Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8v1t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N MET 251.A O no hydrogen 3.179 N/A THR 3.A OG1 MET 251.A O no hydrogen 3.171 N/A GLN 4.A NE2 ALA 252.A O no hydrogen 3.194 N/A HIS 6.A ND1 TYR 8.A OH no hydrogen 2.877 N/A THR 7.A N ASN 412.A O no hydrogen 2.668 N/A THR 7.A OG1 ASP 406.A OD2 no hydrogen 2.458 N/A TYR 8.A OH HIS 6.A ND1 no hydrogen 2.877 N/A TYR 9.A N TYR 408.A OH no hydrogen 2.977 N/A CYS 12.A SG GLU 11.A O no hydrogen 3.349 N/A PHE 15.A N LEU 40.A O no hydrogen 2.809 N/A ARG 16.A NE ASP 37.A OD1 no hydrogen 3.316 N/A ARG 16.A NH2 ASP 37.A OD1 no hydrogen 3.493 N/A PHE 17.A N GLY 38.A O no hydrogen 3.027 N/A ARG 21.A N GLY 34.A O no hydrogen 3.254 N/A ARG 21.A NE ALA 33.A O no hydrogen 3.351 N/A ASP 24.A N ARG 21.A O no hydrogen 2.752 N/A LYS 31.A N PRO 28.A O no hydrogen 2.964 N/A ARG 32.A NH1 ASP 24.A O no hydrogen 2.907 N/A HIS 36.A N ALA 19.A O no hydrogen 2.481 N/A HIS 36.A NE2 ASP 24.A OD2 no hydrogen 2.504 N/A GLY 38.A N ASP 37.A OD1 no hydrogen 2.919 N/A LEU 40.A N PHE 15.A O no hydrogen 2.751 N/A LYS 41.A NZ.B GLU 14.A OE1 no hydrogen 3.388 N/A ARG 42.A NH1 ALA 43.A O no hydrogen 3.522 N/A LYS 45.A NZ.A ALA 43.A O no hydrogen 3.540 N/A LYS 45.A NZ.A ASP 54.A OD1 no hydrogen 2.726 N/A LYS 45.A NZ.B GLU 52.A OE2 no hydrogen 2.798 N/A VAL 46.A N ARG 53.A O no hydrogen 2.974 N/A TYR 47.A N GLU 357.A O no hydrogen 2.758 N/A TYR 47.A OH ASP 359.A OD2 no hydrogen 2.990 N/A CYS 48.A SG VAL 355.A O no hydrogen 3.590 N/A ASP 51.A N CYS 48.A O no hydrogen 3.275 N/A GLU 52.A N ASP 51.A OD1 no hydrogen 2.862 N/A ARG 53.A N VAL 46.A O no hydrogen 3.109 N/A ARG 53.A NH2 VAL 55.A O no hydrogen 3.352 N/A ARG 53.A NH2 ARG 57.A O no hydrogen 2.551 N/A VAL 55.A N PRO 44.A O no hydrogen 2.656 N/A ARG 57.A N ASP 54.A O no hydrogen 3.426 N/A TRP 64.A NE1 GLN 374.A OE1 no hydrogen 2.508 N/A ARG 67.A N GLN 374.A O no hydrogen 3.014 N/A ARG 67.A NE TYR 375.A O no hydrogen 2.869 N/A ARG 67.A NH2 GLY 376.A O no hydrogen 2.842 N/A ARG 67.A NH2 GLU 378.A OE2 no hydrogen 2.968 N/A SER 68.A OG LEU 70.A O no hydrogen 3.366 N/A TRP 71.A N VAL 74.A O no hydrogen 3.064 N/A GLY 72.A N TYR 8.A OH no hydrogen 2.618 N/A HIS 76.A N ARG 69.A O no hydrogen 2.777 N/A HIS 89.A ND1 TYR 280.A OH no hydrogen 2.772 N/A VAL 90.A N GLY 232.A O no hydrogen 2.955 N/A TYR 91.A N LEU 126.A O no hydrogen 3.059 N/A TYR 91.A OH GLY 437.A O no hydrogen 2.516 N/A LEU 94.A N THR 124.A O no hydrogen 2.856 N/A ASN 96.A N VAL 122.A O no hydrogen 3.011 N/A ASN 96.A ND2 THR 124.A OG1 no hydrogen 3.223 N/A GLU 98.A N GLY 120.A O no hydrogen 2.866 N/A ALA 100.A N ILE 116.A O no hydrogen 3.080 N/A GLY 102.A N HIS 99.A O no hydrogen 2.824 N/A ARG 111.A NH1 THR 264.A OG1 no hydrogen 3.162 N/A ARG 111.A NH2 LEU 244.A O no hydrogen 2.829 N/A ARG 111.A NH2 ASN 267.A OD1 no hydrogen 2.500 N/A ASP 114.A N ALA 110.A O no hydrogen 2.868 N/A ILE 116.A N MET 113.A O no hydrogen 3.054 N/A THR 119.A OG1 HIS 99.A ND1 no hydrogen 2.820 N/A GLY 120.A N GLU 98.A O no hydrogen 2.978 N/A VAL 122.A N ASN 96.A O no hydrogen 2.940 N/A ILE 123.A N VAL 139.A O no hydrogen 3.126 N/A THR 124.A N LEU 94.A O no hydrogen 2.930 N/A LEU 125.A N VAL 137.A O no hydrogen 2.765 N/A LEU 126.A N ASP 92.A O no hydrogen 2.965 N/A GLY 127.A N VAL 135.A O no hydrogen 3.030 N/A LEU 128.A N HIS 89.A O no hydrogen 3.186 N/A THR 129.A N HIS 133.A O no hydrogen 2.961 N/A THR 129.A OG1 GLU 131.A OE1 no hydrogen 3.548 N/A GLU 131.A N THR 129.A OG1 no hydrogen 3.179 N/A GLY 132.A N THR 129.A O no hydrogen 3.240 N/A HIS 133.A N THR 129.A OG1 no hydrogen 3.159 N/A ARG 134.A N ASP 258.A OD2 no hydrogen 2.631 N/A VAL 135.A N GLY 127.A O no hydrogen 2.803 N/A ALA 136.A N VAL 259.A O no hydrogen 3.027 N/A VAL 137.A N LEU 125.A O no hydrogen 2.968 N/A HIS 138.A N PHE 261.A O no hydrogen 2.835 N/A HIS 138.A NE2 GLU 260.A OE1 no hydrogen 2.538 N/A VAL 139.A N ILE 123.A O no hydrogen 2.824 N/A TYR 140.A N CYS 263.A O no hydrogen 3.297 N/A GLN 144.A NE2 VAL 215.A O no hydrogen 3.056 N/A TYR 145.A OH ASP 224.A OD1 no hydrogen 3.306 N/A TYR 145.A OH ASP 224.A OD2 no hydrogen 2.901 N/A PHE 146.A N VAL 189.A O no hydrogen 3.097 N/A MET 148.A N TYR 187.A O no hydrogen 2.974 N/A LYS 150.A N LEU 185.A O no hydrogen 2.568 N/A VAL 153.A N ASN 149.A O no hydrogen 3.063 N/A ASP 154.A N LYS 150.A O no hydrogen 2.886 N/A ARG 155.A N GLU 151.A O no hydrogen 2.922 N/A HIS 156.A N GLU 152.A O no hydrogen 2.920 N/A LEU 157.A N VAL 153.A O no hydrogen 2.610 N/A CYS 159.A SG LEU 157.A O no hydrogen 3.570 N/A HIS 165.A ND1 SER 162.A O no hydrogen 2.834 N/A GLU 169.A N ARG 188.A O no hydrogen 2.966 N/A VAL 171.A N PHE 186.A O no hydrogen 2.908 N/A THR 174.A N GLY 551.A O no hydrogen 3.358 N/A THR 174.A OG1 ASP 175.A O no hydrogen 3.158 N/A TYR 177.A OH PRO 701.A O no hydrogen 2.353 N/A TYR 179.A N LEU 608.A O no hydrogen 2.740 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.981 N/A THR 181.A OG1 TYR 177.A O no hydrogen 3.153 N/A PHE 186.A N VAL 171.A O no hydrogen 2.804 N/A TYR 187.A N MET 148.A O no hydrogen 2.824 N/A TYR 187.A OH ASP 154.A OD1 no hydrogen 2.958 N/A ARG 188.A N GLU 169.A O no hydrogen 2.738 N/A VAL 189.A N PHE 146.A O no hydrogen 2.831 N/A TYR 190.A N GLU 167.A O no hydrogen 2.722 N/A ARG 192.A NH1 THR 117.A OG1 no hydrogen 3.095 N/A ARG 192.A NH1 THR 119.A O no hydrogen 3.405 N/A VAL 196.A N SER 193.A O no hydrogen 2.748 N/A LEU 197.A N GLY 194.A O no hydrogen 2.919 N/A SER 198.A N ARG 195.A O no hydrogen 2.874 N/A SER 198.A OG ARG 195.A O no hydrogen 2.664 N/A TYR 199.A N VAL 196.A O no hydrogen 3.014 N/A LEU 200.A N VAL 196.A O no hydrogen 2.985 N/A CYS 201.A SG ASP 556.A OD2 no hydrogen 3.389 N/A ASN 203.A N TYR 199.A O no hydrogen 2.502 N/A ILE 208.A N CYS 205.A O no hydrogen 3.081 N/A LYS 209.A N GLU 152.A OE2 no hydrogen 3.107 N/A LYS 210.A NZ CYS 205.A O no hydrogen 3.520 N/A LYS 210.A NZ ILE 208.A O no hydrogen 3.076 N/A TYR 211.A N TYR 147.A O no hydrogen 2.694 N/A VAL 215.A N GLU 212.A O no hydrogen 3.481 N/A ASP 216.A N ASP 216.A OD1 no hydrogen 2.507 N/A THR 218.A OG1 GLU 95.A OE2 no hydrogen 2.915 N/A THR 219.A OG1 ASP 216.A OD1 no hydrogen 3.287 N/A ARG 220.A N ASP 216.A O no hydrogen 3.256 N/A ARG 220.A NH1 GLU 212.A OE1 no hydrogen 3.125 N/A ARG 220.A NH2 TYR 145.A O no hydrogen 3.283 N/A ARG 220.A NH2 GLU 212.A OE1 no hydrogen 2.546 N/A PHE 221.A N ALA 217.A O no hydrogen 2.946 N/A ILE 222.A N THR 218.A O no hydrogen 2.898 N/A LEU 223.A N THR 219.A O no hydrogen 2.899 N/A ASP 224.A N ARG 220.A O no hydrogen 2.994 N/A ASN 225.A ND2 PHE 221.A O no hydrogen 2.425 N/A PHE 228.A N ASN 225.A O no hydrogen 3.372 N/A VAL 229.A N TYR 234.A OH no hydrogen 3.136 N/A THR 230.A OG1 ILE 525.A O no hydrogen 2.436 N/A GLY 232.A N VAL 90.A O no hydrogen 2.966 N/A TRP 233.A NE1 ASP 276.A O no hydrogen 2.401 N/A TYR 234.A OH VAL 229.A O no hydrogen 2.677 N/A ARG 235.A NE GLU 271.A OE1 no hydrogen 2.901 N/A LEU 236.A N THR 86.A O no hydrogen 3.160 N/A LYS 237.A N ASN 267.A O no hydrogen 2.992 N/A LYS 237.A NZ ASP 266.A O no hydrogen 2.149 N/A ASN 242.A N ASN 241.A OD1 no hydrogen 2.354 N/A THR 243.A N ASN 241.A OD1 no hydrogen 3.120 N/A THR 243.A OG1 ASP 266.A OD2 no hydrogen 3.439 N/A ARG 248.A N GLU 260.A O no hydrogen 2.933 N/A ARG 248.A NE ASN 262.A OD1 no hydrogen 2.850 N/A ARG 248.A NH1 ALA 252.A O no hydrogen 2.468 N/A ARG 248.A NH2 TYR 140.A OH no hydrogen 3.105 N/A ARG 248.A NH2 ASN 262.A OD1 no hydrogen 3.287 N/A ALA 252.A N ALA 249.A O no hydrogen 2.719 N/A GLY 254.A N GLU 260.A OE1 no hydrogen 3.251 N/A THR 255.A N GLU 260.A OE2 no hydrogen 3.214 N/A THR 255.A OG1 SER 257.A OG no hydrogen 3.353 N/A THR 255.A OG1 GLU 260.A OE2 no hydrogen 2.284 N/A SER 256.A N ARG 410.A O no hydrogen 2.744 N/A SER 256.A OG ARG 410.A O no hydrogen 3.357 N/A SER 257.A OG VAL 135.A O no hydrogen 3.394 N/A SER 257.A OG THR 255.A OG1 no hydrogen 3.353 N/A ASP 258.A N ARG 134.A O no hydrogen 2.716 N/A VAL 259.A N ARG 134.A O no hydrogen 3.006 N/A PHE 261.A N ALA 136.A O no hydrogen 2.998 N/A ASN 262.A N ALA 245.A O no hydrogen 2.838 N/A ASN 262.A N GLN 246.A O no hydrogen 3.171 N/A ASN 262.A ND2 GLN 246.A O no hydrogen 3.438 N/A ASN 262.A ND2 GLN 246.A OE1 no hydrogen 2.670 N/A CYS 263.A N HIS 138.A O no hydrogen 2.881 N/A CYS 263.A SG THR 264.A O no hydrogen 3.480 N/A THR 264.A N ASN 267.A OD1 no hydrogen 2.745 N/A THR 264.A OG1 ASP 266.A OD1 no hydrogen 2.909 N/A THR 264.A OG1 ASP 266.A OD2 no hydrogen 3.105 N/A THR 264.A OG1 ASN 267.A OD1 no hydrogen 3.057 N/A ASN 267.A N THR 264.A O no hydrogen 2.690 N/A ASN 267.A ND2 THR 243.A OG1 no hydrogen 3.258 N/A ALA 269.A N ARG 235.A O no hydrogen 2.942 N/A TYR 280.A OH HIS 89.A ND1 no hydrogen 2.772 N/A LYS 281.A N GLU 378.A OE1 no hydrogen 2.992 N/A LYS 281.A NZ ALA 279.A O no hydrogen 3.302 N/A LYS 281.A NZ ASP 318.A OD2 no hydrogen 2.824 N/A LYS 281.A NZ GLU 325.A OE1 no hydrogen 3.425 N/A LEU 282.A N TYR 317.A O no hydrogen 3.018 N/A MET 283.A N PHE 379.A O no hydrogen 2.942 N/A CYS 284.A N LEU 315.A O no hydrogen 2.934 N/A CYS 284.A SG SER 500.A O no hydrogen 3.372 N/A PHE 285.A N THR 381.A O no hydrogen 3.179 N/A ASP 286.A N SER 313.A O no hydrogen 2.972 N/A ILE 287.A N ASP 389.A OD2 no hydrogen 3.259 N/A GLU 288.A N GLN 311.A O no hydrogen 2.692 N/A LYS 290.A N LEU 308.A O no hydrogen 2.791 N/A GLY 292.A N ASP 307.A OD1 no hydrogen 3.075 N/A LEU 297.A N ASP 295.A OD1 no hydrogen 3.067 N/A ALA 298.A N ASP 295.A O no hydrogen 3.343 N/A PHE 299.A N ARG 934.A O no hydrogen 2.657 N/A VAL 301.A N ASP 307.A OD2 no hydrogen 3.189 N/A HIS 304.A N VAL 301.A O no hydrogen 3.238 N/A GLU 306.A N GLU 306.A OE1 no hydrogen 2.969 N/A ASP 307.A N HIS 304.A O no hydrogen 3.136 N/A VAL 309.A N GLU 361.A OE2 no hydrogen 2.486 N/A ILE 310.A N GLU 288.A O no hydrogen 2.786 N/A GLN 311.A N GLU 288.A O no hydrogen 3.069 N/A GLN 311.A NE2 ARG 489.A O no hydrogen 3.280 N/A ILE 312.A N PHE 330.A O no hydrogen 2.947 N/A SER 313.A N ASP 286.A O no hydrogen 2.861 N/A SER 313.A OG CYS 496.A O no hydrogen 3.505 N/A SER 313.A OG SER 500.A OG no hydrogen 3.302 N/A CYS 314.A N LEU 328.A O no hydrogen 2.947 N/A LEU 315.A N CYS 284.A O no hydrogen 3.014 N/A LEU 316.A N HIS 326.A O no hydrogen 2.880 N/A TYR 317.A N LEU 282.A O no hydrogen 2.908 N/A ASP 318.A N ALA 323.A O no hydrogen 2.961 N/A LEU 319.A N TYR 280.A O no hydrogen 2.668 N/A SER 320.A N ASP 318.A OD1 no hydrogen 3.154 N/A SER 320.A OG ASP 318.A OD1 no hydrogen 2.648 N/A THR 321.A N ASP 318.A OD1 no hydrogen 3.339 N/A GLU 325.A N LEU 316.A O no hydrogen 2.772 N/A HIS 326.A N LEU 316.A O no hydrogen 3.074 N/A LEU 328.A N CYS 314.A O no hydrogen 2.930 N/A LEU 329.A N VAL 354.A O no hydrogen 2.989 N/A PHE 330.A N ILE 312.A O no hydrogen 2.934 N/A SER 331.A OG GLY 333.A O no hydrogen 2.868 N/A SER 331.A OG LEU 356.A O no hydrogen 3.083 N/A LEU 332.A N ILE 310.A O no hydrogen 2.798 N/A GLY 333.A N PHE 358.A O no hydrogen 2.620 N/A CYS 335.A SG ARG 489.A O no hydrogen 3.351 N/A ASP 336.A N PRO 486.A O no hydrogen 3.300 N/A LEU 342.A N PRO 338.A O no hydrogen 2.825 N/A ASN 343.A N GLU 339.A O no hydrogen 2.880 N/A GLU 344.A N SER 340.A O no hydrogen 2.959 N/A LEU 345.A N HIS 341.A O no hydrogen 3.005 N/A ALA 346.A N LEU 342.A O no hydrogen 2.951 N/A ALA 347.A N ASN 343.A O no hydrogen 2.847 N/A ARG 348.A N GLU 344.A O no hydrogen 3.162 N/A ARG 348.A N LEU 345.A O no hydrogen 3.076 N/A GLY 349.A N ALA 346.A O no hydrogen 3.413 N/A LEU 350.A N LEU 345.A O no hydrogen 3.332 N/A VAL 354.A N VAL 327.A O no hydrogen 2.779 N/A LEU 356.A N LEU 329.A O no hydrogen 2.577 N/A GLU 357.A N TYR 47.A O no hydrogen 2.733 N/A PHE 358.A N SER 331.A O no hydrogen 2.773 N/A GLU 361.A N ILE 18.A O no hydrogen 2.861 N/A GLU 363.A N SER 360.A OG no hydrogen 3.413 N/A MET 364.A N SER 360.A O no hydrogen 3.395 N/A LEU 365.A N GLU 361.A O no hydrogen 3.011 N/A LEU 366.A N PHE 362.A O no hydrogen 2.786 N/A ALA 367.A N GLU 363.A O no hydrogen 2.897 N/A PHE 368.A N MET 364.A O no hydrogen 2.893 N/A MET 369.A N LEU 365.A O no hydrogen 2.902 N/A THR 370.A N LEU 366.A O no hydrogen 2.774 N/A THR 370.A OG1 LEU 366.A O no hydrogen 2.542 N/A LEU 371.A N ALA 367.A O no hydrogen 2.851 N/A VAL 372.A N PHE 368.A O no hydrogen 2.841 N/A LYS 373.A N MET 369.A O no hydrogen 2.980 N/A LYS 373.A NZ GLY 409.A O no hydrogen 3.498 N/A LYS 373.A NZ MET 411.A O no hydrogen 3.316 N/A LYS 373.A NZ ASN 412.A OD1 no hydrogen 3.098 N/A GLN 374.A N THR 370.A O no hydrogen 2.818 N/A TYR 375.A N LEU 371.A O no hydrogen 2.790 N/A GLY 376.A N VAL 372.A O no hydrogen 3.064 N/A GLU 378.A N GLU 378.A OE1 no hydrogen 2.868 N/A PHE 379.A N LYS 281.A O no hydrogen 3.109 N/A VAL 380.A N VAL 439.A O no hydrogen 2.910 N/A THR 381.A N MET 283.A O no hydrogen 2.742 N/A THR 381.A OG1 ILE 441.A O no hydrogen 2.226 N/A TYR 383.A OH TYR 456.A O no hydrogen 2.532 N/A ASN 384.A N ASP 442.A OD1 no hydrogen 2.776 N/A ILE 385.A N ASP 442.A OD1 no hydrogen 3.391 N/A ASN 387.A ND2 ASN 384.A OD1 no hydrogen 3.408 N/A PHE 388.A N ASN 384.A O no hydrogen 3.141 N/A TRP 390.A N ILE 385.A O no hydrogen 2.881 N/A TRP 390.A NE1 ASN 440.A OD1 no hydrogen 3.061 N/A PHE 392.A N PHE 388.A O no hydrogen 2.776 N/A LEU 393.A N ASP 389.A O no hydrogen 2.925 N/A LEU 394.A N TRP 390.A O no hydrogen 2.868 N/A ALA 395.A N PRO 391.A O no hydrogen 2.873 N/A LYS 396.A N PHE 392.A O no hydrogen 2.965 N/A LYS 396.A NZ ALA 302.A O no hydrogen 3.333 N/A LYS 396.A NZ HIS 304.A O no hydrogen 3.123 N/A LYS 396.A NZ ASP 307.A O no hydrogen 2.776 N/A LEU 397.A N LEU 393.A O no hydrogen 2.797 N/A THR 398.A N LEU 394.A O no hydrogen 2.884 N/A THR 398.A OG1 LEU 394.A O no hydrogen 2.084 N/A ASP 399.A N ALA 395.A O no hydrogen 2.920 N/A ILE 400.A N LYS 396.A O no hydrogen 3.030 N/A TYR 401.A N LYS 396.A O no hydrogen 2.974 N/A TYR 401.A OH GLU 361.A OE1 no hydrogen 2.298 N/A LYS 402.A NZ ASP 399.A O no hydrogen 2.678 N/A VAL 403.A N LEU 397.A O no hydrogen 2.589 N/A TYR 408.A N LEU 405.A O no hydrogen 3.437 N/A ARG 410.A NE SER 257.A OG no hydrogen 2.719 N/A ARG 410.A NH2 GLY 127.A O no hydrogen 3.405 N/A ARG 410.A NH2 SER 257.A OG no hydrogen 2.992 N/A ASN 412.A N GLY 254.A O no hydrogen 3.194 N/A ASN 412.A ND2 PHE 253.A O no hydrogen 3.422 N/A ASN 412.A ND2 THR 255.A O no hydrogen 3.395 N/A ARG 414.A N ASP 406.A OD2 no hydrogen 3.071 N/A ARG 414.A NH2 ARG 5.A O no hydrogen 3.515 N/A GLY 415.A N ASP 406.A O no hydrogen 2.712 N/A ARG 418.A N LYS 434.A O no hydrogen 2.926 N/A TRP 420.A N LYS 432.A O no hydrogen 2.992 N/A SER 425.A N ILE 422.A O no hydrogen 2.884 N/A SER 431.A OG ASN 387.A OD1 no hydrogen 3.110 N/A LYS 432.A NZ ASP 533.A OD1 no hydrogen 3.110 N/A LYS 434.A N ARG 418.A O no hydrogen 2.927 N/A LYS 434.A NZ ASP 533.A OD1 no hydrogen 3.417 N/A ASN 436.A N VAL 416.A O no hydrogen 3.065 N/A VAL 439.A N GLU 378.A O no hydrogen 2.629 N/A ILE 441.A N VAL 380.A O no hydrogen 2.750 N/A MET 443.A N GLY 382.A O no hydrogen 2.809 N/A TYR 444.A N ASP 442.A OD1 no hydrogen 3.122 N/A TYR 444.A OH ASP 942.A OD1 no hydrogen 3.346 N/A ILE 446.A N ASP 442.A O no hydrogen 3.365 N/A ILE 447.A N MET 443.A O no hydrogen 2.953 N/A ILE 447.A N TYR 444.A O no hydrogen 3.216 N/A THR 448.A N TYR 444.A O no hydrogen 2.953 N/A THR 448.A OG1 TYR 444.A O no hydrogen 3.421 N/A THR 448.A OG1 GLY 445.A O no hydrogen 3.423 N/A LYS 450.A N ILE 447.A O no hydrogen 3.046 N/A LYS 450.A NZ GLU 515.A OE1 no hydrogen 2.571 N/A LEU 453.A N TYR 456.A OH no hydrogen 3.120 N/A SER 454.A OG LYS 832.A O no hydrogen 3.165 N/A TYR 456.A OH ILE 451.A O no hydrogen 2.581 N/A LYS 457.A N SER 455.A OG no hydrogen 3.314 N/A VAL 461.A N LYS 457.A O no hydrogen 2.885 N/A ALA 462.A N LEU 458.A O no hydrogen 2.859 N/A GLU 463.A N ASN 459.A O no hydrogen 2.921 N/A ALA 464.A N ALA 460.A O no hydrogen 2.905 N/A VAL 465.A N VAL 461.A O no hydrogen 2.878 N/A LEU 466.A N ALA 462.A O no hydrogen 3.066 N/A LYS 467.A NZ ALA 464.A O no hydrogen 3.084 N/A ASP 468.A N ALA 462.A O no hydrogen 3.177 N/A LYS 471.A NZ TYR 495.A OH no hydrogen 2.905 N/A SER 474.A OG ASP 477.A OD1 no hydrogen 2.840 N/A ARG 476.A N SER 474.A OG no hydrogen 3.072 N/A ASP 477.A N SER 474.A O no hydrogen 2.910 N/A TYR 481.A N ASP 477.A O no hydrogen 2.994 N/A TYR 482.A N ILE 478.A O no hydrogen 2.836 N/A TYR 482.A OH LEU 332.A O no hydrogen 3.058 N/A ALA 483.A N PRO 479.A O no hydrogen 2.863 N/A THR 484.A N TYR 481.A O no hydrogen 3.101 N/A THR 484.A OG1 ALA 480.A O no hydrogen 2.773 N/A THR 484.A OG1 TYR 481.A O no hydrogen 3.444 N/A ARG 489.A N GLY 485.A O no hydrogen 3.516 N/A ARG 489.A NE SER 334.A O no hydrogen 2.654 N/A ARG 489.A NH1 TYR 482.A O no hydrogen 2.690 N/A GLY 490.A N PRO 486.A O no hydrogen 2.905 N/A VAL 491.A N ALA 487.A O no hydrogen 2.926 N/A ILE 492.A N GLN 488.A O no hydrogen 2.996 N/A GLY 493.A N ARG 489.A O no hydrogen 2.867 N/A GLU 494.A N GLY 490.A O no hydrogen 2.851 N/A TYR 495.A N VAL 491.A O no hydrogen 3.091 N/A CYS 496.A N ILE 492.A O no hydrogen 2.944 N/A CYS 496.A SG ASP 286.A O no hydrogen 3.272 N/A CYS 496.A SG ASP 286.A OD2 no hydrogen 3.548 N/A CYS 496.A SG GLU 288.A OE1 no hydrogen 3.606 N/A ILE 497.A N GLY 493.A O no hydrogen 2.954 N/A GLN 498.A N GLU 494.A O no hydrogen 2.913 N/A GLN 498.A NE2 HIS 341.A ND1 no hydrogen 3.471 N/A ASP 499.A N TYR 495.A O no hydrogen 2.999 N/A SER 500.A N CYS 496.A O no hydrogen 3.103 N/A SER 500.A OG SER 313.A OG no hydrogen 3.302 N/A LEU 501.A N ILE 497.A O no hydrogen 2.932 N/A LEU 502.A N GLN 498.A O no hydrogen 3.024 N/A VAL 503.A N ASP 499.A O no hydrogen 3.036 N/A GLY 504.A N SER 500.A O no hydrogen 2.929 N/A GLN 505.A N LEU 501.A O no hydrogen 2.985 N/A GLN 505.A NE2 LEU 501.A O no hydrogen 3.644 N/A LEU 506.A N LEU 502.A O no hydrogen 2.970 N/A PHE 507.A N VAL 503.A O no hydrogen 2.981 N/A PHE 508.A N GLY 504.A O no hydrogen 2.943 N/A LYS 509.A N GLN 505.A O no hydrogen 2.918 N/A LYS 509.A N LEU 506.A O no hydrogen 3.056 N/A PHE 510.A N LEU 506.A O no hydrogen 2.979 N/A LEU 511.A N PHE 507.A O no hydrogen 2.607 N/A LEU 514.A N LEU 511.A O no hydrogen 3.362 N/A LEU 516.A N PRO 512.A O no hydrogen 2.923 N/A SER 517.A N HIS 513.A O no hydrogen 2.953 N/A SER 517.A OG HIS 513.A O no hydrogen 2.103 N/A ALA 518.A N LEU 514.A O no hydrogen 3.000 N/A VAL 519.A N GLU 515.A O no hydrogen 3.180 N/A ALA 520.A N LEU 516.A O no hydrogen 2.856 N/A ARG 521.A N SER 517.A O no hydrogen 2.845 N/A LEU 522.A N ALA 518.A O no hydrogen 3.039 N/A ALA 523.A N VAL 519.A O no hydrogen 2.889 N/A GLY 524.A N ALA 520.A O no hydrogen 3.113 N/A ASN 526.A ND2 ILE 93.A O no hydrogen 3.586 N/A ARG 529.A N ASN 526.A OD1 no hydrogen 2.937 N/A ARG 529.A NE ASP 533.A OD2 no hydrogen 3.472 N/A THR 530.A N ASN 526.A O no hydrogen 3.119 N/A THR 530.A OG1 ASN 526.A O no hydrogen 2.788 N/A ILE 531.A N ILE 527.A O no hydrogen 2.926 N/A TYR 532.A N THR 528.A O no hydrogen 3.008 N/A TYR 532.A OH ASN 440.A O no hydrogen 2.624 N/A ASP 533.A N ARG 529.A O no hydrogen 2.910 N/A GLY 534.A N TYR 532.A O no hydrogen 2.925 N/A ARG 538.A NH2 THR 530.A O no hydrogen 2.899 N/A VAL 539.A N GLN 535.A O no hydrogen 3.338 N/A PHE 540.A N GLN 536.A O no hydrogen 2.834 N/A THR 541.A N ILE 537.A O no hydrogen 2.981 N/A THR 541.A OG1 ILE 537.A O no hydrogen 2.427 N/A CYS 542.A N ARG 538.A O no hydrogen 3.089 N/A CYS 542.A SG LEU 522.A O no hydrogen 3.916 N/A CYS 542.A SG ALA 523.A O no hydrogen 3.583 N/A CYS 542.A SG ARG 538.A O no hydrogen 3.103 N/A LEU 543.A N VAL 539.A O no hydrogen 2.948 N/A LEU 544.A N PHE 540.A O no hydrogen 2.809 N/A ARG 545.A N THR 541.A O no hydrogen 3.004 N/A ARG 545.A NH1 ALA 523.A O no hydrogen 3.169 N/A LEU 546.A N CYS 542.A O no hydrogen 3.116 N/A ALA 547.A N LEU 543.A O no hydrogen 2.863 N/A ASP 548.A N LEU 544.A O no hydrogen 2.925 N/A GLN 549.A N ARG 545.A O no hydrogen 3.086 N/A LYS 550.A N LEU 546.A O no hydrogen 2.957 N/A GLY 551.A N ALA 547.A O no hydrogen 2.768 N/A PHE 552.A N ALA 547.A O no hydrogen 2.904 N/A LEU 554.A N GLU 212.A OE2 no hydrogen 3.415 N/A ASP 556.A N LYS 210.A O no hydrogen 3.104 N/A GLN 558.A NE2 HIS 697.A O no hydrogen 3.169 N/A ARG 560.A N THR 557.A O no hydrogen 2.888 N/A PHE 561.A N GLN 558.A O no hydrogen 2.662 N/A TYR 568.A OH TYR 690.A OH no hydrogen 3.131 N/A THR 577.A N ILE 755.A O no hydrogen 2.669 N/A SER 578.A OG LEU 807.A O no hydrogen 3.122 N/A SER 578.A OG ILE 808.A O no hydrogen 3.187 N/A GLY 579.A N LEU 807.A O no hydrogen 2.985 N/A HIS 581.A N LEU 805.A O no hydrogen 2.784 N/A HIS 581.A NE2 THR 577.A O no hydrogen 2.639 N/A VAL 585.A N PHE 802.A O no hydrogen 3.097 N/A VAL 586.A N VAL 764.A O no hydrogen 2.959 N/A VAL 587.A N LYS 800.A O no hydrogen 3.530 N/A PHE 588.A N ILE 762.A O no hydrogen 2.949 N/A ASP 589.A N GLU 797.A O no hydrogen 2.933 N/A ALA 591.A N LYS 795.A O no hydrogen 2.833 N/A SER 596.A N SER 592.A O no hydrogen 2.781 N/A SER 596.A OG SER 592.A O no hydrogen 2.763 N/A SER 596.A OG LEU 593.A O no hydrogen 2.464 N/A ILE 597.A N LEU 593.A O no hydrogen 2.885 N/A ILE 598.A N TYR 594.A O no hydrogen 2.960 N/A GLN 599.A N PRO 595.A O no hydrogen 2.997 N/A GLN 599.A NE2 SER 647.A O no hydrogen 2.699 N/A ALA 600.A N SER 596.A O no hydrogen 2.845 N/A HIS 601.A N ILE 597.A O no hydrogen 2.953 N/A ASN 602.A ND2 VAL 637.A O no hydrogen 2.875 N/A ASN 602.A ND2 ARG 642.A O no hydrogen 2.841 N/A LEU 603.A N ILE 598.A O no hydrogen 3.045 N/A CYS 604.A SG SER 606.A OG no hydrogen 3.427 N/A THR 607.A OG1 ASN 602.A O no hydrogen 2.576 N/A SER 609.A N PHE 635.A O no hydrogen 2.658 N/A SER 609.A OG GLU 180.A OE1 no hydrogen 2.898 N/A SER 609.A OG ARG 611.A O no hydrogen 2.799 N/A ALA 616.A N ASP 613.A O no hydrogen 2.992 N/A LEU 618.A N VAL 615.A O no hydrogen 3.221 N/A GLU 619.A N ASP 623.A OD2 no hydrogen 2.824 N/A GLY 621.A N TYR 624.A O no hydrogen 3.309 N/A ASP 623.A N GLU 619.A O no hydrogen 3.242 N/A LEU 625.A N PHE 636.A O no hydrogen 2.869 N/A ILE 627.A N LEU 634.A O no hydrogen 2.927 N/A VAL 629.A N ARG 632.A O no hydrogen 2.827 N/A ARG 632.A N VAL 629.A O no hydrogen 2.932 N/A ARG 633.A NH1 GLU 626.A OE2 no hydrogen 2.837 N/A LEU 634.A N ILE 627.A O no hydrogen 2.880 N/A PHE 635.A N SER 609.A O no hydrogen 3.070 N/A PHE 636.A N LEU 625.A O no hydrogen 2.902 N/A VAL 637.A N THR 607.A O no hydrogen 3.200 N/A LYS 638.A N ASP 623.A O no hydrogen 2.774 N/A HIS 640.A NE2 ASP 623.A OD1 no hydrogen 2.657 N/A VAL 641.A N LYS 638.A O no hydrogen 3.261 N/A ARG 642.A N LYS 638.A O no hydrogen 3.477 N/A ARG 642.A NH1 SER 606.A O no hydrogen 2.984 N/A SER 644.A N ASN 602.A OD1 no hydrogen 2.771 N/A SER 644.A OG LEU 603.A O no hydrogen 2.839 N/A SER 644.A OG SER 647.A OG no hydrogen 3.084 N/A SER 647.A N SER 644.A OG no hydrogen 2.918 N/A SER 647.A OG ILE 598.A O no hydrogen 3.343 N/A LEU 649.A N LEU 645.A O no hydrogen 3.227 N/A LEU 650.A N LEU 646.A O no hydrogen 3.032 N/A ARG 651.A N SER 647.A O no hydrogen 2.931 N/A ASP 652.A N ILE 648.A O no hydrogen 3.287 N/A TRP 653.A N LEU 649.A O no hydrogen 3.339 N/A LEU 654.A N LEU 650.A O no hydrogen 2.823 N/A ALA 655.A N ARG 651.A O no hydrogen 2.964 N/A MET 656.A N ASP 652.A O no hydrogen 3.115 N/A ARG 657.A N TRP 653.A O no hydrogen 3.027 N/A ARG 657.A NE GLN 679.A O no hydrogen 3.344 N/A ARG 657.A NE GLN 679.A OE1 no hydrogen 3.044 N/A ARG 657.A NH2 GLN 679.A OE1 no hydrogen 2.814 N/A LYS 658.A N LEU 654.A O no hydrogen 2.939 N/A GLN 659.A N ALA 655.A O no hydrogen 2.935 N/A ILE 660.A N MET 656.A O no hydrogen 3.076 N/A ARG 661.A N ARG 657.A O no hydrogen 2.980 N/A SER 662.A N LYS 658.A O no hydrogen 2.906 N/A SER 662.A OG GLN 659.A O no hydrogen 2.867 N/A ARG 663.A N ILE 660.A O no hydrogen 3.433 N/A ILE 664.A N ARG 661.A O no hydrogen 3.407 N/A GLN 666.A NE2 SER 662.A O no hydrogen 2.662 N/A SER 667.A OG ARG 663.A O no hydrogen 2.945 N/A GLU 671.A N SER 668.A O no hydrogen 3.175 N/A GLU 671.A N SER 668.A OG no hydrogen 3.289 N/A ALA 672.A N SER 668.A O no hydrogen 2.777 N/A VAL 673.A N PRO 669.A O no hydrogen 3.074 N/A LEU 675.A N GLU 671.A O no hydrogen 2.926 N/A ASP 676.A N ALA 672.A O no hydrogen 2.883 N/A LYS 677.A N VAL 673.A O no hydrogen 3.100 N/A LYS 677.A NZ LYS 450.A O no hydrogen 3.046 N/A GLN 678.A N LEU 674.A O no hydrogen 2.919 N/A GLN 678.A NE2 LEU 674.A O no hydrogen 3.527 N/A GLN 679.A N LEU 675.A O no hydrogen 2.974 N/A GLN 679.A NE2 ASP 676.A OD1 no hydrogen 2.770 N/A ALA 680.A N ASP 676.A O no hydrogen 3.021 N/A ALA 681.A N LYS 677.A O no hydrogen 3.021 N/A ILE 682.A N GLN 678.A O no hydrogen 3.079 N/A LYS 683.A N GLN 679.A O no hydrogen 2.849 N/A VAL 684.A N ALA 680.A O no hydrogen 2.977 N/A VAL 685.A N ALA 681.A O no hydrogen 3.081 N/A CYS 686.A N ILE 682.A O no hydrogen 3.019 N/A CYS 686.A N LYS 683.A O no hydrogen 3.157 N/A CYS 686.A SG ILE 682.A O no hydrogen 3.334 N/A ASN 687.A N LYS 683.A O no hydrogen 2.943 N/A SER 688.A N VAL 684.A O no hydrogen 2.867 N/A SER 688.A OG VAL 684.A O no hydrogen 2.363 N/A VAL 689.A N CYS 686.A O no hydrogen 3.121 N/A TYR 690.A OH TYR 568.A OH no hydrogen 3.131 N/A GLY 691.A N ASN 687.A O no hydrogen 2.977 N/A PHE 692.A N VAL 689.A O no hydrogen 3.171 N/A THR 693.A N VAL 689.A O no hydrogen 3.215 N/A THR 693.A OG1 TYR 690.A O no hydrogen 2.301 N/A GLY 694.A N TYR 690.A O no hydrogen 3.260 N/A GLY 698.A N VAL 695.A O no hydrogen 3.293 N/A LEU 699.A N GLN 536.A OE1 no hydrogen 2.944 N/A CYS 702.A N THR 693.A O no hydrogen 2.786 N/A CYS 702.A SG HIS 704.A ND1 no hydrogen 3.479 N/A ALA 706.A N CYS 702.A O no hydrogen 3.052 N/A ALA 707.A N LEU 703.A O no hydrogen 2.931 N/A THR 708.A N HIS 704.A O no hydrogen 2.886 N/A THR 708.A OG1 HIS 704.A O no hydrogen 2.224 N/A VAL 709.A N VAL 705.A O no hydrogen 2.867 N/A THR 710.A N ALA 706.A O no hydrogen 3.122 N/A THR 710.A OG1 GLN 569.A O no hydrogen 2.539 N/A THR 710.A OG1 ALA 706.A O no hydrogen 3.527 N/A THR 710.A OG1 ALA 707.A O no hydrogen 3.255 N/A THR 711.A N ALA 707.A O no hydrogen 2.839 N/A THR 711.A OG1 ALA 707.A O no hydrogen 2.509 N/A ILE 712.A N THR 708.A O no hydrogen 2.859 N/A GLY 713.A N VAL 709.A O no hydrogen 2.951 N/A ARG 714.A N THR 710.A O no hydrogen 2.969 N/A ARG 714.A NH1 GLN 569.A O no hydrogen 3.416 N/A ARG 714.A NH1 GLY 570.A O no hydrogen 2.407 N/A GLU 715.A N THR 711.A O no hydrogen 3.011 N/A MET 716.A N ILE 712.A O no hydrogen 2.843 N/A LEU 717.A N GLY 713.A O no hydrogen 2.962 N/A LEU 718.A N ARG 714.A O no hydrogen 3.077 N/A ALA 719.A N GLU 715.A O no hydrogen 2.833 N/A THR 720.A N MET 716.A O no hydrogen 2.910 N/A THR 720.A OG1 MET 716.A O no hydrogen 2.566 N/A ARG 721.A N LEU 717.A O no hydrogen 3.034 N/A ARG 721.A NE GLU 722.A OE2 no hydrogen 3.148 N/A ARG 721.A NH2 GLU 722.A OE2 no hydrogen 3.067 N/A GLU 722.A N LEU 718.A O no hydrogen 2.924 N/A TYR 723.A N ALA 719.A O no hydrogen 2.916 N/A TYR 723.A OH HIS 784.A NE2 no hydrogen 3.333 N/A VAL 724.A N THR 720.A O no hydrogen 2.970 N/A HIS 725.A N ARG 721.A O no hydrogen 3.002 N/A ALA 726.A N GLU 722.A O no hydrogen 2.917 N/A ARG 727.A N TYR 723.A O no hydrogen 2.919 N/A ARG 727.A NE HIS 784.A NE2 no hydrogen 3.217 N/A ARG 727.A NH2 ASP 737.A OD1 no hydrogen 2.855 N/A TRP 728.A NE1 ASP 737.A OD2 no hydrogen 2.538 N/A ALA 730.A N GLN 733.A OE1 no hydrogen 2.775 N/A GLN 733.A N ALA 730.A O no hydrogen 3.283 N/A GLN 733.A NE2 ALA 726.A O no hydrogen 3.389 N/A LEU 735.A N PHE 731.A O no hydrogen 2.916 N/A ALA 736.A N GLU 732.A O no hydrogen 2.822 N/A ASP 737.A N GLN 733.A O no hydrogen 3.032 N/A PHE 738.A N LEU 734.A O no hydrogen 2.892 N/A ALA 741.A N PHE 738.A O no hydrogen 2.961 N/A ALA 742.A N PRO 739.A O no hydrogen 3.016 N/A MET 744.A N ALA 741.A O no hydrogen 2.953 N/A ARG 745.A NH2 GLY 748.A O no hydrogen 2.390 N/A TYR 750.A OH TRP 728.A O no hydrogen 2.880 N/A SER 751.A N ARG 767.A O no hydrogen 3.362 N/A ILE 754.A N HIS 725.A NE2 no hydrogen 3.044 N/A ILE 755.A N PHE 763.A O no hydrogen 2.704 N/A ASP 758.A N SER 761.A O no hydrogen 3.247 N/A THR 759.A N ASP 758.A OD1 no hydrogen 3.117 N/A ILE 762.A N PHE 588.A O no hydrogen 2.930 N/A PHE 763.A N TYR 756.A O no hydrogen 2.899 N/A VAL 764.A N VAL 586.A O no hydrogen 2.786 N/A LEU 765.A N ARG 753.A O no hydrogen 2.925 N/A CYS 766.A N PRO 584.A O no hydrogen 2.926 N/A CYS 766.A SG VAL 764.A O no hydrogen 3.603 N/A ARG 767.A N LEU 765.A O no hydrogen 3.103 N/A THR 770.A N MET 744.A O no hydrogen 2.714 N/A THR 770.A OG1 MET 744.A O no hydrogen 2.991 N/A LEU 774.A N ALA 771.A O no hydrogen 3.468 N/A MET 777.A N GLY 773.A O no hydrogen 2.892 N/A ASP 779.A N THR 775.A O no hydrogen 3.085 N/A LYS 780.A NZ GLU 740.A OE1 no hydrogen 2.578 N/A MET 781.A N MET 777.A O no hydrogen 2.797 N/A ALA 782.A N GLY 778.A O no hydrogen 2.860 N/A SER 783.A N ASP 779.A O no hydrogen 2.967 N/A SER 783.A OG LYS 780.A O no hydrogen 3.442 N/A HIS 784.A N LYS 780.A O no hydrogen 2.914 N/A ILE 785.A N MET 781.A O no hydrogen 2.956 N/A SER 786.A N ALA 782.A O no hydrogen 2.927 N/A SER 786.A OG ALA 782.A O no hydrogen 2.519 N/A SER 786.A OG LEU 796.A O no hydrogen 3.172 N/A ARG 787.A N SER 783.A O no hydrogen 2.949 N/A ARG 787.A N HIS 784.A O no hydrogen 3.261 N/A ALA 788.A N HIS 784.A O no hydrogen 2.907 N/A LEU 789.A N ILE 785.A O no hydrogen 2.982 N/A ILE 794.A N LEU 791.A O no hydrogen 2.895 N/A LYS 795.A NZ GLU 797.A OE1 no hydrogen 3.496 N/A LEU 796.A N SER 786.A OG no hydrogen 2.914 N/A GLU 797.A N ASP 589.A O no hydrogen 2.988 N/A CYS 798.A SG LYS 800.A O no hydrogen 3.395 N/A GLU 799.A N VAL 587.A O no hydrogen 2.793 N/A LYS 800.A NZ GLU 799.A OE1 no hydrogen 2.477 N/A THR 801.A OG1 LYS 800.A O no hydrogen 2.681 N/A PHE 802.A N VAL 585.A O no hydrogen 3.093 N/A THR 803.A N VAL 816.A O no hydrogen 2.959 N/A THR 803.A OG1 VAL 816.A O no hydrogen 3.220 N/A LEU 805.A N HIS 581.A O no hydrogen 2.923 N/A LEU 806.A N ILE 814.A O no hydrogen 2.575 N/A LEU 807.A N GLY 579.A O no hydrogen 2.880 N/A ILE 808.A N LYS 812.A O no hydrogen 3.290 N/A ALA 809.A N LYS 812.A O no hydrogen 3.304 N/A LYS 810.A NZ VAL 573.A O no hydrogen 3.051 N/A LYS 811.A NZ ASP 758.A OD1 no hydrogen 3.240 N/A LYS 812.A N ALA 809.A O no hydrogen 3.484 N/A TYR 813.A N LYS 825.A O no hydrogen 2.905 N/A ILE 814.A N LEU 806.A O no hydrogen 2.914 N/A GLY 815.A N LEU 823.A O no hydrogen 2.970 N/A VAL 816.A N LYS 804.A O no hydrogen 3.090 N/A ILE 817.A N LYS 821.A O.A no hydrogen 2.597 N/A ILE 817.A N LYS 821.A O.B no hydrogen 2.606 N/A TYR 818.A N THR 801.A O no hydrogen 2.704 N/A LEU 823.A N GLY 815.A O no hydrogen 2.807 N/A LYS 825.A N TYR 813.A O no hydrogen 2.911 N/A ARG 831.A NE ASN 833.A OD1 no hydrogen 3.119 N/A ARG 831.A NH2 ASN 833.A OD1 no hydrogen 2.987 N/A PHE 837.A N ASP 902.A O no hydrogen 2.823 N/A ASN 839.A N CYS 835.A O no hydrogen 3.149 N/A ARG 840.A N ALA 836.A O no hydrogen 2.973 N/A ARG 840.A NH1 ASP 902.A OD1 no hydrogen 3.508 N/A ARG 840.A NH1 ASP 902.A OD2 no hydrogen 3.132 N/A ARG 840.A NH2 ASP 902.A OD1 no hydrogen 2.605 N/A THR 841.A N PHE 837.A O no hydrogen 3.031 N/A SER 842.A N ILE 838.A O no hydrogen 2.851 N/A SER 842.A OG ILE 838.A O no hydrogen 2.417 N/A SER 842.A OG ASN 839.A O no hydrogen 2.933 N/A ARG 843.A N ASN 839.A O no hydrogen 2.941 N/A ARG 843.A NE ASP 847.A OD1 no hydrogen 3.155 N/A ALA 844.A N ARG 840.A O no hydrogen 3.001 N/A LEU 845.A N THR 841.A O no hydrogen 3.009 N/A VAL 846.A N SER 842.A O no hydrogen 2.901 N/A ASP 847.A N ARG 843.A O no hydrogen 2.969 N/A LEU 848.A N ALA 844.A O no hydrogen 2.973 N/A LEU 849.A N LEU 845.A O no hydrogen 2.967 N/A PHE 850.A N VAL 846.A O no hydrogen 2.914 N/A TYR 851.A N ASP 847.A O no hydrogen 2.775 N/A ASP 852.A N ASP 847.A O no hydrogen 3.259 N/A THR 854.A OG1 ASP 853.A O no hydrogen 2.386 N/A VAL 855.A N ASP 852.A O no hydrogen 3.285 N/A SER 856.A N ASP 852.A O no hydrogen 3.244 N/A SER 856.A OG LEU 849.A O no hydrogen 2.010 N/A SER 856.A OG PHE 850.A O no hydrogen 3.365 N/A ALA 859.A N VAL 855.A O no hydrogen 2.735 N/A ALA 860.A N SER 856.A O no hydrogen 2.907 N/A ALA 861.A N GLY 857.A O no hydrogen 2.861 N/A LEU 862.A N ALA 858.A O no hydrogen 2.980 N/A LEU 862.A N ALA 859.A O no hydrogen 3.110 N/A GLU 864.A N ALA 861.A O no hydrogen 3.240 N/A GLU 869.A N PRO 866.A O no hydrogen 2.915 N/A TRP 870.A N ALA 867.A O no hydrogen 3.004 N/A TRP 870.A NE1 LEU 862.A O no hydrogen 2.732 N/A LEU 871.A N GLU 868.A O no hydrogen 2.955 N/A LEU 879.A N PRO 876.A O no hydrogen 2.927 N/A GLY 883.A N GLN 880.A O no hydrogen 2.990 N/A ALA 884.A N GLN 880.A O no hydrogen 3.019 N/A VAL 887.A N GLY 883.A O no hydrogen 2.861 N/A ASP 888.A N ALA 884.A O no hydrogen 2.726 N/A ALA 889.A N VAL 885.A O no hydrogen 2.903 N/A HIS 890.A N LEU 886.A O no hydrogen 2.899 N/A ARG 891.A N VAL 887.A O no hydrogen 2.925 N/A ARG 892.A N ASP 888.A O no hydrogen 2.585 N/A ARG 892.A NH1 ASP 888.A OD2 no hydrogen 2.365 N/A ILE 893.A N HIS 890.A O no hydrogen 3.150 N/A THR 894.A N HIS 890.A O no hydrogen 3.392 N/A THR 894.A N ARG 891.A O no hydrogen 3.043 N/A THR 894.A OG1 HIS 890.A O no hydrogen 3.532 N/A THR 894.A OG1 ARG 891.A O no hydrogen 2.863 N/A ARG 898.A NH1 ILE 893.A O no hydrogen 3.232 N/A GLN 901.A NE2 GLN 901.A O no hydrogen 3.570 N/A PHE 903.A N ILE 900.A O no hydrogen 2.980 N/A LEU 905.A N TYR 946.A O no hydrogen 2.865 N/A THR 906.A N ASN 833.A O no hydrogen 3.086 N/A THR 906.A OG1 LYS 832.A O no hydrogen 2.921 N/A THR 906.A OG1 ASN 833.A O no hydrogen 3.261 N/A LEU 909.A N ASP 942.A O no hydrogen 2.930 N/A SER 910.A OG LEU 909.A O no hydrogen 2.658 N/A ARG 914.A N HIS 912.A ND1 no hydrogen 3.332 N/A ALA 915.A N HIS 912.A O no hydrogen 2.650 N/A TYR 916.A OH LEU 909.A O no hydrogen 2.103 N/A TYR 916.A OH HIS 923.A NE2 no hydrogen 3.389 N/A LYS 919.A NZ TYR 916.A O no hydrogen 2.851 N/A ARG 920.A N ASN 918.A OD1 no hydrogen 3.434 N/A THR 925.A N LEU 921.A O no hydrogen 2.859 N/A THR 925.A OG1 LEU 921.A O no hydrogen 3.382 N/A THR 925.A OG1 SER 969.A O no hydrogen 2.334 N/A VAL 926.A N ALA 922.A O no hydrogen 3.006 N/A TYR 927.A N HIS 923.A O no hydrogen 2.901 N/A TYR 928.A N LEU 924.A O no hydrogen 3.013 N/A LYS 929.A N THR 925.A O no hydrogen 2.890 N/A LEU 930.A N VAL 926.A O no hydrogen 2.882 N/A MET 931.A N TYR 927.A O no hydrogen 2.961 N/A ALA 932.A N TYR 928.A O no hydrogen 2.931 N/A ARG 933.A N LYS 929.A O no hydrogen 3.218 N/A ARG 933.A NH1 GLU 973.A OE2 no hydrogen 2.398 N/A ARG 933.A NH2 GLU 973.A OE1 no hydrogen 3.036 N/A ARG 933.A NH2 GLU 973.A OE2 no hydrogen 2.738 N/A ALA 935.A N LEU 930.A O no hydrogen 2.950 N/A LYS 941.A NZ SER 910.A O no hydrogen 3.410 N/A ASP 942.A N SER 939.A O no hydrogen 2.799 N/A ARG 943.A NE SER 454.A O no hydrogen 2.841 N/A ARG 943.A NH2 LYS 832.A O no hydrogen 2.851 N/A ILE 944.A N ALA 907.A O no hydrogen 2.801 N/A TYR 946.A N LEU 905.A O no hydrogen 2.897 N/A VAL 947.A N GLU 973.A O no hydrogen 2.696 N/A ILE 948.A N TYR 990.A OH no hydrogen 3.014 N/A VAL 949.A N LEU 971.A O no hydrogen 3.250 N/A ALA 950.A N ALA 984.A O no hydrogen 2.713 N/A GLN 951.A NE2 ARG 964.A O no hydrogen 2.991 N/A VAL 955.A N THR 952.A OG1 no hydrogen 3.181 N/A GLU 956.A N THR 952.A O no hydrogen 3.077 N/A GLU 957.A N ARG 953.A O no hydrogen 2.969 N/A THR 958.A N GLU 954.A O no hydrogen 2.951 N/A THR 958.A OG1 GLU 954.A O no hydrogen 2.676 N/A VAL 959.A N VAL 955.A O no hydrogen 2.896 N/A ALA 960.A N GLU 956.A O no hydrogen 2.955 N/A ARG 961.A N GLU 957.A O no hydrogen 2.871 N/A LEU 962.A N THR 958.A O no hydrogen 2.992 N/A ALA 963.A N VAL 959.A O no hydrogen 2.676 N/A LEU 967.A N GLU 970.A OE1 no hydrogen 2.883 N/A SER 969.A OG ARG 920.A O no hydrogen 2.893 N/A GLU 970.A N LEU 967.A O no hydrogen 3.266 N/A LEU 971.A N LEU 967.A O no hydrogen 3.272 N/A ASP 974.A N GLU 973.A OE2 no hydrogen 3.290 N/A TYR 977.A N ASP 974.A OD2 no hydrogen 3.361 N/A ALA 978.A N ASP 974.A O no hydrogen 2.973 N/A ILE 979.A N PRO 975.A O no hydrogen 2.899 N/A ALA 980.A N ALA 976.A O no hydrogen 2.982 N/A HIS 981.A N TYR 977.A O no hydrogen 2.890 N/A VAL 983.A N HIS 981.A O no hydrogen 2.535 N/A ASN 986.A N ILE 948.A O no hydrogen 2.642 N/A ASN 986.A ND2 VAL 949.A O no hydrogen 3.529 N/A TYR 989.A N ASN 986.A OD1 no hydrogen 2.643 N/A TYR 990.A N ASN 986.A O no hydrogen 2.990 N/A TYR 990.A OH PHE 903.A O no hydrogen 2.553 N/A PHE 991.A N THR 987.A O no hydrogen 2.943 N/A SER 992.A N ASP 988.A O no hydrogen 2.987 N/A SER 992.A OG TYR 989.A O no hydrogen 2.976 N/A SER 992.A OG HIS 993.A ND1 no hydrogen 3.178 N/A HIS 993.A N TYR 989.A O no hydrogen 2.907 N/A HIS 993.A ND1 SER 992.A OG no hydrogen 3.178 N/A LEU 994.A N TYR 990.A O no hydrogen 2.910 N/A LEU 995.A N PHE 991.A O no hydrogen 2.992 N/A GLY 996.A N SER 992.A O no hydrogen 2.871 N/A ALA 997.A N HIS 993.A O no hydrogen 2.906 N/A ALA 998.A N LEU 994.A O no hydrogen 2.995 N/A CYS 999.A N LEU 995.A O no hydrogen 2.835 N/A CYS 999.A SG ALA 1010.A O no hydrogen 3.312 N/A VAL 1000.A N GLY 996.A O no hydrogen 2.865 N/A THR 1001.A N ALA 997.A O no hydrogen 3.023 N/A THR 1001.A OG1 ALA 997.A O no hydrogen 3.515 N/A PHE 1002.A N ALA 998.A O no hydrogen 2.920 N/A LYS 1003.A NZ VAL 1000.A O no hydrogen 2.948 N/A LEU 1005.A N PHE 1002.A O no hydrogen 3.230 N/A PHE 1006.A N LYS 1003.A O no hydrogen 3.091 N/A ASN 1008.A N LYS 1003.A O no hydrogen 2.578 N/A ASN 1008.A ND2 ILE 808.A O no hydrogen 2.742 N/A ASN 1009.A N PHE 1006.A O no hydrogen 3.406 N/A ILE 1012.A N ASN 1009.A OD1 no hydrogen 2.977 N/A THR 1013.A N ASN 1009.A O no hydrogen 3.185 N/A THR 1013.A OG1 ASN 1009.A O no hydrogen 2.595 N/A GLU 1014.A N ALA 1010.A O no hydrogen 2.818 N/A SER 1015.A N LYS 1011.A O.A no hydrogen 2.922 N/A SER 1015.A N LYS 1011.A O.B no hydrogen 3.110 N/A SER 1015.A OG ILE 1012.A O no hydrogen 2.749 N/A LEU 1016.A N ILE 1012.A O no hydrogen 2.908 N/A LEU 1017.A N THR 1013.A O no hydrogen 2.798 N/A LYS 1018.A N GLU 1014.A O no hydrogen 3.076 N/A LYS 1018.A NZ GLU 1014.A OE2 no hydrogen 2.601 N/A ARG 1019.A NH1 LEU 871.A O no hydrogen 2.571 N/A ARG 1019.A NH2 LEU 871.A O no hydrogen 3.061 N/A PHE 1020.A N LEU 1017.A O no hydrogen 3.144 N/A GLU 1023.A N GLU 1023.A OE1 no hydrogen 2.961 N/A VAL 1031.A N PRO 1028.A O no hydrogen 3.079 N/A ALA 1032.A N PRO 1028.A O no hydrogen 3.154 N/A ARG 1034.A NE ASP 1030.A O no hydrogen 2.395 N/A ARG 1034.A NH2 ASP 1030.A OD1 no hydrogen 3.059 N/A LEU 1035.A N VAL 1031.A O no hydrogen 2.981 N/A ARG 1036.A N ALA 1032.A O no hydrogen 2.816 N/A ALA 1037.A N ALA 1033.A O no hydrogen 2.908 N/A ALA 1038.A N LEU 1035.A O no hydrogen 3.024 N/A GLY 1039.A N ARG 1036.A O no hydrogen 3.378 N/A PHE 1040.A N LEU 1035.A O no hydrogen 3.193 N/A GLY 1044.A N THR 1052.A OG1 no hydrogen 2.815 N/A ALA 1047.A N ALA 1045.A O no hydrogen 2.662 N/A THR 1048.A OG1 GLU 1051.A OE1 no hydrogen 2.146 N/A THR 1052.A N THR 1048.A O no hydrogen 3.035 N/A THR 1052.A OG1 GLY 1044.A O no hydrogen 3.561 N/A ARG 1053.A N ALA 1049.A O no hydrogen 2.898 N/A ARG 1053.A NH1 GLU 1050.A OE2 no hydrogen 2.394 N/A ARG 1054.A N GLU 1050.A O no hydrogen 2.883 N/A MET 1055.A N GLU 1051.A O no hydrogen 2.872 N/A LEU 1056.A N THR 1052.A O no hydrogen 2.981 N/A HIS 1057.A N ARG 1053.A O no hydrogen 2.985 N/A HIS 1057.A ND1 ARG 1053.A O no hydrogen 2.922 N/A ARG 1058.A N ARG 1054.A O no hydrogen 2.971 N/A ALA 1059.A N MET 1055.A O no hydrogen 2.866 N/A PHE 1060.A N LEU 1056.A O no hydrogen 2.845 N/A ASP 1061.A N HIS 1057.A O no hydrogen 3.072 N/A THR 1062.A N ARG 1058.A O no hydrogen 2.862 N/A THR 1062.A OG1 ARG 1058.A O no hydrogen 3.039 N/A LEU 1063.A N ALA 1059.A O no hydrogen 2.873 N/A ALA 1064.A N PHE 1060.A O no hydrogen 3.138 N/A