ARG 63.A N SER 20.A O no hydrogen 3.042 N/A ARG 63.A NH2 THR 56.A O no hydrogen 2.608 N/A MET 64.A N GLU 10.A O no hydrogen 3.078 N/A ASN 65.A ND2 ASP 15.A O no hydrogen 2.630 N/A ARG 66.A NH1 GLU 180.A O no hydrogen 2.759 N/A ARG 66.A NH2 ASP 184.A OD1 no hydrogen 2.738 N/A VAL 68.A N ASN 65.A OD1 no hydrogen 2.994 N/A ARG 69.A N ASN 65.A O no hydrogen 2.938 N/A ASN 70.A N ARG 66.A O no hydrogen 2.570 N/A ASN 71.A N VAL 67.A O no hydrogen 3.069 N/A LEU 72.A N ARG 69.A O no hydrogen 2.824 N/A ARG 73.A N ASN 70.A O no hydrogen 2.629 N/A ARG 73.A NH1 ASN 70.A O no hydrogen 2.713 N/A VAL 74.A N ARG 69.A O no hydrogen 3.498 N/A ARG 75.A NH1 GLU 176.A OE1 no hydrogen 2.689 N/A ARG 75.A NH2 GLU 176.A OE1 no hydrogen 2.853 N/A ARG 75.A NH2 GLU 176.A OE2 no hydrogen 2.815 N/A SER 81.A OG SER 81.A O no hydrogen 2.619 N/A CYS 85.A N THR 36.A O no hydrogen 3.358 N/A CYS 85.A SG ASP 87.A OD1 no hydrogen 2.843 N/A CYS 85.A SG TYR 153.A OH no hydrogen 3.894 N/A LYS 89.A N ASP 87.A O no hydrogen 2.769 N/A GLY 91.A N ILE 155.A O no hydrogen 2.649 N/A LYS 92.A NZ TYR 90.A O no hydrogen 3.462 N/A HIS 95.A N GLU 147.A O no hydrogen 2.859 N/A VAL 96.A N HIS 163.A O no hydrogen 3.390 N/A LEU 97.A N LYS 144.A O no hydrogen 3.285 N/A ILE 99.A N GLU 142.A O no hydrogen 3.183 N/A THR 102.A N ILE 99.A O no hydrogen 2.968 N/A THR 102.A OG1 ILE 99.A O no hydrogen 2.807 N/A ILE 106.A N VAL 103.A O no hydrogen 3.100 N/A GLU 112.A N ASN 109.A OD1 no hydrogen 2.594 N/A VAL 113.A N ASN 109.A O no hydrogen 3.173 N/A TYR 114.A N LEU 110.A O no hydrogen 3.179 N/A LEU 115.A N LEU 110.A O no hydrogen 3.379 N/A TYR 118.A N LEU 115.A O no hydrogen 3.051 N/A PHE 119.A N LEU 115.A O no hydrogen 3.023 N/A ARG 124.A NE TYR 118.A O no hydrogen 3.111 N/A ARG 124.A NH1 ASP 15.A OD2 no hydrogen 2.750 N/A LYS 128.A N PRO 152.A O no hydrogen 3.106 N/A GLY 129.A N VAL 145.A O no hydrogen 3.292 N/A ASP 130.A N ARG 127.A O no hydrogen 3.396 N/A VAL 134.A N VAL 141.A O no hydrogen 3.234 N/A GLY 136.A N ARG 139.A O no hydrogen 3.304 N/A MET 138.A N ASN 367.A O no hydrogen 2.632 N/A ARG 139.A N GLY 136.A O no hydrogen 3.134 N/A ARG 139.A NH2 GLU 104.A O no hydrogen 3.344 N/A VAL 141.A N VAL 134.A O no hydrogen 3.330 N/A PHE 143.A N PHE 132.A O no hydrogen 3.135 N/A LYS 144.A N LEU 97.A O no hydrogen 3.199 N/A LYS 144.A NZ GLY 129.A O no hydrogen 2.467 N/A LYS 144.A NZ GLU 175.A OE2 no hydrogen 2.510 N/A VAL 145.A N ASP 130.A O no hydrogen 3.349 N/A VAL 146.A N HIS 95.A O no hydrogen 2.835 N/A THR 148.A OG1 PRO 152.A O no hydrogen 3.474 N/A ASP 149.A N ARG 93.A O no hydrogen 3.044 N/A SER 151.A N ASP 149.A O no hydrogen 2.660 N/A CYS 154.A SG THR 148.A OG1 no hydrogen 3.468 N/A ALA 157.A N THR 160.A OG1 no hydrogen 2.949 N/A THR 160.A N ALA 157.A O no hydrogen 2.789 N/A THR 160.A OG1 GLY 91.A O no hydrogen 2.981 N/A THR 160.A OG1 ALA 157.A O no hydrogen 3.402 N/A VAL 161.A N LYS 92.A O no hydrogen 2.989 N/A HIS 163.A N ILE 94.A O no hydrogen 2.713 N/A HIS 163.A ND1 HIS 95.A NE2 no hydrogen 3.128 N/A ARG 171.A NH2 ASP 101.A OD1 no hydrogen 2.842 N/A ARG 171.A NH2 GLU 142.A OE2 no hydrogen 3.068 N/A GLU 172.A N GLU 175.A OE1 no hydrogen 3.364 N/A SER 177.A OG GLU 142.A OE2 no hydrogen 3.224 N/A LEU 178.A N GLU 142.A OE1 no hydrogen 3.060 N/A ASN 179.A N SER 177.A OG no hydrogen 3.236 N/A GLU 180.A N SER 177.A O no hydrogen 2.737 N/A TYR 183.A N GLU 241.A OE1 no hydrogen 3.323 N/A ASP 185.A N GLY 182.A O no hydrogen 3.301 N/A CYS 189.A SG GLY 187.A O no hydrogen 3.051 N/A ARG 190.A NH2 GLU 359.A OE1 no hydrogen 3.065 N/A LEU 193.A N CYS 189.A O no hydrogen 3.069 N/A LYS 197.A N LEU 193.A O no hydrogen 2.769 N/A LYS 197.A NZ GLU 10.A OE2 no hydrogen 2.669 N/A GLU 198.A N ALA 194.A O no hydrogen 3.407 N/A MET 199.A N ILE 196.A O no hydrogen 2.828 N/A VAL 200.A N LYS 197.A O no hydrogen 3.131 N/A LEU 204.A N VAL 200.A O no hydrogen 3.023 N/A ARG 205.A NH2 ASP 78.A OD2 no hydrogen 2.631 N/A HIS 206.A N LEU 202.A O no hydrogen 3.018 N/A LEU 209.A N HIS 206.A O no hydrogen 2.567 N/A LYS 211.A N ALA 208.A O no hydrogen 2.881 N/A ILE 221.A N VAL 323.A O no hydrogen 3.268 N/A LEU 222.A N ARG 345.A O no hydrogen 3.213 N/A LEU 223.A N ALA 325.A O no hydrogen 2.782 N/A TYR 224.A N VAL 347.A O no hydrogen 3.201 N/A TYR 224.A OH GLU 346.A OE2 no hydrogen 2.844 N/A THR 229.A N PRO 226.A O no hydrogen 3.075 N/A THR 229.A OG1 ILE 349.A O no hydrogen 3.245 N/A LYS 231.A NZ GLY 225.A O no hydrogen 2.930 N/A ILE 234.A N LYS 231.A O no hydrogen 2.951 N/A ARG 236.A N THR 232.A O no hydrogen 3.131 N/A ALA 237.A N LEU 233.A O no hydrogen 3.011 N/A VAL 238.A N ILE 234.A O no hydrogen 2.914 N/A ALA 239.A N ALA 235.A O no hydrogen 3.300 N/A ASN 240.A N ARG 236.A O no hydrogen 3.000 N/A GLU 241.A N VAL 238.A O no hydrogen 3.092 N/A THR 242.A N VAL 238.A O no hydrogen 3.177 N/A THR 242.A N ALA 239.A O no hydrogen 2.930 N/A THR 242.A OG1 VAL 238.A O no hydrogen 3.336 N/A THR 242.A OG1 ALA 239.A O no hydrogen 3.154 N/A GLY 243.A N ALA 239.A O no hydrogen 2.597 N/A ALA 244.A N THR 242.A OG1 no hydrogen 3.386 N/A PHE 245.A N PRO 278.A O no hydrogen 3.398 N/A ILE 249.A N PHE 282.A O no hydrogen 3.005 N/A ILE 254.A N ASN 250.A O no hydrogen 3.375 N/A MET 255.A N PRO 252.A O no hydrogen 2.836 N/A SER 256.A N PRO 252.A O no hydrogen 2.786 N/A SER 256.A OG PRO 252.A O no hydrogen 3.388 N/A SER 256.A OG GLU 253.A O no hydrogen 2.904 N/A GLU 261.A N ALA 259.A O no hydrogen 2.605 N/A SER 262.A OG ILE 254.A O no hydrogen 2.947 N/A GLU 263.A N GLY 260.A O no hydrogen 3.038 N/A ASN 265.A N GLU 261.A O no hydrogen 2.574 N/A LEU 266.A N SER 262.A O no hydrogen 3.224 N/A ARG 267.A N GLU 263.A O no hydrogen 2.772 N/A LYS 268.A N SER 264.A O no hydrogen 2.630 N/A LYS 268.A NZ GLU 271.A OE1 no hydrogen 2.899 N/A ALA 269.A N ASN 265.A O no hydrogen 2.825 N/A PHE 270.A N LEU 266.A O no hydrogen 2.923 N/A GLU 272.A N LYS 268.A O no hydrogen 2.490 N/A ALA 273.A N ALA 269.A O no hydrogen 2.810 N/A GLU 274.A N PHE 270.A O no hydrogen 3.152 N/A GLU 274.A N GLU 271.A O no hydrogen 3.165 N/A ALA 277.A N GLU 274.A O no hydrogen 3.213 N/A ILE 280.A N PHE 245.A O no hydrogen 3.095 N/A PHE 282.A N PHE 247.A O no hydrogen 2.986 N/A ILE 283.A N MET 324.A O no hydrogen 2.756 N/A ASP 284.A N ILE 249.A O no hydrogen 2.929 N/A LEU 286.A N ALA 326.A O no hydrogen 3.236 N/A ALA 288.A N GLU 285.A O no hydrogen 2.793 N/A ILE 289.A N LEU 286.A O no hydrogen 2.766 N/A LYS 292.A N ALA 290.A O no hydrogen 2.686 N/A THR 296.A OG1 GLY 298.A O no hydrogen 2.824 N/A ARG 302.A N GLU 299.A O no hydrogen 3.182 N/A ARG 303.A N GLU 299.A O no hydrogen 3.262 N/A ARG 303.A NH2 GLU 299.A OE2 no hydrogen 3.289 N/A ILE 304.A N VAL 300.A O no hydrogen 2.958 N/A SER 306.A N ARG 302.A O no hydrogen 3.196 N/A SER 306.A OG ARG 302.A O no hydrogen 3.524 N/A GLN 307.A N ARG 303.A O no hydrogen 3.272 N/A GLN 307.A NE2 GLU 263.A O no hydrogen 2.515 N/A LEU 308.A N ILE 304.A O no hydrogen 3.481 N/A LEU 309.A N VAL 305.A O no hydrogen 2.947 N/A THR 310.A N SER 306.A O no hydrogen 2.928 N/A THR 310.A OG1 SER 306.A O no hydrogen 3.417 N/A LEU 311.A N GLN 307.A O no hydrogen 3.094 N/A MET 312.A N LEU 308.A O no hydrogen 2.857 N/A GLY 314.A N LEU 311.A O no hydrogen 3.046 N/A LEU 315.A N MET 312.A O no hydrogen 2.830 N/A GLN 317.A N GLY 314.A O no hydrogen 3.269 N/A ALA 319.A N GLN 317.A O no hydrogen 2.635 N/A ILE 322.A N ALA 279.A O no hydrogen 3.188 N/A VAL 323.A N ARG 219.A O no hydrogen 3.082 N/A MET 324.A N ILE 281.A O no hydrogen 2.986 N/A ALA 325.A N ILE 221.A O no hydrogen 3.048 N/A ALA 326.A N ILE 283.A O no hydrogen 3.294 N/A THR 327.A N LEU 223.A O no hydrogen 2.902 N/A THR 327.A OG1 ASP 287.A OD2 no hydrogen 2.775 N/A SER 332.A N ARG 329.A O no hydrogen 3.328 N/A ALA 336.A N ASP 334.A OD2 no hydrogen 3.168 N/A LEU 337.A N ASP 334.A O no hydrogen 2.989 N/A ARG 338.A N PRO 335.A O no hydrogen 2.802 N/A ARG 338.A NH2 PRO 330.A O no hydrogen 3.318 N/A ARG 342.A N ARG 339.A O no hydrogen 2.803 N/A ARG 342.A NE ASP 313.A OD1 no hydrogen 3.379 N/A PHE 343.A N LEU 337.A O no hydrogen 3.182 N/A ARG 345.A N GLY 220.A O no hydrogen 3.382 N/A VAL 347.A N LEU 222.A O no hydrogen 3.077 N/A GLY 356.A N ASP 353.A OD1 no hydrogen 3.049 N/A ARG 357.A N ASP 353.A O no hydrogen 2.998 N/A ARG 357.A NE ALA 380.A O no hydrogen 3.260 N/A ARG 357.A NH2 ALA 380.A O no hydrogen 3.221 N/A GLU 359.A N THR 355.A O no hydrogen 3.275 N/A ILE 360.A N GLY 356.A O no hydrogen 2.857 N/A LEU 361.A N ARG 357.A O no hydrogen 3.033 N/A GLN 362.A N LEU 358.A O no hydrogen 3.462 N/A ILE 363.A N ILE 360.A O no hydrogen 2.555 N/A HIS 364.A N LEU 361.A O no hydrogen 2.821 N/A THR 365.A N LEU 361.A O no hydrogen 2.916 N/A THR 365.A OG1 LEU 361.A O no hydrogen 2.789 N/A VAL 374.A N ALA 371.A O no hydrogen 2.959 N/A GLN 378.A N ASP 375.A OD1 no hydrogen 2.625 N/A GLN 378.A NE2 GLU 382.A OE2 no hydrogen 3.250 N/A VAL 379.A N LEU 376.A O no hydrogen 3.208 N/A ASN 381.A N GLN 378.A O no hydrogen 2.912 N/A GLU 382.A N VAL 379.A O no hydrogen 2.745 N/A THR 383.A N VAL 379.A O no hydrogen 3.288 N/A THR 383.A OG1 THR 383.A O no hydrogen 2.639 N/A VAL 387.A N ASP 390.A OD2 no hydrogen 3.101 N/A LEU 391.A N VAL 387.A O no hydrogen 3.005 N/A ALA 392.A N ALA 389.A O no hydrogen 2.711 N/A CYS 395.A N ALA 392.A O no hydrogen 2.846 N/A CYS 395.A SG LEU 391.A O no hydrogen 4.020 N/A SER 396.A N ALA 392.A O no hydrogen 3.411 N/A GLU 397.A N ALA 393.A O no hydrogen 2.649 N/A ALA 398.A N LEU 394.A O no hydrogen 2.929 N/A ALA 399.A N CYS 395.A O no hydrogen 2.720 N/A LEU 400.A N SER 396.A O no hydrogen 3.164 N/A GLN 401.A N GLU 397.A O no hydrogen 2.947 N/A GLN 401.A N ALA 398.A O no hydrogen 3.071 N/A ALA 402.A N ALA 398.A O no hydrogen 3.340 N/A ILE 403.A N LEU 400.A O no hydrogen 3.295 N/A ARG 404.A N LEU 400.A O no hydrogen 2.887 N/A LYS 405.A NZ ASP 431.A OD1 no hydrogen 3.320 N/A ILE 410.A N LYS 406.A O no hydrogen 3.189 N/A ASP 411.A N MET 407.A O no hydrogen 2.376 N/A THR 416.A OG1 GLY 105.A O no hydrogen 2.536 N/A ALA 419.A N THR 107.A O no hydrogen 2.666 N/A VAL 421.A N ASP 418.A OD2 no hydrogen 3.181 N/A ASN 423.A N ALA 419.A O no hydrogen 3.455 N/A SER 424.A N GLU 420.A O no hydrogen 3.292 N/A SER 424.A N VAL 421.A O no hydrogen 2.910 N/A SER 424.A OG VAL 421.A O no hydrogen 2.407 N/A LEU 425.A N VAL 421.A O no hydrogen 3.045 N/A LEU 425.A N MET 422.A O no hydrogen 2.774 N/A THR 428.A OG1 ASP 431.A OD2 no hydrogen 2.991 N/A MET 429.A N ASP 373.A OD2 no hydrogen 3.077 N/A ASP 431.A N THR 428.A O no hydrogen 3.255 N/A ARG 433.A N MET 429.A O no hydrogen 3.019 N/A TRP 434.A N ASP 431.A O no hydrogen 2.856 N/A ALA 435.A N ASP 431.A O no hydrogen 3.310 N/A LEU 436.A N PHE 432.A O no hydrogen 2.861 N/A SER 437.A N ARG 433.A O no hydrogen 3.190 N/A SER 437.A OG ARG 433.A O no hydrogen 3.058 N/A GLN 438.A N ALA 435.A O no hydrogen 2.975 N/A SER 439.A N ALA 435.A O no hydrogen 3.224 N/A SER 442.A N ASN 440.A O no hydrogen 2.492 N/A SER 442.A OG LEU 444.A O no hydrogen 3.458 N/A ALA 443.A N ASP 390.A OD1 no hydrogen 3.125 N/A ALA 443.A N ASP 390.A OD2 no hydrogen 3.078 N/A THR 447.A OG1 GLU 446.A OE1 no hydrogen 3.511 N/A GLN 453.A N GLN 453.A OE1 no hydrogen 2.425 N/A THR 455.A OG1 GLU 457.A OE1 no hydrogen 3.115 N/A GLU 457.A N THR 455.A OG1 no hydrogen 3.128 N/A VAL 465.A N LEU 462.A O no hydrogen 3.266 N/A LYS 466.A NZ TRP 456.A O no hydrogen 3.488 N/A LYS 466.A NZ GLU 463.A OE1 no hydrogen 2.854 N/A LYS 466.A NZ GLU 463.A OE2 no hydrogen 2.683 N/A GLU 468.A N ASP 464.A O no hydrogen 3.316 N/A LEU 469.A N VAL 465.A O no hydrogen 2.904 N/A GLN 470.A N LYS 466.A O no hydrogen 3.398 N/A GLU 471.A N GLU 468.A O no hydrogen 2.795 N/A LEU 472.A N LEU 469.A O no hydrogen 2.945 N/A VAL 473.A N LEU 469.A O no hydrogen 3.362 N/A GLN 474.A N GLN 470.A O no hydrogen 2.889 N/A TYR 475.A N GLN 470.A O no hydrogen 3.160 N/A VAL 477.A N GLN 474.A O no hydrogen 2.795 N/A GLU 478.A N GLN 474.A O no hydrogen 2.654 N/A LYS 482.A N HIS 479.A O no hydrogen 2.917 N/A PHE 483.A N HIS 479.A O no hydrogen 3.029 N/A LEU 484.A N PRO 480.A O no hydrogen 3.243 N/A LYS 485.A N LYS 482.A O no hydrogen 3.136 N/A LYS 492.A NZ MET 584.A O no hydrogen 2.429 N/A GLY 493.A N ARG 614.A O no hydrogen 3.028 N/A LEU 495.A N GLN 617.A O no hydrogen 3.092 N/A PHE 496.A N GLY 597.A O no hydrogen 2.745 N/A TYR 497.A N ILE 619.A O no hydrogen 3.296 N/A CYS 502.A SG PRO 499.A O no hydrogen 3.243 N/A CYS 502.A SG PRO 500.A O no hydrogen 3.502 N/A CYS 502.A SG PRO 622.A O no hydrogen 3.909 N/A LYS 504.A NZ ILE 621.A O no hydrogen 2.853 N/A LEU 507.A N GLY 503.A O no hydrogen 2.955 N/A LEU 507.A N LYS 504.A O no hydrogen 2.913 N/A ALA 508.A N LYS 504.A O no hydrogen 3.279 N/A LYS 509.A N THR 505.A O no hydrogen 2.855 N/A ALA 510.A N LEU 506.A O no hydrogen 2.776 N/A ILE 511.A N LEU 507.A O no hydrogen 2.643 N/A ASN 513.A N ALA 510.A O no hydrogen 2.896 N/A GLU 514.A N ALA 510.A O no hydrogen 3.260 N/A CYS 515.A SG ILE 511.A O no hydrogen 3.671 N/A GLN 516.A N ASN 513.A O no hydrogen 2.595 N/A ALA 517.A N ALA 512.A O no hydrogen 2.767 N/A ASN 518.A N PRO 551.A O no hydrogen 3.345 N/A ASN 518.A ND2 PRO 551.A O no hydrogen 3.061 N/A PHE 519.A N GLU 450.A O no hydrogen 2.838 N/A ILE 520.A N VAL 553.A O no hydrogen 3.248 N/A ILE 522.A N PHE 555.A O no hydrogen 3.046 N/A LEU 527.A N GLY 524.A O no hydrogen 2.711 N/A LEU 528.A N GLY 524.A O no hydrogen 3.017 N/A THR 529.A N PRO 525.A O no hydrogen 2.804 N/A THR 529.A OG1 PRO 525.A O no hydrogen 2.795 N/A MET 530.A N GLU 526.A O no hydrogen 3.332 N/A MET 530.A N LEU 527.A O no hydrogen 2.824 N/A TRP 531.A N LEU 527.A O no hydrogen 2.954 N/A PHE 532.A N LEU 528.A O no hydrogen 2.727 N/A GLY 533.A N MET 530.A O no hydrogen 3.290 N/A GLU 534.A N TRP 531.A O no hydrogen 2.973 N/A SER 535.A N MET 530.A O no hydrogen 3.135 N/A GLU 536.A N GLU 536.A OE1 no hydrogen 2.388 N/A ASN 538.A N SER 535.A O no hydrogen 3.508 N/A VAL 539.A N GLU 536.A O no hydrogen 2.735 N/A ARG 540.A N ALA 537.A O no hydrogen 2.987 N/A ARG 540.A NH1 GLU 583.A OE2 no hydrogen 2.750 N/A ILE 542.A N VAL 539.A O no hydrogen 2.980 N/A PHE 543.A N VAL 539.A O no hydrogen 3.058 N/A ALA 546.A N ILE 542.A O no hydrogen 3.052 N/A ARG 547.A N ASP 544.A O no hydrogen 2.777 N/A GLN 548.A N ASP 544.A O no hydrogen 2.700 N/A CYS 552.A SG ASN 518.A O no hydrogen 3.807 N/A VAL 553.A N ASN 518.A O no hydrogen 2.856 N/A LEU 554.A N PHE 594.A O no hydrogen 3.168 N/A PHE 555.A N ILE 520.A O no hydrogen 3.025 N/A PHE 556.A N ILE 596.A O no hydrogen 3.374 N/A SER 561.A N GLU 558.A O no hydrogen 2.334 N/A SER 561.A OG GLY 524.A O no hydrogen 3.451 N/A SER 561.A OG GLU 558.A O no hydrogen 2.690 N/A LYS 564.A N ASP 560.A O no hydrogen 2.494 N/A LYS 564.A NZ GLU 558.A OE2 no hydrogen 2.750 N/A LYS 564.A NZ ASN 600.A OD1 no hydrogen 3.319 N/A ALA 565.A N ILE 562.A O no hydrogen 3.148 N/A ARG 566.A N ILE 562.A O no hydrogen 3.381 N/A ARG 566.A NH1 ALA 573.A O no hydrogen 3.019 N/A ARG 566.A NH1 ASP 574.A OD2 no hydrogen 3.427 N/A ARG 575.A NH1 GLU 536.A OE2 no hydrogen 2.531 N/A VAL 576.A N ASP 574.A OD1 no hydrogen 3.070 N/A ASN 578.A N ASP 574.A O no hydrogen 2.698 N/A GLN 579.A N ARG 575.A O no hydrogen 3.334 N/A ILE 580.A N VAL 576.A O no hydrogen 2.982 N/A ILE 580.A N ILE 577.A O no hydrogen 3.135 N/A LEU 581.A N ASN 578.A O no hydrogen 2.715 N/A THR 582.A N ASN 578.A O no hydrogen 3.305 N/A GLU 583.A N GLN 579.A O no hydrogen 3.347 N/A MET 584.A N LEU 581.A O no hydrogen 3.043 N/A ASP 585.A N LEU 581.A O no hydrogen 2.740 N/A ASP 585.A N THR 582.A O no hydrogen 2.755 N/A GLY 586.A N THR 582.A O no hydrogen 3.030 N/A LYS 591.A N SER 588.A O no hydrogen 3.263 N/A PHE 594.A N CYS 552.A O no hydrogen 3.174 N/A ILE 596.A N LEU 554.A O no hydrogen 2.800 N/A GLY 597.A N VAL 494.A O no hydrogen 3.204 N/A THR 599.A N PHE 496.A O no hydrogen 2.968 N/A THR 599.A OG1 ASP 560.A OD1 no hydrogen 2.689 N/A ARG 601.A N THR 599.A OG1 no hydrogen 2.936 N/A ARG 601.A NH1 ASP 603.A OD1 no hydrogen 3.566 N/A ILE 604.A N ARG 601.A O no hydrogen 3.406 N/A ALA 608.A N ASP 606.A OD1 no hydrogen 2.690 N/A ILE 609.A N ASP 606.A O no hydrogen 3.036 N/A LEU 610.A N PRO 607.A O no hydrogen 3.161 N/A ARG 611.A N PRO 607.A O no hydrogen 3.228 N/A GLY 613.A N ASP 616.A OD2 no hydrogen 3.227 N/A ARG 614.A N ARG 611.A O no hydrogen 3.291 N/A ARG 614.A NE ASP 585.A OD1 no hydrogen 3.144 N/A ARG 614.A NH1 ALA 608.A O no hydrogen 2.780 N/A ARG 614.A NH2 ASP 585.A OD1 no hydrogen 3.116 N/A LEU 615.A N ILE 609.A O no hydrogen 2.854 N/A GLN 617.A NE2 ASP 616.A OD1 no hydrogen 2.923 N/A ILE 619.A N LEU 495.A O no hydrogen 3.271 N/A TYR 620.A OH GLU 712.A OE2 no hydrogen 2.323 N/A ILE 621.A N TYR 497.A O no hydrogen 3.436 N/A LYS 627.A N ASP 625.A OD2 no hydrogen 3.199 N/A ARG 629.A N ASP 625.A O no hydrogen 2.864 N/A ARG 629.A NE ALA 652.A O no hydrogen 3.169 N/A ARG 629.A NH2 ASN 656.A O no hydrogen 3.461 N/A VAL 630.A N LYS 627.A O no hydrogen 2.933 N/A ILE 632.A N SER 628.A O no hydrogen 2.702 N/A LEU 633.A N ARG 629.A O no hydrogen 3.166 N/A LEU 633.A N VAL 630.A O no hydrogen 2.682 N/A LYS 634.A N VAL 630.A O no hydrogen 3.035 N/A ALA 635.A N ILE 632.A O no hydrogen 3.324 N/A ASN 636.A N ILE 632.A O no hydrogen 2.873 N/A ASN 636.A N LEU 633.A O no hydrogen 2.827 N/A VAL 642.A N SER 640.A O no hydrogen 2.481 N/A ALA 643.A N ILE 687.A O no hydrogen 3.165 N/A PHE 650.A N ASP 647.A OD1 no hydrogen 2.728 N/A ALA 652.A N LEU 648.A O no hydrogen 2.754 N/A LYS 653.A N PHE 650.A O no hydrogen 3.294 N/A MET 654.A N LEU 651.A O no hydrogen 2.746 N/A THR 655.A N LEU 651.A O no hydrogen 3.346 N/A SER 659.A N ASP 662.A OD2 no hydrogen 3.107 N/A SER 659.A OG GLY 501.A O no hydrogen 2.965 N/A SER 659.A OG ASP 662.A OD2 no hydrogen 2.965 N/A ALA 661.A N GLY 501.A O no hydrogen 2.871 N/A ALA 661.A N SER 659.A OG no hydrogen 3.363 N/A LEU 663.A N SER 659.A O no hydrogen 2.805 N/A THR 664.A N GLY 660.A O no hydrogen 3.370 N/A THR 664.A OG1 GLY 660.A O no hydrogen 2.709 N/A GLU 665.A N ALA 661.A O no hydrogen 2.893 N/A ILE 666.A N ASP 662.A O no hydrogen 3.108 N/A CYS 667.A N LEU 663.A O no hydrogen 3.167 N/A CYS 667.A SG LEU 663.A O no hydrogen 3.170 N/A GLN 668.A N THR 664.A O no hydrogen 3.038 N/A ARG 669.A N GLU 665.A O no hydrogen 3.126 N/A ALA 670.A N ILE 666.A O no hydrogen 3.106 N/A ALA 670.A N CYS 667.A O no hydrogen 2.649 N/A CYS 671.A N GLN 668.A O no hydrogen 2.934 N/A LYS 672.A N GLN 668.A O no hydrogen 2.853 N/A ILE 675.A N CYS 671.A O no hydrogen 2.724 N/A GLU 677.A N ALA 674.A O no hydrogen 3.253 N/A SER 678.A N ALA 674.A O no hydrogen 3.358 N/A SER 678.A OG GLU 682.A OE2 no hydrogen 2.917 N/A ILE 679.A N ILE 675.A O no hydrogen 2.927 N/A GLU 680.A N ARG 676.A O no hydrogen 3.276 N/A SER 681.A N GLU 677.A O no hydrogen 3.073 N/A SER 681.A OG GLU 677.A O no hydrogen 2.752 N/A SER 681.A OG SER 678.A O no hydrogen 3.435 N/A GLU 682.A N SER 678.A O no hydrogen 3.232 N/A GLU 686.A N VAL 684.A O no hydrogen 3.119 N/A ILE 687.A N PRO 641.A O no hydrogen 3.060 N/A ARG 688.A NH1 GLU 686.A O no hydrogen 3.469 N/A ARG 689.A N ASP 645.A OD2 no hydrogen 3.312 N/A ARG 689.A NH1 ASP 645.A O no hydrogen 3.233 N/A ARG 689.A NH2 ASP 645.A O no hydrogen 2.781 N/A HIS 691.A N ARG 688.A O no hydrogen 3.086 N/A PHE 692.A N ARG 688.A O no hydrogen 3.462 N/A GLU 693.A N ARG 689.A O no hydrogen 2.853 N/A GLU 694.A N ASP 690.A O no hydrogen 2.891 N/A ALA 695.A N PHE 692.A O no hydrogen 2.978 N/A MET 696.A N PHE 692.A O no hydrogen 3.149 N/A MET 696.A N GLU 693.A O no hydrogen 3.010 N/A PHE 698.A N ALA 695.A O no hydrogen 3.125 N/A ALA 699.A N MET 696.A O no hydrogen 2.884 N/A ARG 701.A NH2 VAL 703.A O no hydrogen 3.465 N/A SER 702.A N ASP 662.A OD1 no hydrogen 3.316 N/A SER 702.A OG ASP 662.A OD1 no hydrogen 2.990 N/A SER 702.A OG ASP 662.A OD2 no hydrogen 2.280 N/A SER 704.A OG ASP 707.A OD2 no hydrogen 2.631 N/A ILE 708.A N SER 704.A O no hydrogen 2.989 N/A ARG 709.A N ASN 706.A O no hydrogen 3.300 N/A LYS 710.A N ASN 706.A O no hydrogen 3.297 N/A LYS 710.A NZ ASP 707.A OD1 no hydrogen 3.559 N/A TYR 711.A N ASP 707.A O no hydrogen 3.295 N/A GLU 712.A N ARG 709.A O no hydrogen 2.846 N/A MET 713.A N ARG 709.A O no hydrogen 2.809 N/A PHE 714.A N LYS 710.A O no hydrogen 3.158 N/A ALA 715.A N TYR 711.A O no hydrogen 2.602 N/A GLN 716.A N GLU 712.A O no hydrogen 2.973 N/A THR 717.A OG1 PHE 714.A O no hydrogen 3.044 N/A LEU 718.A N PHE 714.A O no hydrogen 2.622 N/A GLN 719.A N GLN 716.A O no hydrogen 2.880 N/A GLN 719.A NE2 TYR 497.A OH no hydrogen 3.443 N/A GLN 719.A NE2 LEU 618.A O no hydrogen 2.929 N/A