Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5u8r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A N VAL 24.A O no hydrogen 2.945 N/A CYS 3.A SG GLU 1.A OE2 no hydrogen 3.532 N/A ILE 7.A N TYR 28.A O no hydrogen 3.231 N/A ILE 9.A N HIS 30.A O no hydrogen 2.648 N/A ARG 10.A NE ASP 8.A OD1 no hydrogen 2.768 N/A ARG 10.A NH2 ASP 8.A OD1 no hydrogen 3.127 N/A ARG 10.A NH2 ASP 8.A OD2 no hydrogen 3.039 N/A ASN 11.A N LEU 32.A O no hydrogen 3.285 N/A GLN 15.A N ASP 12.A O no hydrogen 3.160 N/A LEU 16.A N TYR 13.A O no hydrogen 3.498 N/A LYS 17.A N GLN 14.A O no hydrogen 3.184 N/A ARG 18.A NH1 ASP 8.A O no hydrogen 3.488 N/A ARG 18.A NH1 GLN 15.A OE1 no hydrogen 3.174 N/A LEU 19.A N LEU 16.A O no hydrogen 3.403 N/A GLU 20.A N LYS 17.A O no hydrogen 3.271 N/A CYS 22.A SG ARG 18.A O no hydrogen 3.479 N/A THR 23.A N GLU 1.A O no hydrogen 3.186 N/A THR 23.A OG1 LYS 44.A O no hydrogen 3.273 N/A VAL 24.A N GLU 1.A O no hydrogen 3.389 N/A ILE 25.A N VAL 47.A O no hydrogen 3.128 N/A GLU 26.A N CYS 3.A O no hydrogen 2.551 N/A GLY 27.A N THR 49.A OG1 no hydrogen 2.668 N/A LEU 29.A N TYR 51.A O no hydrogen 3.254 N/A HIS 30.A N ILE 7.A O no hydrogen 2.740 N/A HIS 30.A ND1 ASP 8.A OD2 no hydrogen 3.010 N/A HIS 30.A NE2 TYR 51.A OH no hydrogen 3.185 N/A ILE 31.A N LEU 53.A O no hydrogen 3.139 N/A LEU 32.A N ILE 9.A O no hydrogen 2.924 N/A LEU 33.A N PHE 55.A O no hydrogen 2.889 N/A LYS 36.A N ALA 58.A O no hydrogen 2.971 N/A PHE 42.A N LEU 66.A O no hydrogen 2.685 N/A THR 46.A N THR 23.A O no hydrogen 2.968 N/A THR 46.A OG1 THR 23.A O no hydrogen 3.241 N/A VAL 47.A N THR 23.A O no hydrogen 3.506 N/A ILE 48.A N VAL 72.A O no hydrogen 2.923 N/A THR 49.A N ILE 25.A O no hydrogen 3.181 N/A THR 49.A OG1 ILE 25.A O no hydrogen 3.080 N/A TYR 51.A OH HIS 30.A NE2 no hydrogen 3.185 N/A LEU 52.A N ALA 83.A O no hydrogen 3.136 N/A LEU 53.A N LEU 29.A O no hydrogen 2.868 N/A LEU 54.A N VAL 85.A O no hydrogen 2.792 N/A PHE 55.A N ILE 31.A O no hydrogen 3.122 N/A ARG 56.A NE GLU 88.A OE1 no hydrogen 2.666 N/A ARG 56.A NH2 GLU 88.A OE1 no hydrogen 2.846 N/A ALA 58.A N ILE 34.A O no hydrogen 2.778 N/A GLY 59.A N ASN 91.A OD1 no hydrogen 3.306 N/A SER 62.A OG ASP 94.A O no hydrogen 3.539 N/A SER 62.A OG ASP 94.A OD2 no hydrogen 2.793 N/A GLY 64.A N SER 62.A OG no hydrogen 3.410 N/A ASP 65.A N SER 62.A O no hydrogen 3.197 N/A LEU 66.A N LEU 63.A O no hydrogen 3.223 N/A PHE 67.A N LEU 63.A O no hydrogen 3.175 N/A THR 71.A N THR 46.A O no hydrogen 2.645 N/A THR 71.A OG1 ASN 69.A O no hydrogen 2.984 N/A VAL 72.A N THR 46.A O no hydrogen 3.213 N/A ILE 73.A N ASN 102.A O no hydrogen 3.353 N/A ARG 74.A N ILE 48.A O no hydrogen 2.894 N/A ARG 74.A NE GLY 233.A O no hydrogen 3.129 N/A ARG 74.A NH1 CYS 211.A O no hydrogen 3.324 N/A ARG 74.A NH2 CYS 211.A O no hydrogen 2.353 N/A GLY 75.A N GLU 50.A O no hydrogen 2.907 N/A LYS 77.A NZ TRP 76.A O no hydrogen 3.561 N/A PHE 79.A N TYR 82.A O no hydrogen 2.906 N/A TYR 82.A N PHE 79.A O no hydrogen 3.246 N/A ALA 83.A N ALA 107.A O no hydrogen 2.644 N/A VAL 85.A N LEU 52.A O no hydrogen 3.046 N/A ILE 86.A N ARG 109.A O no hydrogen 2.889 N/A PHE 87.A N LEU 54.A O no hydrogen 3.131 N/A GLU 88.A N GLU 111.A O no hydrogen 3.125 N/A MET 89.A N ASN 113.A OD1 no hydrogen 2.956 N/A LYS 93.A N GLU 61.A O no hydrogen 2.548 N/A LYS 93.A NZ GLU 61.A OE1 no hydrogen 3.237 N/A TYR 98.A N GLY 96.A O no hydrogen 2.752 N/A ASN 99.A ND2 PRO 68.A O no hydrogen 2.685 N/A LEU 100.A N LEU 97.A O no hydrogen 3.311 N/A ARG 101.A N THR 71.A O no hydrogen 2.794 N/A ASN 102.A N THR 71.A O no hydrogen 3.452 N/A ILE 103.A N ILE 127.A O no hydrogen 2.566 N/A THR 104.A N ILE 73.A O no hydrogen 3.241 N/A THR 104.A OG1 ASN 102.A OD1 no hydrogen 3.121 N/A ALA 107.A N ASN 81.A O no hydrogen 3.021 N/A ILE 108.A N ASN 134.A OD1 no hydrogen 2.937 N/A ARG 109.A N LEU 84.A O no hydrogen 2.871 N/A ARG 109.A NE GLU 111.A OE1 no hydrogen 3.146 N/A ARG 109.A NH1 TYR 82.A OH no hydrogen 3.278 N/A ARG 109.A NH2 GLU 111.A OE1 no hydrogen 3.023 N/A ILE 110.A N TYR 135.A O no hydrogen 2.749 N/A GLU 111.A N ILE 86.A O no hydrogen 2.949 N/A LYS 112.A N VAL 137.A O no hydrogen 3.435 N/A ASN 113.A ND2 ILE 86.A O no hydrogen 3.238 N/A ASN 113.A ND2 ASN 139.A OD1 no hydrogen 2.645 N/A LEU 116.A N ASN 113.A O no hydrogen 3.200 N/A CYS 117.A N LYS 93.A O no hydrogen 2.609 N/A TYR 118.A N ASP 147.A OD1 no hydrogen 2.864 N/A TYR 118.A OH LEU 148.A O no hydrogen 3.002 N/A THR 121.A OG1 CYS 165.A O no hydrogen 2.540 N/A VAL 122.A N LEU 119.A O no hydrogen 3.402 N/A ASP 123.A N GLN 172.A OE1 no hydrogen 2.973 N/A SER 125.A OG ASP 123.A OD1 no hydrogen 2.286 N/A LEU 126.A N ASP 123.A O no hydrogen 3.381 N/A LEU 128.A N TRP 124.A O no hydrogen 3.213 N/A VAL 131.A N ASP 129.A O no hydrogen 2.963 N/A ASN 134.A N VAL 131.A O no hydrogen 3.485 N/A TYR 135.A N ILE 108.A O no hydrogen 2.757 N/A VAL 137.A N ILE 110.A O no hydrogen 3.175 N/A ASN 139.A ND2 ILE 110.A O no hydrogen 3.083 N/A GLU 144.A N PRO 141.A O no hydrogen 3.045 N/A CYS 145.A SG ASP 147.A OD1 no hydrogen 3.196 N/A CYS 152.A SG ARG 164.A O no hydrogen 3.460 N/A THR 156.A N THR 155.A OG1 no hydrogen 2.592 N/A ILE 157.A N GLU 160.A O no hydrogen 2.622 N/A GLU 160.A N ILE 157.A O no hydrogen 2.726 N/A ASN 162.A N THR 155.A O no hydrogen 3.362 N/A TYR 163.A N ASN 162.A OD1 no hydrogen 2.749 N/A ARG 164.A N GLU 153.A O no hydrogen 3.471 N/A CYS 165.A N THR 121.A O no hydrogen 2.872 N/A CYS 165.A SG THR 167.A O no hydrogen 3.740 N/A THR 167.A N ARG 170.A O no hydrogen 3.290 N/A THR 167.A OG1 ASP 94.A OD2 no hydrogen 3.242 N/A THR 168.A N THR 167.A OG1 no hydrogen 2.609 N/A GLN 172.A NE2 ASP 123.A O no hydrogen 3.130 N/A LYS 173.A NZ ASN 99.A OD1 no hydrogen 3.187 N/A CYS 179.A SG ALA 183.A O no hydrogen 4.016 N/A ARG 182.A N CYS 179.A O no hydrogen 3.091 N/A ARG 182.A NH1 CYS 179.A O no hydrogen 2.328 N/A CYS 184.A SG MET 174.A O no hydrogen 3.790 N/A CYS 184.A SG THR 185.A O no hydrogen 3.704 N/A THR 185.A N GLU 189.A O no hydrogen 2.995 N/A THR 185.A OG1 GLU 189.A O no hydrogen 2.965 N/A ASN 188.A N THR 185.A O no hydrogen 2.865 N/A CYS 191.A N ALA 183.A O no hydrogen 2.485 N/A GLU 194.A N HIS 192.A ND1 no hydrogen 3.007 N/A CYS 195.A N HIS 192.A O no hydrogen 2.713 N/A CYS 195.A SG SER 198.A O no hydrogen 3.655 N/A CYS 199.A SG SER 198.A O no hydrogen 3.076 N/A CYS 199.A SG ALA 207.A O no hydrogen 3.849 N/A SER 200.A N ALA 207.A O no hydrogen 3.172 N/A ALA 207.A N ASN 204.A O no hydrogen 3.498 N/A CYS 208.A SG ASN 204.A O no hydrogen 3.523 N/A CYS 208.A SG ASP 205.A O no hydrogen 3.945 N/A ARG 212.A N GLU 194.A O no hydrogen 3.196 N/A ARG 212.A NE PRO 193.A O no hydrogen 2.732 N/A ARG 212.A NE CYS 195.A O no hydrogen 2.706 N/A TYR 214.A N VAL 221.A O no hydrogen 3.234 N/A TYR 216.A N VAL 219.A O no hydrogen 3.013 N/A VAL 219.A N TYR 216.A O no hydrogen 2.940 N/A THR 228.A N PRO 225.A O no hydrogen 3.034 N/A THR 228.A OG1 PRO 225.A O no hydrogen 2.931 N/A TYR 229.A N VAL 237.A O no hydrogen 2.804 N/A ARG 230.A N GLY 261.A O no hydrogen 2.791 N/A ARG 230.A NH1 ASP 260.A O no hydrogen 3.299 N/A ARG 230.A NH2 ASP 260.A O no hydrogen 2.793 N/A PHE 231.A N ARG 235.A O no hydrogen 2.965 N/A ARG 235.A NE GLU 26.A OE2 no hydrogen 2.771 N/A CYS 236.A N TYR 215.A O no hydrogen 2.921 N/A CYS 236.A SG TYR 215.A O no hydrogen 3.838 N/A VAL 237.A N TYR 229.A O no hydrogen 2.978 N/A PHE 241.A N ASP 238.A O no hydrogen 3.410 N/A ALA 243.A N ARG 239.A O no hydrogen 3.387 N/A ASN 244.A N PHE 241.A O no hydrogen 3.041 N/A ASN 244.A ND2 ASP 240.A O no hydrogen 2.516 N/A SER 247.A N GLU 254.A O no hydrogen 3.475 N/A SER 247.A OG SER 253.A OG no hydrogen 2.966 N/A SER 247.A OG GLU 254.A O no hydrogen 3.153 N/A SER 250.A OG ALA 248.A O no hydrogen 3.373 N/A SER 251.A OG GLU 295.A OE2 no hydrogen 3.060 N/A SER 253.A OG SER 247.A OG no hydrogen 2.966 N/A SER 253.A OG ALA 248.A O no hydrogen 3.199 N/A VAL 257.A N MET 264.A O no hydrogen 2.949 N/A ILE 258.A N MET 279.A O no hydrogen 2.500 N/A HIS 259.A N GLU 262.A O no hydrogen 2.715 N/A GLU 262.A N HIS 259.A O no hydrogen 2.730 N/A CYS 263.A N ARG 230.A O no hydrogen 2.801 N/A MET 264.A N VAL 257.A O no hydrogen 3.008 N/A PHE 271.A N PRO 268.A O no hydrogen 3.065 N/A ILE 272.A N ILE 282.A O no hydrogen 3.240 N/A ARG 273.A NH1 GLY 255.A O no hydrogen 3.324 N/A ARG 273.A NH2 GLY 255.A O no hydrogen 3.437 N/A ARG 273.A NH2 SER 278.A O no hydrogen 3.379 N/A ASN 274.A N TYR 280.A O no hydrogen 2.848 N/A SER 278.A OG ASN 274.A O no hydrogen 3.237 N/A ILE 282.A N ILE 272.A O no hydrogen 2.755 N/A GLU 285.A N GLU 285.A OE1 no hydrogen 2.404 N/A CYS 288.A SG CYS 284.A O no hydrogen 3.740 N/A CYS 292.A N ILE 315.A O no hydrogen 3.103 N/A CYS 292.A SG LYS 290.A O no hydrogen 3.839 N/A LYS 299.A N ASN 319.A O no hydrogen 2.813 N/A LYS 299.A NZ SER 306.A O no hydrogen 2.805 N/A ILE 301.A N LEU 321.A O no hydrogen 2.620 N/A SER 303.A N SER 306.A OG no hydrogen 3.246 N/A SER 306.A N SER 303.A OG no hydrogen 3.406 N/A SER 306.A OG SER 303.A O no hydrogen 3.116 N/A GLN 308.A N THR 305.A O no hydrogen 3.071 N/A LEU 310.A N ALA 307.A O no hydrogen 3.068 N/A GLN 311.A N GLN 308.A O no hydrogen 3.293 N/A THR 314.A N LYS 290.A O no hydrogen 2.953 N/A THR 314.A OG1 GLU 342.A OE1 no hydrogen 3.284 N/A PHE 316.A N VAL 343.A O no hydrogen 2.895 N/A LYS 317.A N CYS 292.A O no hydrogen 3.394 N/A GLY 318.A N THR 345.A OG1 no hydrogen 2.855 N/A ASN 319.A N LYS 297.A O no hydrogen 3.022 N/A ASN 319.A ND2 GLU 372.A OE1 no hydrogen 3.102 N/A LEU 320.A N TYR 347.A O no hydrogen 3.032 N/A LEU 321.A N LYS 299.A O no hydrogen 2.789 N/A ILE 322.A N LYS 349.A O no hydrogen 2.743 N/A ASN 323.A N ILE 301.A O no hydrogen 2.891 N/A ASN 323.A ND2 ASN 323.A O no hydrogen 2.801 N/A ILE 324.A N SER 353.A OG no hydrogen 3.269 N/A SER 332.A OG ASN 329.A O no hydrogen 3.195 N/A GLU 333.A N ASN 329.A O no hydrogen 2.993 N/A LEU 334.A N ILE 330.A O no hydrogen 2.753 N/A ASN 336.A N GLU 333.A O no hydrogen 3.062 N/A ASN 336.A ND2 GLU 333.A OE1 no hydrogen 3.507 N/A MET 338.A N LEU 334.A O no hydrogen 2.721 N/A ILE 341.A N MET 338.A O no hydrogen 3.112 N/A GLU 342.A N THR 314.A O no hydrogen 2.692 N/A VAL 343.A N THR 314.A O no hydrogen 3.321 N/A VAL 344.A N LEU 367.A O no hydrogen 3.018 N/A THR 345.A N PHE 316.A O no hydrogen 3.042 N/A THR 345.A OG1 PHE 316.A O no hydrogen 3.072 N/A THR 345.A OG1 GLY 318.A O no hydrogen 3.387 N/A VAL 348.A N SER 379.A O no hydrogen 3.029 N/A LYS 349.A N LEU 320.A O no hydrogen 2.920 N/A ILE 350.A N TYR 381.A O no hydrogen 2.918 N/A ARG 351.A N ILE 322.A O no hydrogen 2.883 N/A ARG 351.A NE ASN 323.A OD1 no hydrogen 3.419 N/A HIS 352.A N LEU 383.A O no hydrogen 2.979 N/A SER 353.A N ASN 385.A OD1 no hydrogen 3.101 N/A SER 353.A OG ARG 351.A O no hydrogen 3.370 N/A HIS 354.A N HIS 352.A O no hydrogen 2.983 N/A ALA 355.A N ILE 324.A O no hydrogen 3.081 N/A SER 358.A OG LEU 391.A O no hydrogen 3.323 N/A SER 360.A N SER 358.A OG no hydrogen 3.279 N/A LEU 362.A N LEU 359.A O no hydrogen 3.016 N/A LYS 363.A NZ GLU 335.A OE2 no hydrogen 3.148 N/A ASN 364.A ND2 GLY 339.A O no hydrogen 2.549 N/A ARG 366.A N GLU 342.A O no hydrogen 2.915 N/A ARG 366.A NH1 GLU 342.A OE2 no hydrogen 3.294 N/A LEU 367.A N GLU 342.A O no hydrogen 3.258 N/A ILE 368.A N THR 400.A O no hydrogen 2.918 N/A LEU 369.A N VAL 344.A O no hydrogen 3.072 N/A GLY 370.A N THR 345.A O no hydrogen 3.393 N/A GLU 371.A N THR 345.A O no hydrogen 3.101 N/A GLN 373.A NE2 GLY 370.A O no hydrogen 3.257 N/A LEU 374.A N TYR 378.A O no hydrogen 2.883 N/A TYR 378.A N LEU 374.A O no hydrogen 3.288 N/A TYR 378.A OH ASP 436.A OD1 no hydrogen 3.260 N/A SER 379.A N LYS 405.A O no hydrogen 2.928 N/A PHE 380.A N LYS 405.A O no hydrogen 3.240 N/A TYR 381.A N VAL 348.A O no hydrogen 3.035 N/A VAL 382.A N TYR 407.A O no hydrogen 3.194 N/A LEU 383.A N ILE 350.A O no hydrogen 2.902 N/A ASP 384.A N ALA 409.A O no hydrogen 3.241 N/A ASN 385.A N ASN 411.A OD1 no hydrogen 3.069 N/A ASN 385.A ND2 ILE 350.A O no hydrogen 3.215 N/A ASN 385.A ND2 ASN 411.A OD1 no hydrogen 2.718 N/A GLN 386.A N HIS 354.A ND1 no hydrogen 3.286 N/A ASN 387.A ND2 HIS 354.A O no hydrogen 3.215 N/A LEU 388.A N ASN 385.A O no hydrogen 3.366 N/A GLN 389.A N VAL 357.A O no hydrogen 2.868 N/A GLN 390.A N VAL 357.A O no hydrogen 3.198 N/A TRP 394.A N TRP 392.A O no hydrogen 2.985 N/A ARG 397.A N TRP 394.A O no hydrogen 2.999 N/A ARG 397.A NH1 LEU 362.A O no hydrogen 3.549 N/A ARG 397.A NH2 LEU 362.A O no hydrogen 3.369 N/A LYS 402.A N ILE 368.A O no hydrogen 2.843 N/A ALA 403.A N LEU 369.A O no hydrogen 3.040 N/A LYS 405.A N ASN 377.A O no hydrogen 2.956 N/A LYS 405.A NZ GLY 376.A O no hydrogen 2.357 N/A LYS 405.A NZ ASN 377.A O no hydrogen 2.863 N/A TYR 407.A N PHE 380.A O no hydrogen 3.074 N/A PHE 408.A N ASP 436.A O no hydrogen 2.823 N/A PHE 410.A N ASN 441.A OD1 no hydrogen 2.744 N/A ASN 411.A N ASN 442.A OD1 no hydrogen 2.950 N/A LYS 413.A NZ ARG 445.A O no hydrogen 3.290 N/A GLU 418.A N CYS 415.A O no hydrogen 2.908 N/A TYR 420.A N SER 417.A O no hydrogen 3.138 N/A ARG 421.A N SER 417.A O no hydrogen 3.134 N/A THR 426.A N MET 422.A O no hydrogen 2.693 N/A THR 426.A OG1 MET 422.A O no hydrogen 2.841 N/A GLY 427.A N GLU 423.A O no hydrogen 2.858 N/A THR 428.A N GLU 423.A O no hydrogen 3.250 N/A ARG 431.A N THR 428.A O no hydrogen 3.092 N/A ARG 431.A NH2 GLY 404.A O no hydrogen 2.632 N/A GLN 432.A NE2 THR 428.A OG1 no hydrogen 3.118 N/A SER 433.A N ASP 436.A OD2 no hydrogen 3.191 N/A GLY 443.A N ASN 411.A O no hydrogen 3.142 N/A ARG 445.A N PRO 412.A O no hydrogen 3.360 N/A ASP 451.A N GLY 548.A O no hydrogen 2.730 N/A LEU 453.A N LYS 550.A O no hydrogen 3.097 N/A THR 456.A N THR 468.A O no hydrogen 2.612 N/A THR 456.A OG1 GLU 515.A OE1 no hydrogen 3.185 N/A SER 457.A N THR 468.A O no hydrogen 3.217 N/A SER 457.A OG THR 468.A OG1 no hydrogen 2.534 N/A THR 459.A N ILE 466.A O no hydrogen 2.717 N/A THR 460.A OG1 ASN 559.A OD1 no hydrogen 3.140 N/A SER 461.A N ARG 464.A O no hydrogen 2.729 N/A ILE 466.A N THR 459.A O no hydrogen 2.831 N/A ILE 467.A N ILE 518.A O no hydrogen 3.215 N/A THR 468.A N SER 457.A O no hydrogen 2.921 N/A THR 468.A OG1 SER 457.A O no hydrogen 3.503 N/A THR 468.A OG1 SER 457.A OG no hydrogen 2.534 N/A THR 468.A OG1 GLU 515.A OE2 no hydrogen 3.180 N/A TRP 469.A N PRO 516.A O no hydrogen 3.122 N/A HIS 470.A N HIS 454.A O no hydrogen 2.894 N/A HIS 470.A ND1 ARG 471.A O no hydrogen 2.617 N/A ARG 471.A NH1 PRO 509.A O no hydrogen 3.442 N/A ARG 471.A NH1 VAL 514.A O no hydrogen 2.827 N/A ARG 471.A NH2 PRO 509.A O no hydrogen 3.464 N/A TYR 472.A OH ASP 451.A OD2 no hydrogen 2.335 N/A ARG 478.A N ASP 476.A OD1 no hydrogen 2.817 N/A ASP 479.A N ASP 476.A O no hydrogen 3.440 N/A LEU 480.A N LEU 538.A O no hydrogen 3.230 N/A SER 482.A N VAL 536.A O no hydrogen 2.989 N/A SER 482.A OG ASP 507.A OD1 no hydrogen 3.316 N/A PHE 483.A N VAL 506.A O no hydrogen 3.259 N/A THR 484.A N LYS 534.A O no hydrogen 2.749 N/A THR 484.A OG1 ASP 505.A OD1 no hydrogen 2.649 N/A VAL 485.A N VAL 504.A O no hydrogen 2.847 N/A TYR 486.A N TYR 532.A O no hydrogen 2.932 N/A TYR 487.A N ASN 502.A O no hydrogen 2.962 N/A LYS 488.A N ALA 530.A O no hydrogen 3.049 N/A ALA 490.A N GLN 528.A O no hydrogen 3.001 N/A GLU 497.A N GLU 497.A OE1 no hydrogen 2.663 N/A TYR 498.A N TYR 532.A OH no hydrogen 3.479 N/A ASN 502.A N TYR 487.A O no hydrogen 3.035 N/A VAL 504.A N VAL 485.A O no hydrogen 3.187 N/A ASP 513.A N ASN 511.A OD1 no hydrogen 2.979 N/A ILE 518.A N ILE 467.A O no hydrogen 3.031 N/A LEU 520.A N ILE 465.A O no hydrogen 2.909 N/A LEU 523.A N ASN 463.A O no hydrogen 2.747 N/A LYS 524.A N TYR 529.A OH no hydrogen 2.970 N/A LYS 524.A NZ GLU 489.A OE1 no hydrogen 3.558 N/A TRP 526.A N ASN 559.A O no hydrogen 2.519 N/A THR 527.A N THR 558.A OG1 no hydrogen 3.242 N/A THR 527.A OG1 LYS 524.A O no hydrogen 3.057 N/A THR 527.A OG1 PRO 525.A O no hydrogen 3.383 N/A TYR 529.A N ILE 556.A O no hydrogen 2.653 N/A ALA 530.A N LYS 488.A O no hydrogen 2.914 N/A VAL 531.A N LEU 554.A O no hydrogen 2.708 N/A TYR 532.A N TYR 486.A O no hydrogen 2.917 N/A LYS 534.A N THR 484.A O no hydrogen 2.862 N/A LYS 534.A NZ TYR 486.A OH no hydrogen 3.195 N/A ALA 535.A N ALA 549.A O no hydrogen 2.944 N/A VAL 536.A N SER 482.A O no hydrogen 2.463 N/A THR 537.A OG1 ARG 547.A O no hydrogen 3.353 N/A LEU 538.A N LEU 480.A O no hydrogen 2.960 N/A THR 539.A OG1 VAL 541.A O no hydrogen 3.525 N/A HIS 545.A ND1 ASP 544.A O no hydrogen 2.375 N/A ARG 547.A NE ASP 451.A OD1 no hydrogen 3.008 N/A LYS 550.A N ASP 451.A O no hydrogen 3.464 N/A SER 551.A N VAL 533.A O no hydrogen 3.123 N/A SER 551.A OG LEU 453.A O no hydrogen 3.044 N/A SER 551.A OG GLU 552.A O no hydrogen 3.295 N/A LEU 554.A N VAL 531.A O no hydrogen 2.636 N/A ILE 556.A N TYR 529.A O no hydrogen 2.828 N/A THR 558.A N THR 527.A O no hydrogen 3.236 N/A THR 558.A OG1 LYS 524.A O no hydrogen 2.702 N/A ASN 559.A N SER 461.A O no hydrogen 2.684 N/A SER 564.A N LEU 588.A O no hydrogen 3.262 N/A SER 564.A OG ILE 565.A O no hydrogen 3.469 N/A LEU 567.A N ASN 584.A O no hydrogen 3.010 N/A LEU 570.A N LYS 582.A O no hydrogen 2.889 N/A ALA 572.A N ILE 580.A O no hydrogen 3.019 N/A SER 573.A OG SER 575.A O no hydrogen 2.967 N/A SER 573.A OG GLN 578.A O no hydrogen 2.960 N/A SER 575.A OG SER 576.A O no hydrogen 3.194 N/A SER 577.A OG LEU 667.A O no hydrogen 2.522 N/A GLN 578.A N SER 575.A O no hydrogen 3.266 N/A LEU 579.A N ILE 664.A O no hydrogen 3.090 N/A ILE 580.A N ALA 572.A O no hydrogen 3.001 N/A VAL 581.A N THR 662.A O no hydrogen 3.063 N/A LYS 582.A N LEU 570.A O no hydrogen 2.825 N/A TRP 583.A N GLU 660.A O no hydrogen 3.229 N/A ASN 584.A N LEU 567.A O no hydrogen 2.824 N/A ASN 584.A ND2 ASP 568.A OD2 no hydrogen 3.395 N/A ASN 590.A ND2 VAL 562.A O no hydrogen 3.604 N/A ASN 592.A N HIS 682.A ND1 no hydrogen 2.998 N/A SER 594.A OG ASN 592.A O no hydrogen 3.389 N/A TYR 595.A N LEU 593.A O no hydrogen 2.513 N/A TYR 596.A N VAL 656.A O no hydrogen 2.740 N/A ILE 597.A N HIS 678.A O no hydrogen 3.434 N/A VAL 598.A N SER 654.A O no hydrogen 3.005 N/A ARG 599.A N ASP 676.A O no hydrogen 2.543 N/A ARG 599.A NH2 ASP 676.A OD2 no hydrogen 3.442 N/A TRP 600.A N PHE 652.A O no hydrogen 3.181 N/A GLN 601.A N ARG 674.A O no hydrogen 2.818 N/A GLN 601.A NE2 TYR 649.A O no hydrogen 2.962 N/A GLN 603.A N LEU 672.A O no hydrogen 2.766 N/A GLN 605.A NE2 PHE 670.A O no hydrogen 3.284 N/A TYR 610.A N TYR 608.A O no hydrogen 2.285 N/A CYS 615.A N ASN 613.A OD1 no hydrogen 3.294 N/A SER 616.A N ASN 613.A O no hydrogen 3.308 N/A TYR 631.A N GLU 627.A O no hydrogen 3.114 N/A ARG 632.A N GLU 628.A O no hydrogen 2.938 N/A ARG 632.A NH1 GLU 628.A O no hydrogen 3.394 N/A ARG 632.A NH1 GLU 628.A OE1 no hydrogen 3.508 N/A LYS 633.A N ALA 629.A O no hydrogen 2.986 N/A VAL 634.A N TYR 631.A O no hydrogen 3.264 N/A GLU 636.A N ARG 632.A O no hydrogen 3.191 N/A ASN 637.A N LYS 633.A O no hydrogen 2.960 N/A LEU 639.A N GLU 636.A O no hydrogen 3.261 N/A PHE 644.A N CYS 689.A O no hydrogen 2.753 N/A PHE 652.A N TRP 600.A O no hydrogen 3.301 N/A SER 654.A N VAL 598.A O no hydrogen 3.107 N/A VAL 656.A N TYR 596.A O no hydrogen 2.695 N/A THR 662.A N VAL 581.A O no hydrogen 3.252 N/A ILE 664.A N LEU 579.A O no hydrogen 2.671 N/A ARG 668.A N TYR 673.A OH no hydrogen 3.195 N/A PHE 670.A N MET 700.A O no hydrogen 3.149 N/A THR 671.A N THR 699.A OG1 no hydrogen 3.273 N/A THR 671.A OG1 ARG 668.A O no hydrogen 2.288 N/A TYR 673.A N ALA 697.A O no hydrogen 2.766 N/A ARG 674.A N GLN 601.A O no hydrogen 2.851 N/A ILE 675.A N VAL 695.A O no hydrogen 2.780 N/A ASP 676.A N ARG 599.A O no hydrogen 2.574 N/A HIS 678.A N ILE 597.A O no hydrogen 2.916 N/A SER 679.A OG SER 564.A O no hydrogen 2.412 N/A CYS 680.A N TYR 595.A O no hydrogen 3.423 N/A ASN 681.A ND2 SER 561.A O no hydrogen 2.966 N/A ASN 681.A ND2 PRO 589.A O no hydrogen 3.640 N/A ASN 681.A ND2 ASN 590.A O no hydrogen 3.313 N/A HIS 682.A N ASN 592.A O no hydrogen 3.149 N/A ALA 684.A N ASN 681.A O no hydrogen 3.032 N/A LYS 686.A N GLU 683.A O no hydrogen 3.353 N/A LEU 687.A N GLU 683.A O no hydrogen 2.943 N/A GLY 688.A N ALA 684.A O no hydrogen 2.988 N/A SER 690.A N SER 679.A O no hydrogen 3.259 N/A SER 690.A OG PRO 563.A O no hydrogen 3.072 N/A SER 690.A OG ALA 691.A O no hydrogen 3.423 N/A ASN 693.A N ILE 677.A O no hydrogen 3.089 N/A ASN 693.A ND2 PRO 566.A O no hydrogen 2.888 N/A VAL 695.A N ILE 675.A O no hydrogen 3.076 N/A ALA 697.A N TYR 673.A O no hydrogen 3.065 N/A THR 699.A N THR 671.A O no hydrogen 3.372 N/A THR 699.A OG1 ARG 668.A O no hydrogen 3.070 N/A MET 700.A N SER 573.A OG no hydrogen 3.142 N/A ALA 705.A N ALA 702.A O no hydrogen 3.246 N/A THR 713.A N LYS 725.A O no hydrogen 2.696 N/A THR 713.A OG1 LYS 725.A O no hydrogen 3.169 N/A GLU 715.A N PHE 723.A O no hydrogen 3.155 N/A ARG 717.A N SER 721.A O no hydrogen 3.372 N/A SER 721.A OG PRO 718.A O no hydrogen 3.021 N/A ILE 722.A N LEU 767.A O no hydrogen 3.046 N/A PHE 723.A N GLU 715.A O no hydrogen 3.113 N/A LEU 724.A N ALA 765.A O no hydrogen 2.794 N/A LYS 725.A N THR 713.A O no hydrogen 2.594 N/A ASN 733.A ND2 ALA 702.A O no hydrogen 2.938 N/A ASN 733.A ND2 SER 785.A OG no hydrogen 3.373 N/A LEU 735.A N ASN 733.A O no hydrogen 3.095 N/A LEU 737.A N THR 782.A O no hydrogen 2.893 N/A TYR 739.A N VAL 754.A O no hydrogen 2.642 N/A GLU 740.A N GLN 780.A O no hydrogen 2.948 N/A ILE 741.A N GLU 752.A O no hydrogen 2.723 N/A LYS 742.A N ARG 778.A O no hydrogen 2.646 N/A TYR 743.A N GLN 750.A O no hydrogen 2.835 N/A GLY 744.A N THR 776.A O no hydrogen 3.237 N/A GLU 752.A N ILE 741.A O no hydrogen 2.710 N/A VAL 754.A N TYR 739.A O no hydrogen 2.804 N/A GLN 757.A NE2 TYR 610.A O no hydrogen 2.341 N/A GLN 757.A NE2 HIS 612.A O no hydrogen 3.239 N/A GLU 758.A N SER 755.A OG no hydrogen 3.078 N/A TYR 759.A N SER 755.A O no hydrogen 3.213 N/A TYR 759.A OH TRP 726.A O no hydrogen 2.615 N/A ARG 760.A N ARG 756.A O no hydrogen 3.133 N/A LYS 761.A N GLU 758.A O no hydrogen 3.366 N/A TYR 762.A N GLU 758.A O no hydrogen 3.473 N/A GLY 763.A N TYR 759.A O no hydrogen 2.793 N/A ALA 765.A N LEU 724.A O no hydrogen 2.990 N/A LEU 767.A N ILE 722.A O no hydrogen 2.599 N/A ARG 769.A N SER 721.A OG no hydrogen 3.263 N/A ARG 769.A NH2 GLU 719.A OE2 no hydrogen 3.293 N/A LEU 770.A N ASN 720.A O no hydrogen 2.572 N/A GLY 773.A N VAL 798.A O no hydrogen 2.991 N/A TYR 775.A N PHE 796.A O no hydrogen 2.882 N/A TYR 775.A OH ASN 771.A O no hydrogen 2.774 N/A THR 776.A N GLY 744.A O no hydrogen 3.149 N/A THR 776.A OG1 GLU 748.A OE1 no hydrogen 3.385 N/A ALA 777.A N VAL 794.A O no hydrogen 3.007 N/A ARG 778.A N LYS 742.A O no hydrogen 2.890 N/A ILE 779.A N THR 791.A OG1 no hydrogen 3.146 N/A GLN 780.A N GLU 740.A O no hydrogen 3.009 N/A GLN 780.A NE2 GLY 788.A O no hydrogen 2.711 N/A THR 782.A N MET 738.A O no hydrogen 2.947 N/A SER 783.A N GLY 786.A O no hydrogen 2.553 N/A SER 783.A OG ASP 706.A OD2 no hydrogen 2.354 N/A SER 783.A OG SER 785.A OG no hydrogen 3.298 N/A SER 783.A OG GLY 786.A O no hydrogen 2.752 N/A SER 785.A OG SER 783.A OG no hydrogen 3.298 N/A ASN 787.A ND2 GLY 788.A O no hydrogen 2.721 N/A GLY 788.A N ALA 781.A O no hydrogen 2.693 N/A SER 789.A OG TRP 790.A O no hydrogen 3.431 N/A THR 791.A N ILE 779.A O no hydrogen 2.970 N/A THR 791.A OG1 ASP 792.A O no hydrogen 3.553 N/A VAL 794.A N ALA 777.A O no hydrogen 2.981 N/A PHE 796.A N TYR 775.A O no hydrogen 3.315 N/A VAL 798.A N GLY 773.A O no hydrogen 3.037 N/A