Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8h6k_4G.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N LYS 1.A O no hydrogen 3.433 N/A TYR 12.A N PRO 9.A O no hydrogen 3.284 N/A GLY 17.A N VAL 13.A O no hydrogen 3.050 N/A ARG 26.A NH1 ASP 28.A OD2 no hydrogen 2.843 N/A ASP 37.A N ASP 37.A OD1 no hydrogen 2.411 N/A GLU 39.A N GLU 35.A O no hydrogen 3.184 N/A GLU 40.A N LYS 36.A O no hydrogen 2.911 N/A ALA 41.A N ASP 37.A O no hydrogen 2.875 N/A ASP 42.A N ASP 38.A O no hydrogen 2.969 N/A ALA 43.A N GLU 39.A O no hydrogen 2.900 N/A ILE 44.A N GLU 40.A O no hydrogen 2.892 N/A TYR 45.A N ALA 41.A O no hydrogen 2.928 N/A ALA 46.A N ASP 42.A O no hydrogen 2.957 N/A ALA 47.A N ALA 43.A O no hydrogen 2.876 N/A LEU 48.A N ILE 44.A O no hydrogen 2.901 N/A ASP 49.A N TYR 45.A O no hydrogen 2.939 N/A LYS 50.A N ALA 46.A O no hydrogen 2.960 N/A ARG 51.A N ALA 47.A O no hydrogen 2.846 N/A MET 52.A N LEU 48.A O no hydrogen 2.938 N/A ASP 53.A N ASP 49.A O no hydrogen 2.914 N/A GLU 54.A N LYS 50.A O no hydrogen 2.946 N/A GLU 54.A N ARG 51.A O no hydrogen 3.278 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.711 N/A ARG 59.A NH1 GLU 58.A OE2 no hydrogen 2.352 N/A ARG 60.A N ARG 56.A O no hydrogen 2.941 N/A ARG 60.A NH1 ASP 53.A OD1 no hydrogen 3.566 N/A ARG 60.A NH2 ASP 53.A OD1 no hydrogen 2.777 N/A GLU 61.A N LYS 57.A O no hydrogen 2.890 N/A GLN 62.A N GLU 58.A O no hydrogen 2.938 N/A ARG 63.A N ARG 59.A O no hydrogen 2.916 N/A GLU 64.A N ARG 60.A O no hydrogen 2.931 N/A LYS 65.A N GLU 61.A O no hydrogen 2.914 N/A GLU 66.A N GLN 62.A O no hydrogen 2.950 N/A GLU 67.A N ARG 63.A O no hydrogen 2.908 N/A ILE 68.A N GLU 64.A O no hydrogen 2.928 N/A GLU 69.A N LYS 65.A O no hydrogen 2.927 N/A LYS 70.A N GLU 66.A O no hydrogen 2.920 N/A TYR 71.A N GLU 67.A O no hydrogen 2.905 N/A ARG 72.A N ILE 68.A O no hydrogen 2.931 N/A ARG 72.A NH1 ARG 75.A O no hydrogen 3.397 N/A MET 73.A N LYS 70.A O no hydrogen 3.344 N/A GLU 74.A N TYR 71.A O no hydrogen 3.381 N/A ARG 75.A NE TYR 71.A OH no hydrogen 3.483 N/A GLN 80.A N LYS 77.A O no hydrogen 3.070 N/A GLN 81.A N ILE 78.A O no hydrogen 3.184 N/A SER 83.A N GLN 80.A O no hydrogen 3.360 N/A SER 83.A OG GLN 80.A O no hydrogen 3.549 N/A LEU 85.A N ASP 84.A OD1 no hydrogen 2.650 N/A LYS 86.A N PHE 82.A O no hydrogen 3.032 N/A ARG 87.A N SER 83.A O no hydrogen 2.925 N/A LYS 88.A N ASP 84.A O no hydrogen 2.904 N/A LEU 89.A N LEU 85.A O no hydrogen 2.848 N/A ALA 90.A N LYS 86.A O no hydrogen 3.026 N/A ALA 90.A N ARG 87.A O no hydrogen 3.150 N/A GLU 91.A N LYS 88.A O no hydrogen 3.043 N/A VAL 92.A N LEU 89.A O no hydrogen 3.082 N/A THR 93.A OG1 GLU 96.A OE2 no hydrogen 3.326 N/A GLU 96.A N THR 93.A OG1 no hydrogen 3.142 N/A TRP 97.A N THR 93.A O no hydrogen 3.228 N/A LEU 98.A N GLU 94.A O no hydrogen 3.233 N/A SER 99.A N GLU 96.A O no hydrogen 3.078 N/A SER 99.A OG GLU 96.A O no hydrogen 3.297 N/A ARG 107.A N ASP 105.A OD1 no hydrogen 3.116 N/A ARG 107.A NE ASP 105.A OD1 no hydrogen 3.530 N/A ARG 107.A NE ASP 105.A OD2 no hydrogen 3.136 N/A ARG 107.A NH2 ASP 105.A OD2 no hydrogen 2.889 N/A GLN 111.A N ASN 108.A O no hydrogen 3.189 N/A GLN 111.A N ASN 108.A OD1 no hydrogen 3.365 N/A GLN 111.A NE2 ASN 108.A OD1 no hydrogen 3.052 N/A ARG 112.A N ASN 108.A O no hydrogen 2.985 N/A ARG 112.A NH1 ARG 107.A O no hydrogen 3.433 N/A ASN 113.A N LYS 109.A O no hydrogen 2.707 N/A PHE 126.A N PRO 123.A O no hydrogen 3.325 N/A ALA 128.A N ASP 124.A O no hydrogen 3.489 N/A LYS 129.A N SER 125.A O no hydrogen 2.890 N/A HIS 130.A N PHE 126.A O no hydrogen 2.931 N/A LEU 131.A N PHE 127.A O no hydrogen 2.917 N/A GLN 132.A N ALA 128.A O no hydrogen 2.895 N/A GLN 132.A NE2 ALA 128.A O no hydrogen 2.732 N/A THR 133.A OG1 LYS 129.A O no hydrogen 3.458 N/A GLY 134.A N LEU 131.A O no hydrogen 3.096 N/A ARG 143.A N ASP 141.A OD1 no hydrogen 2.754 N/A GLN 144.A N ASP 141.A O no hydrogen 3.301 N/A ALA 158.A N ASP 154.A O no hydrogen 3.264 N/A ARG 159.A N ILE 155.A O no hydrogen 2.889 N/A ARG 159.A NE GLU 183.A OE2 no hydrogen 2.688 N/A ARG 159.A NH2 GLU 183.A OE2 no hydrogen 3.093 N/A LEU 160.A N LYS 156.A O no hydrogen 2.976 N/A LEU 161.A N LYS 157.A O no hydrogen 2.914 N/A LEU 162.A N ALA 158.A O no hydrogen 2.889 N/A LYS 163.A N ARG 159.A O no hydrogen 2.943 N/A SER 164.A N LEU 160.A O no hydrogen 2.933 N/A VAL 165.A N LEU 161.A O no hydrogen 2.919 N/A ARG 166.A N LEU 162.A O no hydrogen 2.931 N/A ARG 166.A NH1 SER 179.A OG no hydrogen 3.255 N/A GLU 167.A N LYS 163.A O no hydrogen 2.928 N/A THR 168.A N SER 164.A O no hydrogen 2.924 N/A THR 168.A OG1 SER 164.A O no hydrogen 3.061 N/A ASN 169.A N VAL 165.A O no hydrogen 2.848 N/A ALA 175.A N HIS 172.A O no hydrogen 2.861 N/A TRP 176.A NE1 PRO 170.A O no hydrogen 2.756 N/A ILE 177.A N PRO 173.A O no hydrogen 2.956 N/A ALA 178.A N PRO 174.A O no hydrogen 2.858 N/A SER 179.A N ALA 175.A O no hydrogen 2.915 N/A SER 179.A OG ALA 175.A O no hydrogen 3.024 N/A ALA 180.A N TRP 176.A O no hydrogen 2.938 N/A ARG 181.A N ILE 177.A O no hydrogen 2.910 N/A ARG 181.A NE GLU 212.A OE2 no hydrogen 2.683 N/A ARG 181.A NH2 GLU 212.A OE1 no hydrogen 3.457 N/A LEU 182.A N ALA 178.A O no hydrogen 2.852 N/A GLU 183.A N SER 179.A O no hydrogen 2.973 N/A GLU 184.A N ALA 180.A O no hydrogen 2.880 N/A VAL 185.A N ARG 181.A O no hydrogen 2.905 N/A THR 186.A OG1 GLU 183.A O no hydrogen 3.500 N/A GLN 190.A NE2 GLN 190.A O no hydrogen 3.223 N/A ALA 192.A N LYS 188.A O no hydrogen 3.153 N/A ARG 193.A N LEU 189.A O no hydrogen 2.899 N/A ARG 193.A NE LEU 216.A O no hydrogen 3.166 N/A ARG 193.A NH1 GLN 190.A OE1 no hydrogen 3.418 N/A ASN 194.A N GLN 190.A O no hydrogen 2.944 N/A ASN 194.A ND2 GLN 190.A O no hydrogen 2.288 N/A LEU 195.A N VAL 191.A O no hydrogen 2.914 N/A ILE 196.A N ALA 192.A O no hydrogen 2.898 N/A MET 197.A N ARG 193.A O no hydrogen 2.935 N/A LYS 198.A N ASN 194.A O no hydrogen 2.956 N/A GLY 199.A N LEU 195.A O no hydrogen 2.876 N/A THR 200.A N ILE 196.A O no hydrogen 2.902 N/A THR 200.A OG1 ILE 196.A O no hydrogen 3.420 N/A THR 200.A OG1 MET 197.A O no hydrogen 2.410 N/A GLU 201.A N MET 197.A O no hydrogen 2.931 N/A MET 202.A N LYS 198.A O no hydrogen 2.903 N/A MET 202.A N GLY 199.A O no hydrogen 2.892 N/A CYS 203.A N GLY 199.A O no hydrogen 2.928 N/A CYS 203.A SG GLY 199.A O no hydrogen 3.461 N/A TRP 210.A NE1 PRO 204.A O no hydrogen 2.599 N/A LEU 211.A N GLU 207.A O no hydrogen 2.903 N/A GLU 212.A N ASP 208.A O no hydrogen 2.890 N/A ALA 213.A N VAL 209.A O no hydrogen 2.910 N/A ALA 214.A N TRP 210.A O no hydrogen 2.907 N/A ARG 215.A N LEU 211.A O no hydrogen 2.889 N/A LEU 216.A N GLU 212.A O no hydrogen 2.914 N/A GLN 217.A N ALA 213.A O no hydrogen 2.942 N/A THR 221.A N PRO 218.A O no hydrogen 3.105 N/A THR 221.A OG1 PRO 218.A O no hydrogen 1.934 N/A ALA 222.A N GLY 219.A O no hydrogen 2.658 N/A ALA 224.A N ASP 220.A O no hydrogen 2.936 N/A VAL 225.A N THR 221.A O no hydrogen 2.873 N/A VAL 226.A N ALA 222.A O no hydrogen 2.909 N/A ALA 227.A N LYS 223.A O no hydrogen 2.950 N/A GLN 228.A N ALA 224.A O no hydrogen 3.405 N/A ALA 229.A N VAL 225.A O no hydrogen 2.883 N/A VAL 230.A N VAL 226.A O no hydrogen 2.904 N/A ARG 231.A N ALA 227.A O no hydrogen 2.938 N/A HIS 232.A N GLN 228.A O no hydrogen 2.892 N/A HIS 232.A N ALA 229.A O no hydrogen 3.279 N/A LEU 233.A N ALA 229.A O no hydrogen 2.916 N/A GLN 235.A N LEU 233.A O no hydrogen 2.500 N/A ARG 242.A N ARG 238.A O no hydrogen 3.359 N/A ALA 243.A N ILE 239.A O no hydrogen 2.875 N/A ALA 244.A N TYR 240.A O no hydrogen 2.919 N/A GLU 245.A N ARG 242.A O no hydrogen 3.146 N/A LEU 246.A N ARG 242.A O no hydrogen 3.358 N/A ALA 252.A N ASP 249.A O no hydrogen 2.971 N/A LYS 253.A N ASP 249.A O no hydrogen 3.227 N/A LYS 254.A N ILE 250.A O no hydrogen 2.896 N/A VAL 256.A N ALA 252.A O no hydrogen 2.915 N/A LEU 257.A N LYS 253.A O no hydrogen 2.905 N/A ARG 258.A N LYS 254.A O no hydrogen 2.875 N/A LYS 259.A N ARG 255.A O no hydrogen 2.905 N/A ALA 260.A N VAL 256.A O no hydrogen 2.919 N/A LEU 261.A N LEU 257.A O no hydrogen 2.889 N/A GLU 262.A N ARG 258.A O no hydrogen 3.197 N/A HIS 263.A N ALA 260.A O no hydrogen 3.091 N/A TRP 271.A N SER 267.A O no hydrogen 3.491 N/A LYS 272.A N VAL 268.A O no hydrogen 2.803 N/A ALA 273.A N ARG 269.A O no hydrogen 2.903 N/A ALA 274.A N LEU 270.A O no hydrogen 2.894 N/A VAL 275.A N TRP 271.A O no hydrogen 2.919 N/A GLU 276.A N ALA 273.A O no hydrogen 3.437 N/A LEU 277.A N VAL 275.A O no hydrogen 3.133 N/A ALA 283.A N GLU 279.A O no hydrogen 2.575 N/A ARG 284.A N PRO 280.A O no hydrogen 2.880 N/A ILE 285.A N GLU 281.A O no hydrogen 2.949 N/A MET 286.A N ASP 282.A O no hydrogen 2.875 N/A LEU 287.A N ALA 283.A O no hydrogen 2.860 N/A SER 288.A N ARG 284.A O no hydrogen 2.919 N/A ARG 289.A N ILE 285.A O no hydrogen 2.928 N/A ALA 290.A N MET 286.A O no hydrogen 2.857 N/A VAL 291.A N LEU 287.A O no hydrogen 2.883 N/A GLU 292.A N SER 288.A O no hydrogen 2.932 N/A CYS 293.A N ARG 289.A O no hydrogen 2.889 N/A CYS 294.A N ALA 290.A O no hydrogen 2.298 N/A TRP 301.A N SER 297.A O no hydrogen 3.123 N/A LEU 302.A N VAL 298.A O no hydrogen 2.909 N/A ALA 303.A N GLU 299.A O no hydrogen 2.879 N/A LEU 304.A N LEU 300.A O no hydrogen 2.911 N/A ALA 305.A N TRP 301.A O no hydrogen 2.912 N/A ARG 306.A N ALA 303.A O no hydrogen 3.210 N/A ALA 313.A N THR 309.A O no hydrogen 2.486 N/A ARG 314.A N TYR 310.A O no hydrogen 2.904 N/A LYS 315.A N GLU 311.A O no hydrogen 2.923 N/A VAL 316.A N ASN 312.A O no hydrogen 2.902 N/A LEU 317.A N ALA 313.A O no hydrogen 2.877 N/A ASN 318.A N ARG 314.A O no hydrogen 2.898 N/A LYS 319.A N LYS 315.A O no hydrogen 2.930 N/A ALA 320.A N VAL 316.A O no hydrogen 2.887 N/A ARG 321.A N LEU 317.A O no hydrogen 2.894 N/A GLU 322.A N ASN 318.A O no hydrogen 3.410 N/A ASN 323.A N ALA 320.A O no hydrogen 2.759 N/A THR 333.A N HIS 329.A O no hydrogen 2.922 N/A ALA 334.A N ILE 330.A O no hydrogen 2.881 N/A ALA 335.A N TRP 331.A O no hydrogen 2.888 N/A LYS 336.A N ILE 332.A O no hydrogen 2.895 N/A LEU 337.A N THR 333.A O no hydrogen 2.907 N/A GLU 338.A N ALA 334.A O no hydrogen 2.890 N/A GLU 339.A N ALA 335.A O no hydrogen 2.892 N/A ALA 340.A N LYS 336.A O no hydrogen 2.905 N/A ASN 341.A N LEU 337.A O no hydrogen 2.947 N/A VAL 347.A N ASN 343.A O no hydrogen 3.111 N/A GLU 348.A N THR 344.A O no hydrogen 3.115 N/A LYS 349.A N GLN 345.A O no hydrogen 2.897 N/A ILE 350.A N MET 346.A O no hydrogen 2.889 N/A ILE 351.A N VAL 347.A O no hydrogen 2.921 N/A ASP 352.A N GLU 348.A O no hydrogen 2.876 N/A ARG 353.A N LYS 349.A O no hydrogen 2.887 N/A ALA 354.A N ILE 350.A O no hydrogen 2.916 N/A ILE 355.A N ILE 351.A O no hydrogen 2.899 N/A THR 356.A N ASP 352.A O no hydrogen 2.877 N/A SER 357.A N ARG 353.A O no hydrogen 2.908 N/A LEU 358.A N ALA 354.A O no hydrogen 2.889 N/A ARG 359.A N ILE 355.A O no hydrogen 2.890 N/A ALA 360.A N THR 356.A O no hydrogen 2.910 N/A ASN 361.A N SER 357.A O no hydrogen 2.311 N/A GLY 362.A N SER 357.A O no hydrogen 3.207 N/A ILE 371.A N ARG 367.A O no hydrogen 2.879 N/A GLN 372.A N GLU 368.A O no hydrogen 2.927 N/A ASP 373.A N GLN 369.A O no hydrogen 2.877 N/A ALA 374.A N TRP 370.A O no hydrogen 2.883 N/A GLU 375.A N ILE 371.A O no hydrogen 2.914 N/A GLU 376.A N GLN 372.A O no hydrogen 2.912 N/A CYS 377.A N ASP 373.A O no hydrogen 2.866 N/A ASP 378.A N ALA 374.A O no hydrogen 2.899 N/A ARG 379.A N GLU 375.A O no hydrogen 2.916 N/A ALA 380.A N GLU 376.A O no hydrogen 2.902 N/A CYS 386.A N SER 382.A O no hydrogen 3.274 N/A GLN 387.A N VAL 383.A O no hydrogen 2.895 N/A ALA 388.A N ALA 384.A O no hydrogen 2.900 N/A VAL 389.A N THR 385.A O no hydrogen 2.894 N/A MET 390.A N CYS 386.A O no hydrogen 2.878 N/A ARG 391.A N GLN 387.A O no hydrogen 2.899 N/A ALA 392.A N ALA 388.A O no hydrogen 2.907 N/A VAL 393.A N VAL 389.A O no hydrogen 2.889 N/A ILE 394.A N MET 390.A O no hydrogen 2.889 N/A GLY 395.A N ARG 391.A O no hydrogen 2.906 N/A ILE 396.A N ALA 392.A O no hydrogen 3.008 N/A MET 408.A N LYS 404.A O no hydrogen 3.252 N/A GLU 409.A N HIS 405.A O no hydrogen 2.883 N/A ASP 410.A N THR 406.A O no hydrogen 2.908 N/A ALA 411.A N TRP 407.A O no hydrogen 2.895 N/A ASP 412.A N MET 408.A O no hydrogen 2.875 N/A SER 413.A N GLU 409.A O no hydrogen 2.899 N/A CYS 414.A N ASP 410.A O no hydrogen 2.927 N/A VAL 415.A N ALA 411.A O no hydrogen 2.869 N/A ALA 416.A N ASP 412.A O no hydrogen 2.890 N/A HIS 417.A N SER 413.A O no hydrogen 3.496 N/A ASN 418.A N VAL 415.A O no hydrogen 2.890 N/A ARG 424.A N LEU 420.A O no hydrogen 2.891 N/A ALA 425.A N GLU 421.A O no hydrogen 2.920 N/A ILE 426.A N CYS 422.A O no hydrogen 2.883 N/A TYR 427.A N ALA 423.A O no hydrogen 2.887 N/A ALA 428.A N ARG 424.A O no hydrogen 2.912 N/A TYR 429.A N ALA 425.A O no hydrogen 2.915 N/A ALA 430.A N ILE 426.A O no hydrogen 2.875 N/A LEU 431.A N TYR 427.A O no hydrogen 2.907 N/A GLN 432.A N ALA 428.A O no hydrogen 2.915 N/A VAL 433.A N TYR 429.A O no hydrogen 2.632 N/A LEU 442.A N LYS 438.A O no hydrogen 3.141 N/A ARG 443.A N SER 439.A O no hydrogen 2.900 N/A ALA 444.A N VAL 440.A O no hydrogen 2.897 N/A ALA 445.A N TRP 441.A O no hydrogen 2.902 N/A TYR 446.A N LEU 442.A O no hydrogen 2.903 N/A PHE 447.A N ARG 443.A O no hydrogen 2.896 N/A GLU 448.A N ALA 444.A O no hydrogen 2.908 N/A LYS 449.A N ALA 445.A O no hydrogen 2.890 N/A ASN 450.A N TYR 446.A O no hydrogen 2.702 N/A HIS 451.A N PHE 447.A O no hydrogen 3.287 N/A GLY 452.A N LYS 449.A O no hydrogen 2.918 N/A LEU 457.A N THR 453.A O no hydrogen 2.853 N/A GLU 458.A N ARG 454.A O no hydrogen 2.894 N/A ALA 459.A N GLU 455.A O no hydrogen 2.919 N/A LEU 460.A N SER 456.A O no hydrogen 2.897 N/A LEU 461.A N LEU 457.A O no hydrogen 2.880 N/A GLN 462.A N GLU 458.A O no hydrogen 2.912 N/A ARG 463.A N ALA 459.A O no hydrogen 2.917 N/A ALA 464.A N LEU 460.A O no hydrogen 2.891 N/A VAL 465.A N LEU 461.A O no hydrogen 2.888 N/A ALA 466.A N GLN 462.A O no hydrogen 2.930 N/A HIS 467.A N ARG 463.A O no hydrogen 2.883 N/A HIS 467.A N ALA 464.A O no hydrogen 3.292 N/A CYS 468.A N ALA 464.A O no hydrogen 3.377 N/A LYS 470.A N CYS 468.A O no hydrogen 2.819 N/A LEU 476.A N GLU 472.A O no hydrogen 2.841 N/A MET 477.A N VAL 473.A O no hydrogen 2.902 N/A GLY 478.A N LEU 474.A O no hydrogen 2.893 N/A ALA 479.A N TRP 475.A O no hydrogen 2.896 N/A LYS 480.A N LEU 476.A O no hydrogen 2.908 N/A SER 481.A N MET 477.A O no hydrogen 2.901 N/A LYS 482.A N GLY 478.A O no hydrogen 2.893 N/A TRP 483.A N ALA 479.A O no hydrogen 2.902 N/A LEU 484.A N LYS 480.A O no hydrogen 2.901 N/A ALA 485.A N LYS 482.A O no hydrogen 3.058 N/A ARG 492.A N VAL 488.A O no hydrogen 2.905 N/A SER 493.A N PRO 489.A O no hydrogen 2.886 N/A ILE 494.A N ALA 490.A O no hydrogen 2.926 N/A LEU 495.A N ALA 491.A O no hydrogen 2.892 N/A ALA 496.A N ARG 492.A O no hydrogen 2.904 N/A LEU 497.A N SER 493.A O no hydrogen 2.901 N/A ALA 498.A N ILE 494.A O no hydrogen 2.907 N/A PHE 499.A N LEU 495.A O no hydrogen 2.895 N/A GLN 500.A N ALA 496.A O no hydrogen 2.905 N/A ALA 501.A N LEU 497.A O no hydrogen 2.910 N/A ASN 502.A N ALA 498.A O no hydrogen 2.398 N/A ILE 508.A N SER 505.A O no hydrogen 3.465 N/A LEU 510.A N GLU 506.A O no hydrogen 3.403 N/A ALA 511.A N GLU 507.A O no hydrogen 2.888 N/A ALA 512.A N ILE 508.A O no hydrogen 2.894 N/A VAL 513.A N TRP 509.A O no hydrogen 2.896 N/A LYS 514.A N LEU 510.A O no hydrogen 2.908 N/A LEU 515.A N ALA 511.A O no hydrogen 2.892 N/A GLU 516.A N ALA 512.A O no hydrogen 2.871 N/A SER 517.A N VAL 513.A O no hydrogen 2.907 N/A GLU 518.A N LYS 514.A O no hydrogen 2.903 N/A ASN 519.A N GLU 516.A O no hydrogen 3.008 N/A ARG 524.A N GLU 521.A O no hydrogen 2.978 N/A ARG 526.A N TYR 522.A O no hydrogen 2.906 N/A ARG 527.A N GLU 523.A O no hydrogen 2.911 N/A LEU 528.A N ARG 524.A O no hydrogen 2.877 N/A LEU 529.A N ALA 525.A O no hydrogen 2.878 N/A ALA 530.A N ARG 526.A O no hydrogen 2.921 N/A LYS 531.A N ARG 527.A O no hydrogen 2.899 N/A ALA 532.A N LEU 528.A O no hydrogen 2.875 N/A ARG 533.A N LEU 529.A O no hydrogen 2.888 N/A SER 534.A N ALA 530.A O no hydrogen 2.922 N/A SER 535.A N LYS 531.A O no hydrogen 2.891 N/A ALA 536.A N ALA 532.A O no hydrogen 2.464 N/A VAL 541.A N THR 538.A O no hydrogen 2.771 N/A MET 543.A N ALA 539.A O no hydrogen 3.117 N/A LYS 544.A N ARG 540.A O no hydrogen 2.901 N/A SER 545.A N VAL 541.A O no hydrogen 2.885 N/A VAL 546.A N PHE 542.A O no hydrogen 2.892 N/A LYS 547.A N MET 543.A O no hydrogen 2.886 N/A LEU 548.A N LYS 544.A O no hydrogen 2.883 N/A GLU 549.A N SER 545.A O no hydrogen 2.916 N/A TRP 550.A N VAL 546.A O no hydrogen 2.879 N/A VAL 551.A N LYS 547.A O no hydrogen 2.905 N/A VAL 551.A N LEU 548.A O no hydrogen 3.239 N/A GLN 559.A N ILE 555.A O no hydrogen 2.886 N/A ASP 560.A N ARG 556.A O no hydrogen 2.898 N/A LEU 561.A N ALA 557.A O no hydrogen 2.930 N/A CYS 562.A N ALA 558.A O no hydrogen 2.898 N/A GLU 563.A N GLN 559.A O no hydrogen 2.872 N/A GLU 564.A N ASP 560.A O no hydrogen 2.916 N/A ALA 565.A N LEU 561.A O no hydrogen 2.931 N/A LEU 566.A N CYS 562.A O no hydrogen 2.866 N/A ARG 567.A N GLU 563.A O no hydrogen 2.899 N/A HIS 568.A N GLU 564.A O no hydrogen 2.917 N/A TYR 569.A N ALA 565.A O no hydrogen 2.625 N/A TRP 576.A NE1 GLU 570.A O no hydrogen 2.544 N/A MET 577.A N PRO 573.A O no hydrogen 2.937 N/A MET 578.A N LYS 574.A O no hydrogen 2.878 N/A LYS 579.A N LEU 575.A O no hydrogen 2.892 N/A GLY 580.A N TRP 576.A O no hydrogen 2.893 N/A GLN 581.A N MET 577.A O no hydrogen 2.921 N/A ILE 582.A N MET 578.A O no hydrogen 2.941 N/A GLU 583.A N LYS 579.A O no hydrogen 2.889 N/A GLU 584.A N GLY 580.A O no hydrogen 2.911 N/A GLN 585.A N GLN 581.A O no hydrogen 2.918 N/A LYS 586.A N ILE 582.A O no hydrogen 2.971 N/A LYS 586.A N GLU 583.A O no hydrogen 3.254 N/A ARG 593.A N MET 589.A O no hydrogen 2.964 N/A GLU 594.A N GLU 590.A O no hydrogen 2.927 N/A ALA 595.A N LYS 591.A O no hydrogen 2.897 N/A TYR 596.A N ALA 592.A O no hydrogen 2.927 N/A TYR 596.A OH GLU 584.A OE2 no hydrogen 2.984 N/A ASN 597.A N ARG 593.A O no hydrogen 2.869 N/A GLN 598.A N GLU 594.A O no hydrogen 2.920 N/A GLY 599.A N ALA 595.A O no hydrogen 2.929 N/A LEU 600.A N TYR 596.A O no hydrogen 2.896 N/A LYS 601.A N ASN 597.A O no hydrogen 2.871 N/A LYS 602.A N GLN 598.A O no hydrogen 2.962 N/A LYS 602.A N GLY 599.A O no hydrogen 3.304 N/A CYS 603.A N GLY 599.A O no hydrogen 2.854 N/A SER 606.A N PRO 604.A O no hydrogen 3.041 N/A LEU 609.A N SER 606.A OG no hydrogen 3.027 N/A TRP 610.A N SER 606.A O no hydrogen 3.180 N/A LEU 611.A N THR 607.A O no hydrogen 2.897 N/A LEU 612.A N PRO 608.A O no hydrogen 2.877 N/A LEU 613.A N LEU 609.A O no hydrogen 2.940 N/A SER 614.A N TRP 610.A O no hydrogen 2.891 N/A SER 614.A OG GLU 646.A OE2 no hydrogen 3.415 N/A ARG 615.A N LEU 611.A O no hydrogen 2.889 N/A LEU 616.A N LEU 612.A O no hydrogen 2.906 N/A GLU 617.A N LEU 613.A O no hydrogen 2.924 N/A GLU 618.A N SER 614.A O no hydrogen 2.903 N/A LYS 619.A N ARG 615.A O no hydrogen 2.901 N/A ILE 620.A N LEU 616.A O no hydrogen 3.164 N/A GLY 621.A N GLU 617.A O no hydrogen 3.183 N/A ARG 625.A N GLN 622.A O no hydrogen 3.017 N/A ALA 626.A N GLN 622.A O no hydrogen 3.428 N/A ARG 627.A N LEU 623.A O no hydrogen 2.911 N/A ARG 627.A NH1 GLU 651.A OE2 no hydrogen 2.625 N/A ALA 628.A N THR 624.A O no hydrogen 2.917 N/A ILE 629.A N ARG 625.A O no hydrogen 2.884 N/A LEU 630.A N ALA 626.A O no hydrogen 2.928 N/A GLU 631.A N ARG 627.A O no hydrogen 2.894 N/A LYS 632.A N ALA 628.A O no hydrogen 2.931 N/A SER 633.A N ILE 629.A O no hydrogen 2.907 N/A SER 633.A OG LEU 630.A O no hydrogen 2.613 N/A ARG 634.A N LEU 630.A O no hydrogen 2.895 N/A ARG 634.A NH1 SER 647.A OG no hydrogen 2.936 N/A LEU 635.A N GLU 631.A O no hydrogen 2.924 N/A LYS 636.A N LYS 632.A O no hydrogen 2.919 N/A ASN 637.A N SER 633.A O no hydrogen 3.378 N/A TRP 644.A N ASN 640.A O no hydrogen 3.527 N/A TRP 644.A NE1 GLU 670.A OE2 no hydrogen 2.599 N/A LEU 645.A N PRO 641.A O no hydrogen 2.900 N/A GLU 646.A N GLY 642.A O no hydrogen 2.911 N/A SER 647.A N LEU 643.A O no hydrogen 2.902 N/A SER 647.A OG LEU 643.A O no hydrogen 2.748 N/A VAL 648.A N TRP 644.A O no hydrogen 2.929 N/A ARG 649.A N LEU 645.A O no hydrogen 2.910 N/A LEU 650.A N GLU 646.A O no hydrogen 2.843 N/A GLU 651.A N SER 647.A O no hydrogen 2.965 N/A TYR 652.A N VAL 648.A O no hydrogen 2.881 N/A ARG 653.A N ARG 649.A O no hydrogen 2.890 N/A ARG 653.A NH1 GLU 618.A OE2 no hydrogen 3.423 N/A ASN 661.A N LYS 657.A O no hydrogen 2.914 N/A THR 662.A N ASN 658.A O no hydrogen 2.905 N/A THR 662.A OG1 ASN 658.A O no hydrogen 2.860 N/A LEU 663.A N ILE 659.A O no hydrogen 2.937 N/A MET 664.A N ALA 660.A O no hydrogen 2.868 N/A ALA 665.A N ASN 661.A O no hydrogen 2.897 N/A LYS 666.A N THR 662.A O no hydrogen 2.988 N/A ALA 667.A N LEU 663.A O no hydrogen 2.887 N/A LEU 668.A N MET 664.A O no hydrogen 2.920 N/A GLN 669.A N ALA 665.A O no hydrogen 2.886 N/A GLU 670.A N LYS 666.A O no hydrogen 3.006 N/A CYS 671.A N ALA 667.A O no hydrogen 2.733 N/A LEU 677.A N SER 674.A OG no hydrogen 3.303 N/A TRP 678.A N SER 674.A O no hydrogen 3.162 N/A TRP 678.A NE1 PRO 672.A O no hydrogen 2.570 N/A SER 679.A N GLY 675.A O no hydrogen 2.897 N/A SER 679.A OG GLY 675.A O no hydrogen 3.459 N/A SER 679.A OG HIS 706.A O no hydrogen 2.861 N/A GLU 680.A N ILE 676.A O no hydrogen 2.944 N/A ALA 681.A N LEU 677.A O no hydrogen 2.898 N/A ILE 682.A N TRP 678.A O no hydrogen 2.905 N/A LEU 684.A N GLU 680.A O no hydrogen 2.950 N/A LEU 684.A N ALA 681.A O no hydrogen 3.120 N/A GLN 689.A N ALA 686.A O no hydrogen 3.107 N/A ARG 690.A NE GLU 685.A O no hydrogen 3.483 N/A SER 694.A N ARG 690.A O no hydrogen 2.894 N/A SER 694.A OG ARG 691.A O no hydrogen 3.003 N/A VAL 695.A N ARG 691.A O no hydrogen 2.921 N/A ASP 696.A N THR 692.A O no hydrogen 2.910 N/A ALA 697.A N LYS 693.A O no hydrogen 2.903 N/A LEU 698.A N SER 694.A O no hydrogen 2.903 N/A LYS 699.A N VAL 695.A O no hydrogen 2.912 N/A LYS 700.A N ASP 696.A O no hydrogen 2.927 N/A CYS 701.A N ALA 697.A O no hydrogen 3.032 N/A CYS 701.A SG ALA 697.A O no hydrogen 3.329 N/A HIS 703.A N GLU 702.A OE2 no hydrogen 2.715 N/A HIS 706.A N ASP 704.A OD1 no hydrogen 2.851 N/A LEU 708.A N ASP 704.A O no hydrogen 3.179 N/A LEU 709.A N PRO 705.A O no hydrogen 2.894 N/A ALA 710.A N HIS 706.A O no hydrogen 2.905 N/A VAL 711.A N VAL 707.A O no hydrogen 2.888 N/A ALA 712.A N LEU 708.A O no hydrogen 2.916 N/A LYS 713.A N LEU 709.A O no hydrogen 2.891 N/A LEU 714.A N ALA 710.A O no hydrogen 2.881 N/A PHE 715.A N VAL 711.A O no hydrogen 2.921 N/A TRP 716.A N ALA 712.A O no hydrogen 2.898 N/A TRP 716.A NE1 GLN 751.A OE1 no hydrogen 2.994 N/A SER 717.A N LYS 713.A O no hydrogen 2.881 N/A GLN 718.A N PHE 715.A O no hydrogen 3.133 N/A ARG 719.A N TRP 716.A O no hydrogen 3.173 N/A LYS 720.A N PHE 715.A O no hydrogen 3.219 N/A ALA 724.A N LYS 720.A O no hydrogen 3.038 N/A ARG 725.A N ILE 721.A O no hydrogen 2.869 N/A ARG 725.A NE GLU 749.A OE2 no hydrogen 2.979 N/A ARG 725.A NH2 HIS 752.A O no hydrogen 3.487 N/A GLU 726.A N THR 722.A O no hydrogen 2.951 N/A TRP 727.A N LYS 723.A O no hydrogen 2.905 N/A PHE 728.A N ALA 724.A O no hydrogen 2.872 N/A HIS 729.A N ARG 725.A O no hydrogen 2.922 N/A ARG 730.A N GLU 726.A O no hydrogen 2.933 N/A THR 731.A N TRP 727.A O no hydrogen 2.858 N/A THR 731.A OG1 TRP 727.A O no hydrogen 3.191 N/A VAL 732.A N PHE 728.A O no hydrogen 2.947 N/A LYS 733.A N HIS 729.A O no hydrogen 2.921 N/A ILE 734.A N ARG 730.A O no hydrogen 2.913 N/A ILE 734.A N THR 731.A O no hydrogen 3.295 N/A ASP 735.A N THR 731.A O no hydrogen 3.171 N/A SER 736.A OG VAL 732.A O no hydrogen 3.317 N/A TRP 742.A NE1 SER 736.A O no hydrogen 3.121 N/A ALA 743.A N GLY 739.A O no hydrogen 3.194 N/A PHE 744.A N ASP 740.A O no hydrogen 2.930 N/A PHE 745.A N ALA 741.A O no hydrogen 2.883 N/A TYR 746.A N TRP 742.A O no hydrogen 2.880 N/A LYS 747.A N ALA 743.A O no hydrogen 2.944 N/A PHE 748.A N PHE 744.A O no hydrogen 2.898 N/A GLU 749.A N PHE 745.A O no hydrogen 2.872 N/A LEU 750.A N TYR 746.A O no hydrogen 2.940 N/A GLN 751.A N LYS 747.A O no hydrogen 2.907 N/A HIS 752.A N PHE 748.A O no hydrogen 2.721 N/A GLN 757.A N THR 754.A O no hydrogen 3.115 N/A GLN 758.A N THR 754.A O no hydrogen 3.456 N/A GLU 759.A N GLU 755.A O no hydrogen 2.959 N/A GLU 760.A N GLU 756.A O no hydrogen 2.856 N/A VAL 761.A N GLN 757.A O no hydrogen 2.928 N/A ARG 762.A N GLN 758.A O no hydrogen 2.896 N/A LYS 763.A N GLU 759.A O no hydrogen 2.901 N/A LYS 763.A NZ GLU 759.A OE1 no hydrogen 3.217 N/A ARG 764.A N GLU 760.A O no hydrogen 2.928 N/A CYS 765.A N VAL 761.A O no hydrogen 2.922 N/A GLU 766.A N ARG 762.A O no hydrogen 2.881 N/A SER 767.A N LYS 763.A O no hydrogen 2.916 N/A SER 767.A OG LYS 763.A O no hydrogen 2.439 N/A ARG 771.A N ASP 737.A O no hydrogen 3.090 N/A CYS 777.A N GLY 773.A O no hydrogen 3.129 N/A CYS 777.A SG GLY 773.A O no hydrogen 2.972 N/A ALA 778.A N LEU 775.A O no hydrogen 3.261 N/A VAL 779.A N TRP 776.A O no hydrogen 3.322 N/A SER 780.A N TRP 776.A O no hydrogen 3.092 N/A SER 780.A OG TRP 776.A O no hydrogen 3.055 N/A ASN 785.A N ASP 782.A O no hydrogen 3.375 N/A ASN 785.A ND2 VAL 779.A O no hydrogen 2.639 N/A LYS 788.A N ASN 785.A O no hydrogen 3.075 N/A LYS 789.A NZ ASP 792.A OD1 no hydrogen 2.765 N/A ILE 793.A N LYS 789.A O no hydrogen 3.133 N/A LEU 794.A N ILE 790.A O no hydrogen 2.872 N/A ARG 795.A N GLY 791.A O no hydrogen 2.962 N/A ARG 795.A NH2 ASP 792.A OD1 no hydrogen 3.141 N/A LEU 796.A N ASP 792.A O no hydrogen 2.868 N/A VAL 797.A N ILE 793.A O no hydrogen 2.917 N/A ALA 798.A N LEU 794.A O no hydrogen 2.901 N/A GLY 799.A N ARG 795.A O no hydrogen 2.932 N/A ARG 800.A N VAL 797.A O no hydrogen 3.180 N/A