Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8d0k_F.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG ASP 2.A OD2 no hydrogen 2.909 N/A LEU 8.A N LEU 6.A O no hydrogen 2.673 N/A VAL 9.A N VAL 17.A O no hydrogen 2.349 N/A LYS 10.A NZ GLU 14.A O no hydrogen 2.820 N/A GLY 11.A N GLU 15.A O no hydrogen 3.367 N/A GLU 14.A N GLY 11.A O no hydrogen 3.287 N/A VAL 17.A N VAL 9.A O no hydrogen 2.847 N/A PHE 18.A N VAL 178.A O no hydrogen 2.828 N/A PHE 20.A N LEU 176.A O no hydrogen 3.385 N/A TYR 21.A N LYS 41.A O no hydrogen 3.122 N/A TRP 22.A NE1 GLY 172.A O no hydrogen 2.611 N/A LEU 23.A N PHE 39.A O no hydrogen 2.418 N/A ASP 24.A N PHE 39.A O no hydrogen 3.216 N/A TYR 26.A N PHE 37.A O no hydrogen 2.840 N/A GLN 29.A N GLN 29.A OE1 no hydrogen 2.661 N/A ASN 31.A N ASP 28.A OD1 no hydrogen 3.247 N/A GLN 32.A N ASP 28.A O no hydrogen 3.055 N/A VAL 36.A N VAL 57.A O no hydrogen 3.447 N/A PHE 37.A N TYR 26.A O no hydrogen 2.761 N/A LEU 38.A N VAL 55.A O no hydrogen 2.777 N/A PHE 39.A N ASP 24.A O no hydrogen 2.807 N/A GLY 40.A N CYS 53.A O no hydrogen 3.170 N/A LYS 41.A N TYR 21.A O no hydrogen 3.126 N/A LYS 41.A NZ HIS 50.A O no hydrogen 2.954 N/A VAL 42.A N VAL 51.A O no hydrogen 2.871 N/A TRP 43.A NE1 GLU 45.A OE1 no hydrogen 2.314 N/A ILE 44.A N THR 49.A O no hydrogen 2.568 N/A GLU 48.A N GLU 45.A O no hydrogen 3.281 N/A THR 49.A N ILE 44.A O no hydrogen 3.127 N/A HIS 50.A N THR 49.A OG1 no hydrogen 2.599 N/A VAL 51.A N VAL 42.A O no hydrogen 2.938 N/A SER 52.A OG ASP 307.A OD2 no hydrogen 3.491 N/A CYS 53.A N GLY 40.A O no hydrogen 2.740 N/A CYS 54.A N VAL 193.A O no hydrogen 2.560 N/A VAL 55.A N LEU 38.A O no hydrogen 3.054 N/A VAL 57.A N VAL 36.A O no hydrogen 3.106 N/A LYS 58.A N ALA 197.A O no hydrogen 3.238 N/A ARG 62.A N TYR 134.A O no hydrogen 2.525 N/A ARG 62.A NH1 THR 156.A O no hydrogen 2.882 N/A ARG 62.A NH2 GLN 140.A OE1 no hydrogen 2.615 N/A LEU 64.A N VAL 132.A O no hydrogen 3.145 N/A TYR 65.A N PHE 154.A O no hydrogen 3.164 N/A PHE 66.A N LEU 130.A O no hydrogen 3.072 N/A LEU 67.A N HIS 152.A O no hydrogen 2.348 N/A ARG 69.A N THR 149.A O no hydrogen 2.363 N/A ARG 69.A NE GLY 147.A O no hydrogen 2.790 N/A ILE 73.A N GLU 148.A O no hydrogen 3.226 N/A ASP 74.A N LYS 79.A O no hydrogen 2.930 N/A ASN 76.A N ASP 74.A OD2 no hydrogen 2.913 N/A THR 77.A N ASP 74.A OD2 no hydrogen 2.415 N/A THR 77.A OG1 ASP 74.A OD2 no hydrogen 2.679 N/A GLY 78.A N ASP 74.A O no hydrogen 3.133 N/A LYS 79.A NZ GLY 78.A O no hydrogen 2.377 N/A THR 83.A OG1 PRO 84.A O no hydrogen 3.359 N/A SER 86.A OG ASP 89.A OD1 no hydrogen 2.274 N/A ASP 89.A N SER 86.A OG no hydrogen 3.334 N/A VAL 90.A N SER 86.A O no hydrogen 3.027 N/A TYR 91.A N MET 87.A O no hydrogen 2.936 N/A GLU 92.A N LYS 88.A O no hydrogen 2.886 N/A GLU 93.A N ASP 89.A O no hydrogen 2.913 N/A PHE 94.A N VAL 90.A O no hydrogen 2.902 N/A ASP 95.A N TYR 91.A O no hydrogen 2.893 N/A GLU 96.A N GLU 92.A O no hydrogen 2.929 N/A LYS 97.A N GLU 93.A O no hydrogen 2.909 N/A LYS 97.A N PHE 94.A O no hydrogen 3.343 N/A ILE 98.A N PHE 94.A O no hydrogen 2.863 N/A ALA 99.A N PHE 94.A O no hydrogen 3.237 N/A THR 100.A OG1 GLU 96.A O no hydrogen 2.778 N/A THR 100.A OG1 LYS 97.A O no hydrogen 2.601 N/A LYS 101.A N LYS 97.A O no hydrogen 2.948 N/A TYR 102.A N ILE 98.A O no hydrogen 2.901 N/A LYS 103.A NZ LYS 101.A O no hydrogen 3.105 N/A ILE 104.A N ALA 99.A O no hydrogen 3.137 N/A LYS 108.A N LYS 133.A O no hydrogen 2.947 N/A LYS 110.A N GLU 131.A O no hydrogen 3.340 N/A VAL 112.A N TYR 129.A O no hydrogen 2.682 N/A LYS 114.A NZ ASN 477.A OD1 no hydrogen 3.375 N/A LYS 114.A NZ TYR 478.A O no hydrogen 2.759 N/A ASN 115.A N ASN 477.A O no hydrogen 3.164 N/A TYR 116.A N GLU 125.A O no hydrogen 3.484 N/A GLU 131.A N LYS 110.A O no hydrogen 3.160 N/A VAL 132.A N LEU 64.A O no hydrogen 3.320 N/A LYS 133.A N LYS 108.A O no hydrogen 2.739 N/A TYR 134.A N ARG 62.A O no hydrogen 3.384 N/A GLU 137.A N SER 135.A OG no hydrogen 3.272 N/A LEU 145.A N PRO 142.A O no hydrogen 3.272 N/A LYS 146.A NZ SER 151.A O no hydrogen 2.971 N/A GLY 147.A N PHE 150.A O no hydrogen 2.575 N/A GLU 148.A N GLU 93.A OE2 no hydrogen 2.550 N/A THR 149.A N GLU 93.A OE1 no hydrogen 3.067 N/A THR 149.A OG1 GLU 93.A OE1 no hydrogen 3.063 N/A SER 151.A N LEU 67.A O no hydrogen 2.641 N/A SER 151.A OG LEU 67.A O no hydrogen 3.287 N/A PHE 154.A N TYR 65.A O no hydrogen 2.647 N/A THR 156.A OG1 ASP 482.A OD2 no hydrogen 3.326 N/A THR 158.A OG1 GLY 155.A O no hydrogen 3.530 N/A GLU 162.A N SER 159.A OG no hydrogen 3.339 N/A LEU 163.A N SER 159.A O no hydrogen 3.416 N/A PHE 164.A N SER 160.A O no hydrogen 2.886 N/A LEU 165.A N LEU 161.A O no hydrogen 2.922 N/A MET 166.A N GLU 162.A O no hydrogen 2.891 N/A ASN 167.A N LEU 163.A O no hydrogen 2.909 N/A ARG 168.A N LEU 165.A O no hydrogen 3.442 N/A ARG 168.A NE VAL 203.A O no hydrogen 2.985 N/A ARG 168.A NH2 VAL 203.A O no hydrogen 2.405 N/A LYS 169.A N MET 166.A O no hydrogen 3.338 N/A CYS 174.A SG GLY 172.A O no hydrogen 3.820 N/A CYS 174.A SG TRP 175.A O no hydrogen 3.780 N/A LEU 176.A N PHE 20.A O no hydrogen 3.010 N/A GLU 177.A N ASN 204.A O no hydrogen 3.129 N/A VAL 178.A N PHE 18.A O no hydrogen 2.666 N/A LYS 179.A N LEU 202.A O no hydrogen 3.167 N/A LYS 179.A NZ GLU 177.A O no hydrogen 3.024 N/A LYS 179.A NZ GLU 177.A OE1 no hydrogen 2.663 N/A LYS 179.A NZ LEU 202.A O no hydrogen 3.439 N/A LYS 179.A NZ ASN 204.A OD1 no hydrogen 3.099 N/A GLN 182.A N MET 196.A O no hydrogen 3.195 N/A GLN 182.A NE2 SER 180.A O no hydrogen 2.726 N/A GLN 186.A N ASN 185.A OD1 no hydrogen 2.811 N/A VAL 188.A N GLU 194.A OE1 no hydrogen 3.008 N/A SER 189.A N GLU 194.A OE2 no hydrogen 2.870 N/A TRP 190.A N ARG 341.A O no hydrogen 3.007 N/A CYS 191.A N SER 189.A OG no hydrogen 3.138 N/A VAL 193.A N SER 52.A O no hydrogen 3.183 N/A ALA 195.A N CYS 54.A O no hydrogen 2.407 N/A MET 196.A N GLN 182.A O no hydrogen 3.029 N/A ALA 197.A N MET 56.A O no hydrogen 2.871 N/A ASN 204.A N GLU 177.A O no hydrogen 3.375 N/A ILE 206.A N TRP 175.A O no hydrogen 2.741 N/A SER 210.A OG ASP 248.A OD2 no hydrogen 3.379 N/A LEU 214.A N PHE 245.A O no hydrogen 3.385 N/A VAL 215.A N ASP 309.A OD2 no hydrogen 3.167 N/A MET 217.A N ILE 310.A O no hydrogen 2.694 N/A SER 220.A N ALA 238.A O no hydrogen 3.197 N/A LYS 222.A NZ THR 422.A OG1 no hydrogen 2.682 N/A MET 224.A N GLU 233.A O no hydrogen 2.693 N/A ASN 226.A N GLN 231.A O no hydrogen 3.048 N/A LYS 228.A N ASN 226.A OD1 no hydrogen 2.610 N/A ASN 229.A N ASN 226.A OD1 no hydrogen 3.389 N/A ASN 229.A ND2 GLN 231.A OE1 no hydrogen 3.294 N/A GLN 231.A N ASN 229.A OD1 no hydrogen 3.267 N/A GLU 233.A N MET 224.A O no hydrogen 2.657 N/A ILE 235.A N LYS 222.A O no hydrogen 2.895 N/A MET 237.A N VAL 262.A O no hydrogen 2.767 N/A ALA 239.A N PHE 260.A O no hydrogen 3.383 N/A LEU 240.A N ALA 218.A O no hydrogen 3.012 N/A VAL 241.A N SER 258.A O no hydrogen 2.757 N/A LYS 249.A NZ ASP 248.A OD1 no hydrogen 2.912 N/A ALA 250.A N ASP 580.A OD1 no hydrogen 3.049 N/A LYS 253.A NZ ALA 251.A O no hydrogen 3.025 N/A LYS 253.A NZ PRO 252.A O no hydrogen 3.130 N/A GLN 257.A N VAL 241.A O no hydrogen 2.473 N/A SER 258.A N VAL 241.A O no hydrogen 3.462 N/A PHE 260.A N ALA 239.A O no hydrogen 3.406 N/A VAL 263.A N GLU 287.A O no hydrogen 3.233 N/A SER 264.A OG ALA 289.A O no hydrogen 2.988 N/A LYS 265.A N SER 264.A OG no hydrogen 2.677 N/A CYS 269.A SG ILE 270.A O no hydrogen 3.307 N/A VAL 278.A N ALA 274.A O no hydrogen 2.838 N/A ILE 279.A N PHE 275.A O no hydrogen 2.907 N/A GLU 280.A N LYS 276.A O no hydrogen 2.898 N/A LYS 281.A N GLU 277.A O no hydrogen 2.901 N/A LYS 282.A N VAL 278.A O no hydrogen 2.821 N/A ASN 283.A N ILE 279.A O no hydrogen 2.530 N/A VAL 286.A N VAL 284.A O no hydrogen 2.697 N/A GLU 287.A N CYS 261.A O no hydrogen 2.844 N/A ALA 289.A N VAL 263.A O no hydrogen 2.683 N/A THR 291.A OG1 THR 294.A OG1 no hydrogen 2.251 N/A THR 294.A OG1 THR 291.A OG1 no hydrogen 2.251 N/A LEU 295.A N THR 291.A O no hydrogen 2.963 N/A LEU 296.A N GLU 292.A O no hydrogen 2.931 N/A GLY 297.A N ARG 293.A O no hydrogen 2.889 N/A PHE 298.A N THR 294.A O no hydrogen 2.906 N/A PHE 299.A N LEU 295.A O no hydrogen 2.879 N/A LEU 300.A N LEU 296.A O no hydrogen 2.934 N/A ALA 301.A N GLY 297.A O no hydrogen 2.878 N/A LYS 302.A N PHE 298.A O no hydrogen 2.896 N/A VAL 303.A N PHE 299.A O no hydrogen 2.946 N/A HIS 304.A N LEU 300.A O no hydrogen 2.880 N/A LYS 305.A N ALA 301.A O no hydrogen 2.893 N/A ILE 306.A N LYS 302.A O no hydrogen 2.909 N/A ASP 307.A N VAL 303.A O no hydrogen 2.624 N/A ASP 309.A N VAL 215.A O no hydrogen 3.210 N/A ILE 310.A N VAL 215.A O no hydrogen 2.686 N/A ILE 311.A N MET 366.A O no hydrogen 2.673 N/A VAL 312.A N MET 217.A O no hydrogen 3.145 N/A ASN 315.A N ASP 369.A OD1 no hydrogen 2.765 N/A TYR 317.A N ASP 369.A OD2 no hydrogen 3.438 N/A PHE 319.A N ASN 315.A O no hydrogen 3.121 N/A LEU 321.A N ILE 316.A O no hydrogen 2.631 N/A GLU 322.A N GLU 322.A OE1 no hydrogen 3.031 N/A VAL 323.A N PHE 319.A O no hydrogen 2.968 N/A LEU 324.A N GLU 320.A O no hydrogen 2.884 N/A LEU 325.A N LEU 321.A O no hydrogen 2.958 N/A GLN 326.A N GLU 322.A O no hydrogen 2.881 N/A ARG 327.A N VAL 323.A O no hydrogen 2.915 N/A ILE 328.A N LEU 324.A O no hydrogen 2.898 N/A ASN 329.A N LEU 325.A O no hydrogen 2.924 N/A VAL 330.A N GLN 326.A O no hydrogen 2.891 N/A CYS 331.A N ARG 327.A O no hydrogen 2.954 N/A CYS 331.A SG GLU 292.A OE1 no hydrogen 3.756 N/A LYS 332.A N ASN 329.A O no hydrogen 3.237 N/A ALA 333.A N ILE 328.A O no hydrogen 3.231 N/A LYS 338.A N HIS 335.A O no hydrogen 3.416 N/A ILE 339.A N TRP 336.A O no hydrogen 3.490 N/A GLY 340.A N SER 337.A O no hydrogen 3.109 N/A LYS 343.A N VAL 188.A O no hydrogen 3.187 N/A LYS 343.A NZ SER 189.A O no hydrogen 2.518 N/A GLY 355.A N GLY 352.A O no hydrogen 2.990 N/A ARG 359.A N GLY 355.A O no hydrogen 3.309 N/A ARG 359.A NH2 SER 354.A O no hydrogen 3.537 N/A ASN 360.A N PHE 356.A O no hydrogen 2.939 N/A ALA 361.A N GLY 357.A O no hydrogen 2.905 N/A THR 362.A OG1 GLU 358.A O no hydrogen 3.111 N/A THR 362.A OG1 ARG 359.A O no hydrogen 2.823 N/A CYS 363.A SG ASN 360.A O no hydrogen 3.285 N/A CYS 363.A SG ALA 361.A O no hydrogen 3.994 N/A GLY 364.A N ASP 24.A OD2 no hydrogen 2.697 N/A ARG 365.A NE ILE 339.A O no hydrogen 2.821 N/A ARG 365.A NE GLY 340.A O no hydrogen 3.205 N/A ARG 365.A NH1 ASP 307.A OD1 no hydrogen 2.544 N/A ARG 365.A NH1 PRO 308.A O no hydrogen 2.334 N/A ARG 365.A NH2 ASP 307.A OD1 no hydrogen 3.360 N/A ARG 365.A NH2 GLY 340.A O no hydrogen 2.547 N/A MET 366.A N ASP 309.A O no hydrogen 2.678 N/A CYS 368.A N ILE 311.A O no hydrogen 2.800 N/A CYS 368.A SG ASP 369.A O no hydrogen 3.934 N/A CYS 368.A SG SER 373.A OG no hydrogen 3.516 N/A VAL 370.A N GLY 313.A O no hydrogen 3.058 N/A GLU 371.A N ASP 369.A OD1 no hydrogen 3.298 N/A SER 373.A N ASP 369.A O no hydrogen 3.311 N/A SER 373.A OG ASP 369.A O no hydrogen 2.970 N/A ALA 374.A N VAL 370.A O no hydrogen 2.891 N/A LYS 375.A N GLU 371.A O no hydrogen 2.912 N/A GLU 376.A N ILE 372.A O no hydrogen 2.906 N/A LEU 377.A N ALA 374.A O no hydrogen 3.371 N/A ILE 378.A N ALA 374.A O no hydrogen 3.242 N/A LYS 381.A N GLN 391.A OE1 no hydrogen 2.931 N/A SER 386.A N HIS 384.A ND1 no hydrogen 3.211 N/A LEU 388.A N HIS 384.A O no hydrogen 3.072 N/A VAL 389.A N LEU 385.A O no hydrogen 2.924 N/A GLN 390.A N SER 386.A O no hydrogen 2.894 N/A GLN 391.A N GLU 387.A O no hydrogen 2.879 N/A ILE 392.A N LEU 388.A O no hydrogen 2.920 N/A ILE 392.A N VAL 389.A O no hydrogen 3.220 N/A LYS 394.A N VAL 389.A O no hydrogen 2.517 N/A LYS 394.A NZ ILE 392.A O no hydrogen 2.707 N/A THR 395.A OG1 LEU 393.A O no hydrogen 3.110 N/A ARG 397.A NH1 SER 386.A OG no hydrogen 3.188 N/A ASN 404.A N PRO 401.A O no hydrogen 3.267 N/A ILE 405.A N PRO 401.A O no hydrogen 3.300 N/A GLN 406.A N MET 402.A O no hydrogen 2.903 N/A MET 408.A N ILE 405.A O no hydrogen 3.064 N/A TYR 409.A OH SER 264.A O no hydrogen 2.358 N/A SER 410.A N ASN 407.A O no hydrogen 3.193 N/A SER 410.A OG ASN 407.A O no hydrogen 3.033 N/A SER 410.A OG GLN 414.A OE1 no hydrogen 2.623 N/A GLN 414.A NE2 ASN 407.A O no hydrogen 3.654 N/A LEU 415.A N GLU 411.A O no hydrogen 3.377 N/A LEU 416.A N SER 412.A O no hydrogen 2.911 N/A TYR 417.A N SER 413.A O no hydrogen 2.887 N/A LEU 418.A N GLN 414.A O no hydrogen 2.925 N/A LEU 419.A N LEU 415.A O no hydrogen 2.898 N/A GLU 420.A N LEU 416.A O no hydrogen 2.891 N/A HIS 421.A N TYR 417.A O no hydrogen 2.896 N/A THR 422.A N LEU 418.A O no hydrogen 2.941 N/A THR 422.A OG1 LEU 418.A O no hydrogen 2.878 N/A TRP 423.A N LEU 419.A O no hydrogen 2.897 N/A LYS 424.A N GLU 420.A O no hydrogen 2.864 N/A LYS 424.A NZ GLU 420.A OE2 no hydrogen 2.462 N/A ASP 425.A N HIS 421.A O no hydrogen 2.899 N/A ALA 426.A N THR 422.A O no hydrogen 2.954 N/A LYS 427.A N TRP 423.A O no hydrogen 2.904 N/A PHE 428.A N LYS 424.A O no hydrogen 2.859 N/A ILE 429.A N ASP 425.A O no hydrogen 2.947 N/A LEU 430.A N ALA 426.A O no hydrogen 2.924 N/A GLN 431.A N LYS 427.A O no hydrogen 2.893 N/A ILE 432.A N PHE 428.A O no hydrogen 2.885 N/A MET 433.A N ILE 429.A O no hydrogen 2.944 N/A CYS 434.A N LEU 430.A O no hydrogen 2.902 N/A CYS 434.A SG GLN 431.A O no hydrogen 3.120 N/A CYS 434.A SG GLN 431.A OE1 no hydrogen 3.282 N/A GLU 435.A N GLN 431.A O no hydrogen 2.932 N/A LEU 436.A N ILE 432.A O no hydrogen 3.275 N/A ASN 437.A N MET 433.A O no hydrogen 3.051 N/A ASN 437.A N CYS 434.A O no hydrogen 3.237 N/A LEU 441.A N ASN 437.A O no hydrogen 3.496 N/A ALA 442.A N VAL 438.A O no hydrogen 2.880 N/A LEU 443.A N LEU 439.A O no hydrogen 2.908 N/A GLN 444.A N PRO 440.A O no hydrogen 2.913 N/A ILE 445.A N LEU 441.A O no hydrogen 2.897 N/A THR 446.A N ALA 442.A O no hydrogen 2.887 N/A THR 446.A OG1 ALA 442.A O no hydrogen 2.861 N/A ASN 447.A N LEU 443.A O no hydrogen 2.909 N/A ILE 448.A N GLN 444.A O no hydrogen 2.909 N/A ALA 449.A N ILE 445.A O no hydrogen 2.886 N/A GLY 450.A N THR 446.A O no hydrogen 2.509 N/A THR 456.A N MET 453.A O no hydrogen 3.286 N/A THR 456.A OG1 ILE 452.A O no hydrogen 3.412 N/A LEU 457.A N SER 454.A O no hydrogen 2.917 N/A GLY 459.A N THR 456.A O no hydrogen 3.008 N/A ARG 461.A N GLY 459.A O no hydrogen 2.906 N/A ARG 464.A N GLY 460.A O no hydrogen 3.155 N/A ARG 464.A NE GLY 460.A O no hydrogen 3.411 N/A ASN 465.A N ARG 461.A O no hydrogen 2.921 N/A ASN 465.A ND2 SER 598.A OG no hydrogen 3.052 N/A GLU 466.A N SER 462.A O no hydrogen 2.880 N/A PHE 467.A N GLU 463.A O no hydrogen 2.903 N/A LEU 468.A N ARG 464.A O no hydrogen 2.917 N/A LEU 469.A N ASN 465.A O no hydrogen 2.917 N/A LEU 470.A N GLU 466.A O no hydrogen 2.864 N/A HIS 471.A N PHE 467.A O no hydrogen 2.909 N/A ALA 472.A N LEU 468.A O no hydrogen 2.931 N/A PHE 473.A N LEU 469.A O no hydrogen 2.893 N/A TYR 474.A N LEU 470.A O no hydrogen 2.893 N/A GLU 475.A N HIS 471.A O no hydrogen 2.935 N/A ASN 476.A N PHE 473.A O no hydrogen 3.107 N/A ASN 477.A N TYR 474.A O no hydrogen 3.148 N/A ASN 477.A ND2 GLU 113.A O no hydrogen 2.998 N/A TYR 478.A N PHE 473.A O no hydrogen 2.909 N/A ILE 479.A N ASN 115.A O no hydrogen 3.212 N/A TYR 495.A OH GLU 640.A OE2 no hydrogen 3.033 N/A PHE 498.A N SER 655.A O no hydrogen 3.167 N/A ILE 499.A N PHE 687.A O no hydrogen 2.665 N/A LEU 501.A N GLY 685.A O no hydrogen 2.802 N/A LEU 502.A N ILE 649.A O no hydrogen 3.025 N/A ASP 503.A N ASP 682.A O no hydrogen 3.250 N/A PHE 504.A N ASP 647.A O no hydrogen 2.853 N/A ASN 505.A N GLU 680.A O no hydrogen 3.142 N/A SER 510.A N SER 506.A O no hydrogen 2.892 N/A SER 510.A OG SER 506.A O no hydrogen 2.520 N/A ILE 511.A N LEU 507.A O no hydrogen 2.890 N/A ILE 512.A N TYR 508.A O no hydrogen 2.926 N/A GLN 513.A N PRO 509.A O no hydrogen 2.882 N/A GLN 513.A NE2 PRO 509.A O no hydrogen 2.827 N/A GLU 514.A N SER 510.A O no hydrogen 2.903 N/A PHE 515.A N ILE 511.A O no hydrogen 3.130 N/A ASN 516.A ND2 GLU 550.A O no hydrogen 3.175 N/A ILE 517.A N ILE 512.A O no hydrogen 3.087 N/A CYS 518.A SG THR 520.A OG1 no hydrogen 3.596 N/A THR 521.A N CYS 518.A O no hydrogen 3.252 N/A THR 521.A OG1 ASN 516.A O no hydrogen 3.092 N/A THR 521.A OG1 CYS 518.A O no hydrogen 3.342 N/A SER 527.A OG ALA 526.A O no hydrogen 3.020 N/A LYS 531.A N GLN 540.A O no hydrogen 2.330 N/A LYS 531.A NZ GLU 119.A OE1 no hydrogen 3.011 N/A THR 533.A OG1 ASP 535.A OD2 no hydrogen 3.498 N/A GLU 534.A N GLU 534.A OE1 no hydrogen 2.859 N/A SER 548.A N ASP 546.A OD1 no hydrogen 3.459 N/A SER 548.A OG ASP 546.A OD2 no hydrogen 2.718 N/A LEU 549.A N ASP 546.A O no hydrogen 3.029 N/A GLY 552.A N ASN 516.A OD1 no hydrogen 2.808 N/A ARG 556.A NH2 ASN 476.A OD1 no hydrogen 2.949 N/A GLU 557.A N ILE 553.A O no hydrogen 3.380 N/A ILE 558.A N LEU 554.A O no hydrogen 2.978 N/A ARG 559.A N PRO 555.A O no hydrogen 2.855 N/A ARG 559.A NH1 GLU 563.A OE1 no hydrogen 2.788 N/A ARG 559.A NH1 GLU 563.A OE2 no hydrogen 2.949 N/A LYS 560.A N ARG 556.A O no hydrogen 2.893 N/A LEU 561.A N GLU 557.A O no hydrogen 2.919 N/A VAL 562.A N ILE 558.A O no hydrogen 2.905 N/A GLU 563.A N ARG 559.A O no hydrogen 2.871 N/A ARG 564.A N LYS 560.A O no hydrogen 2.913 N/A ARG 565.A N LEU 561.A O no hydrogen 2.897 N/A ARG 565.A NH1 GLN 589.A O no hydrogen 2.550 N/A LYS 566.A N VAL 562.A O no hydrogen 2.891 N/A GLN 567.A N GLU 563.A O no hydrogen 2.892 N/A VAL 568.A N ARG 564.A O no hydrogen 2.897 N/A LYS 569.A N ARG 565.A O no hydrogen 2.904 N/A GLN 570.A N LYS 566.A O no hydrogen 2.897 N/A LEU 571.A N GLN 567.A O no hydrogen 2.883 N/A MET 572.A N VAL 568.A O no hydrogen 2.938 N/A LYS 573.A NZ GLN 570.A O no hydrogen 2.357 N/A GLN 574.A N LEU 571.A O no hydrogen 3.253 N/A ASP 580.A N ASN 578.A OD1 no hydrogen 2.788 N/A ILE 582.A N ASN 578.A O no hydrogen 3.247 N/A LEU 583.A N PRO 579.A O no hydrogen 2.917 N/A GLN 584.A N ASP 580.A O no hydrogen 2.879 N/A GLN 584.A NE2 ASP 248.A O no hydrogen 2.323 N/A TYR 585.A N LEU 581.A O no hydrogen 2.910 N/A ASP 586.A N ILE 582.A O no hydrogen 2.914 N/A ILE 587.A N LEU 583.A O no hydrogen 2.911 N/A ARG 588.A N GLN 584.A O no hydrogen 2.875 N/A GLN 589.A N TYR 585.A O no hydrogen 2.914 N/A LYS 590.A N ASP 586.A O no hydrogen 2.940 N/A ALA 591.A N ILE 587.A O no hydrogen 2.866 N/A LEU 592.A N ARG 588.A O no hydrogen 2.911 N/A LYS 593.A N GLN 589.A O no hydrogen 2.801 N/A LEU 594.A N LYS 590.A O no hydrogen 2.921 N/A THR 595.A N ALA 591.A O no hydrogen 2.886 N/A THR 595.A OG1 ALA 591.A O no hydrogen 2.689 N/A ALA 596.A N LEU 592.A O no hydrogen 2.895 N/A ASN 597.A N LYS 593.A O no hydrogen 2.913 N/A SER 598.A N LEU 594.A O no hydrogen 2.886 N/A SER 598.A OG LEU 594.A O no hydrogen 3.221 N/A SER 598.A OG THR 595.A O no hydrogen 2.706 N/A MET 599.A N THR 595.A O no hydrogen 2.935 N/A MET 599.A N ALA 596.A O no hydrogen 3.267 N/A CYS 602.A N SER 598.A O no hydrogen 2.906 N/A CYS 602.A N MET 599.A O no hydrogen 3.363 N/A LEU 603.A N TYR 600.A O no hydrogen 3.149 N/A GLY 604.A N TYR 600.A O no hydrogen 2.905 N/A PHE 605.A N GLY 601.A O no hydrogen 3.302 N/A SER 608.A N PHE 605.A O no hydrogen 3.427 N/A SER 608.A OG CYS 602.A O no hydrogen 2.964 N/A ARG 609.A NH1 GLU 466.A OE2 no hydrogen 3.333 N/A TYR 611.A N SER 608.A O no hydrogen 3.335 N/A ALA 616.A N ALA 612.A O no hydrogen 3.354 N/A ALA 617.A N LYS 613.A O no hydrogen 2.899 N/A LEU 618.A N PRO 614.A O no hydrogen 2.908 N/A VAL 619.A N LEU 615.A O no hydrogen 2.894 N/A THR 620.A N ALA 616.A O no hydrogen 2.908 N/A THR 620.A OG1 ALA 616.A O no hydrogen 3.109 N/A THR 620.A OG1 ALA 617.A O no hydrogen 2.547 N/A TYR 621.A N ALA 617.A O no hydrogen 2.925 N/A LYS 622.A N LEU 618.A O no hydrogen 2.903 N/A LYS 622.A NZ GLU 625.A OE1 no hydrogen 3.181 N/A GLY 623.A N VAL 619.A O no hydrogen 2.889 N/A ARG 624.A N THR 620.A O no hydrogen 2.929 N/A GLU 625.A N TYR 621.A O no hydrogen 2.920 N/A ILE 626.A N LYS 622.A O no hydrogen 2.890 N/A LEU 627.A N GLY 623.A O no hydrogen 2.889 N/A MET 628.A N ARG 624.A O no hydrogen 2.933 N/A HIS 629.A N GLU 625.A O no hydrogen 2.929 N/A HIS 629.A ND1 GLU 625.A O no hydrogen 2.958 N/A THR 630.A N ILE 626.A O no hydrogen 2.882 N/A THR 630.A OG1 ILE 626.A O no hydrogen 2.537 N/A LYS 631.A N LEU 627.A O no hydrogen 2.926 N/A GLU 632.A N MET 628.A O no hydrogen 2.932 N/A MET 633.A N HIS 629.A O no hydrogen 2.929 N/A VAL 634.A N THR 630.A O no hydrogen 2.895 N/A GLN 635.A N LYS 631.A O no hydrogen 2.915 N/A LYS 636.A N GLU 632.A O no hydrogen 2.920 N/A MET 637.A N VAL 634.A O no hydrogen 3.186 N/A ASN 638.A N GLN 635.A O no hydrogen 3.306 N/A VAL 641.A N GLN 635.A OE1 no hydrogen 3.383 N/A ASP 645.A N SER 648.A O no hydrogen 2.929 N/A ASP 647.A N ASP 645.A O no hydrogen 2.488 N/A SER 648.A N ASP 645.A O no hydrogen 2.907 N/A SER 648.A OG ASP 645.A O no hydrogen 3.333 N/A ILE 649.A N LEU 502.A O no hydrogen 2.815 N/A ILE 651.A N LEU 500.A O no hydrogen 2.980 N/A ASN 652.A N GLU 640.A O no hydrogen 2.942 N/A ASN 652.A ND2 ASN 654.A OD1 no hydrogen 2.737 N/A THR 653.A OG1 PHE 498.A O no hydrogen 2.238 N/A SER 655.A OG GLU 660.A OE1 no hydrogen 3.229 N/A GLU 659.A N ASN 657.A OD1 no hydrogen 3.496 N/A PHE 662.A N LEU 658.A O no hydrogen 2.914 N/A LYS 663.A N GLU 659.A O no hydrogen 2.919 N/A LEU 664.A N GLU 660.A O no hydrogen 2.866 N/A GLY 665.A N VAL 661.A O no hydrogen 2.901 N/A ASN 666.A N PHE 662.A O no hydrogen 2.937 N/A ASN 666.A ND2 PHE 662.A O no hydrogen 3.087 N/A LYS 667.A N LYS 663.A O no hydrogen 2.894 N/A LYS 667.A NZ GLU 671.A OE2 no hydrogen 2.430 N/A VAL 668.A N LEU 664.A O no hydrogen 2.889 N/A LYS 669.A N GLY 665.A O no hydrogen 2.911 N/A LYS 669.A NZ ILE 681.A O no hydrogen 3.321 N/A SER 670.A N ASN 666.A O no hydrogen 2.918 N/A SER 670.A OG ASN 666.A O no hydrogen 3.535 N/A SER 670.A OG LYS 667.A O no hydrogen 2.535 N/A GLU 671.A N LYS 667.A O no hydrogen 2.902 N/A VAL 672.A N VAL 668.A O no hydrogen 2.905 N/A ASN 673.A N LYS 669.A O no hydrogen 3.304 N/A LYS 674.A N GLU 671.A O no hydrogen 3.357 N/A LYS 674.A NZ SER 670.A O no hydrogen 2.645 N/A ASP 682.A N ASP 503.A O no hydrogen 3.169 N/A ILE 683.A N ASP 682.A OD1 no hydrogen 2.533 N/A ASP 684.A N LEU 501.A O no hydrogen 3.188 N/A GLY 685.A N LEU 501.A O no hydrogen 3.157 N/A PHE 687.A N ILE 499.A O no hydrogen 2.524 N/A LYS 688.A N LEU 701.A O no hydrogen 2.562 N/A LEU 691.A N ALA 699.A O no hydrogen 2.367 N/A LYS 697.A N LYS 694.A O no hydrogen 3.314 N/A ALA 699.A N LEU 691.A O no hydrogen 2.697 N/A VAL 702.A N LYS 714.A O no hydrogen 2.491 N/A VAL 703.A N VAL 686.A O no hydrogen 2.565 N/A GLU 704.A N VAL 712.A O no hydrogen 3.317 N/A THR 706.A N ASN 710.A O no hydrogen 2.844 N/A THR 706.A OG1 ASN 710.A O no hydrogen 3.275 N/A VAL 712.A N GLU 704.A O no hydrogen 3.488 N/A LYS 714.A N VAL 702.A O no hydrogen 3.015 N/A LYS 714.A NZ GLN 715.A O no hydrogen 3.355 N/A GLU 716.A N ALA 700.A O no hydrogen 3.147 N/A LYS 718.A NZ LYS 696.A O no hydrogen 2.879 N/A THR 721.A OG1 GLU 724.A OE1 no hydrogen 2.313 N/A GLU 724.A N GLU 724.A OE1 no hydrogen 2.702 N/A LYS 725.A N THR 721.A O no hydrogen 2.973 N/A LYS 725.A NZ TYR 726.A OH no hydrogen 2.694 N/A TYR 726.A N ASP 722.A O no hydrogen 3.020 N/A GLU 730.A N GLN 844.A OE1 no hydrogen 3.124 N/A CYS 734.A N ASN 743.A O no hydrogen 3.082 N/A CYS 734.A SG PRO 735.A O no hydrogen 3.609 N/A CYS 736.A N THR 741.A O no hydrogen 2.773 N/A CYS 739.A SG THR 741.A OG1 no hydrogen 3.357 N/A CYS 739.A SG ASN 765.A OD1 no hydrogen 3.190 N/A GLY 740.A N CYS 736.A O no hydrogen 3.042 N/A THR 741.A OG1 ASN 765.A OD1 no hydrogen 2.468 N/A ASN 743.A N CYS 734.A O no hydrogen 2.538 N/A TYR 745.A N PHE 732.A O no hydrogen 3.349 N/A VAL 748.A N ASN 747.A OD1 no hydrogen 2.646 N/A ASP 750.A N GLU 757.A O no hydrogen 2.461 N/A SER 752.A OG GLY 751.A O no hydrogen 2.698 N/A ASP 755.A N SER 752.A O no hydrogen 3.247 N/A GLU 757.A N ASP 750.A O no hydrogen 3.382 N/A SER 759.A OG ASN 747.A O no hydrogen 3.357 N/A SER 759.A OG VAL 748.A O no hydrogen 3.532 N/A ARG 762.A NE GLU 757.A OE1 no hydrogen 3.465 N/A CYS 763.A SG SER 764.A OG no hydrogen 3.610 N/A CYS 768.A N ASN 765.A O no hydrogen 3.313 N/A LEU 773.A N SER 771.A OG no hydrogen 3.272 N/A THR 774.A N SER 771.A O no hydrogen 3.042 N/A THR 774.A OG1 SER 771.A O no hydrogen 3.038 N/A PHE 775.A N PRO 772.A O no hydrogen 3.083 N/A THR 776.A OG1 LEU 773.A O no hydrogen 3.195 N/A GLN 778.A N GLN 778.A OE1 no hydrogen 2.688 N/A LEU 779.A N PHE 775.A O no hydrogen 2.903 N/A SER 780.A N THR 776.A O no hydrogen 2.939 N/A ASN 781.A N VAL 777.A O no hydrogen 2.896 N/A LYS 782.A N GLN 778.A O no hydrogen 2.911 N/A LEU 783.A N LEU 779.A O no hydrogen 2.904 N/A ILE 784.A N SER 780.A O no hydrogen 2.968 N/A ASP 786.A N LYS 782.A O no hydrogen 2.929 N/A ILE 787.A N LEU 783.A O no hydrogen 2.914 N/A ARG 788.A N ILE 784.A O no hydrogen 2.939 N/A ARG 789.A N MET 785.A O no hydrogen 2.908 N/A ARG 789.A NE ASP 786.A OD1 no hydrogen 3.322 N/A ARG 789.A NH2 GLU 730.A OE1 no hydrogen 2.762 N/A ARG 789.A NH2 ASP 786.A OD1 no hydrogen 2.948 N/A PHE 790.A N ASP 786.A O no hydrogen 2.918 N/A ILE 791.A N ILE 787.A O no hydrogen 2.968 N/A LYS 792.A N ARG 788.A O no hydrogen 2.923 N/A LYS 793.A N ARG 789.A O no hydrogen 2.915 N/A TYR 794.A N PHE 790.A O no hydrogen 2.895 N/A TYR 795.A N ILE 791.A O no hydrogen 2.973 N/A ASP 796.A N LYS 793.A O no hydrogen 3.168 N/A LEU 799.A N THR 810.A O no hydrogen 3.065 N/A ILE 800.A N GLN 833.A O no hydrogen 3.263 N/A CYS 801.A N ASN 808.A O no hydrogen 2.896 N/A GLU 802.A N THR 831.A O no hydrogen 3.320 N/A THR 805.A N GLU 803.A OE2 no hydrogen 3.089 N/A THR 805.A OG1 GLU 803.A OE2 no hydrogen 2.764 N/A CYS 806.A N GLU 803.A O no hydrogen 3.043 N/A ARG 807.A N GLU 803.A O no hydrogen 3.162 N/A ARG 809.A NE GLU 835.A OE2 no hydrogen 2.383 N/A ARG 809.A NH2 GLU 835.A OE1 no hydrogen 2.776 N/A THR 810.A N LEU 799.A O no hydrogen 3.227 N/A HIS 812.A N THR 810.A OG1 no hydrogen 3.262 N/A GLN 816.A NE2 PHE 817.A O no hydrogen 3.010 N/A SER 818.A N GLY 821.A O no hydrogen 2.851 N/A ARG 819.A N SER 818.A OG no hydrogen 2.619 N/A CYS 824.A N ALA 830.A O no hydrogen 3.202 N/A MET 828.A N CYS 824.A O no hydrogen 3.272 N/A THR 831.A OG1 GLU 802.A OE1 no hydrogen 3.332 N/A THR 831.A OG1 GLN 833.A OE1 no hydrogen 2.634 N/A LEU 832.A N PRO 822.A O no hydrogen 3.314 N/A GLN 833.A N ILE 800.A O no hydrogen 3.394 N/A GLU 835.A N TRP 798.A O no hydrogen 2.853 N/A TYR 842.A N ASP 838.A O no hydrogen 2.924 N/A THR 843.A N LYS 839.A O no hydrogen 2.902 N/A THR 843.A OG1 LYS 839.A O no hydrogen 2.662 N/A GLN 844.A N SER 840.A O no hydrogen 2.880 N/A GLN 844.A NE2 GLU 730.A O no hydrogen 2.749 N/A LEU 845.A N LEU 841.A O no hydrogen 2.954 N/A CYS 846.A N TYR 842.A O no hydrogen 2.906 N/A PHE 847.A N THR 843.A O no hydrogen 2.871 N/A TYR 848.A N GLN 844.A O no hydrogen 2.919 N/A TYR 848.A OH ASP 786.A OD2 no hydrogen 2.224 N/A ARG 849.A N LEU 845.A O no hydrogen 2.932 N/A TYR 850.A N PHE 847.A O no hydrogen 3.014 N/A TYR 850.A OH ASP 722.A OD2 no hydrogen 3.340 N/A GLU 855.A N GLU 855.A OE1 no hydrogen 2.741 N/A CYS 856.A N ASP 853.A OD1 no hydrogen 2.746 N/A ALA 857.A N ASP 853.A O no hydrogen 3.440 N/A LEU 858.A N ALA 854.A O no hydrogen 2.891 N/A GLU 859.A N GLU 855.A O no hydrogen 2.904 N/A LYS 860.A N CYS 856.A O no hydrogen 2.898 N/A LEU 861.A N LEU 858.A O no hydrogen 3.163 N/A THR 862.A OG1 LYS 860.A O no hydrogen 3.552 N/A THR 863.A OG1 GLU 866.A OE1 no hydrogen 3.459 N/A LYS 867.A N THR 863.A O no hydrogen 3.068 N/A LYS 867.A NZ LEU 858.A O no hydrogen 2.816 N/A ASP 868.A N ASP 864.A O no hydrogen 2.907 N/A LYS 869.A N HIS 865.A O no hydrogen 2.907 N/A LEU 870.A N GLU 866.A O no hydrogen 2.899 N/A LYS 871.A N LYS 867.A O no hydrogen 2.927 N/A LYS 871.A NZ PHE 875.A O no hydrogen 2.379 N/A LYS 872.A N ASP 868.A O no hydrogen 2.907 N/A GLN 873.A N LYS 869.A O no hydrogen 2.894 N/A PHE 874.A N LEU 870.A O no hydrogen 3.452 N/A PHE 875.A N LYS 871.A O no hydrogen 3.114 N/A VAL 879.A N THR 876.A O no hydrogen 3.040 N/A LEU 880.A N THR 876.A O no hydrogen 3.426 N/A GLN 881.A N PRO 877.A O no hydrogen 2.903 N/A ASP 882.A N LYS 878.A O no hydrogen 2.897 N/A TYR 883.A N VAL 879.A O no hydrogen 2.912 N/A ARG 884.A N LEU 880.A O no hydrogen 2.888 N/A LYS 885.A N GLN 881.A O no hydrogen 2.880 N/A LEU 886.A N ASP 882.A O no hydrogen 2.932 N/A LYS 887.A N TYR 883.A O no hydrogen 2.893 N/A LYS 887.A NZ ARG 849.A O no hydrogen 3.271 N/A LYS 887.A NZ ASP 853.A OD2 no hydrogen 3.100 N/A ASN 888.A N ARG 884.A O no hydrogen 2.894 N/A ASN 888.A N LYS 885.A O no hydrogen 3.282 N/A GLU 891.A N LYS 887.A O no hydrogen 2.911 N/A GLN 892.A N ASN 888.A O no hydrogen 2.893 N/A GLN 892.A N THR 889.A O no hydrogen 3.205 N/A LEU 894.A N GLU 891.A O no hydrogen 3.018 N/A SER 895.A N GLU 891.A O no hydrogen 3.247 N/A SER 895.A OG GLN 892.A O no hydrogen 2.900 N/A ARG 896.A NH1 GLN 892.A OE1 no hydrogen 2.604 N/A SER 897.A N LEU 894.A O no hydrogen 3.300 N/A SER 897.A OG PHE 893.A O no hydrogen 2.769 N/A SER 897.A OG LEU 894.A O no hydrogen 3.365 N/A GLU 901.A N GLY 898.A O no hydrogen 3.234 N/A SER 905.A N ASN 903.A OD1 no hydrogen 3.039 N/A LEU 907.A N LEU 904.A O no hydrogen 3.268 N/A SER 915.A OG LYS 914.A O no hydrogen 2.606 N/A