Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6bzo_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG ASN 1.A O no hydrogen 2.277 N/A ARG 9.A NH1 PRO 595.A O no hydrogen 3.361 N/A ARG 9.A NH1 VAL 943.A O no hydrogen 3.239 N/A ARG 9.A NH2 GLU 683.A OE1 no hydrogen 3.128 N/A ARG 9.A NH2 GLU 683.A OE2 no hydrogen 2.781 N/A PHE 12.A N SER 944.A O no hydrogen 3.097 N/A ALA 13.A N SER 11.A OG no hydrogen 3.207 N/A LYS 14.A N ASP 949.A OD2 no hydrogen 2.795 N/A LYS 14.A NZ PHE 12.A O no hydrogen 2.825 N/A LYS 14.A NZ GLU 955.A OE1 no hydrogen 3.494 N/A LYS 14.A NZ GLU 955.A OE2 no hydrogen 3.011 N/A ASP 26.A N GLY 23.A O no hydrogen 2.213 N/A GLN 28.A N LEU 25.A O no hydrogen 3.167 N/A THR 29.A N LEU 25.A O no hydrogen 3.249 N/A THR 29.A OG1 ASP 30.A OD1 no hydrogen 3.354 N/A SER 31.A N ASP 26.A O no hydrogen 3.311 N/A SER 31.A OG THR 351.A OG1 no hydrogen 2.530 N/A PHE 32.A N GLN 28.A O no hydrogen 2.969 N/A TRP 34.A N PHE 32.A O no hydrogen 1.975 N/A LEU 35.A N PHE 32.A O no hydrogen 3.056 N/A ARG 42.A N SER 38.A O no hydrogen 3.267 N/A GLU 43.A N PRO 39.A O no hydrogen 2.914 N/A SER 44.A N ARG 40.A O no hydrogen 2.899 N/A ALA 45.A N TRP 41.A O no hydrogen 2.821 N/A ALA 46.A N GLU 43.A O no hydrogen 3.044 N/A GLU 47.A N GLU 43.A O no hydrogen 2.928 N/A GLY 56.A N TRP 34.A O no hydrogen 2.224 N/A LEU 57.A N LEU 35.A O no hydrogen 3.278 N/A GLU 59.A N GLY 55.A O no hydrogen 3.229 N/A VAL 60.A N LEU 57.A O no hydrogen 2.731 N/A LEU 61.A N LEU 57.A O no hydrogen 3.028 N/A TYR 62.A N GLU 58.A O no hydrogen 2.928 N/A GLU 63.A N VAL 60.A O no hydrogen 2.975 N/A LEU 64.A N VAL 60.A O no hydrogen 2.902 N/A LEU 64.A N LEU 61.A O no hydrogen 2.686 N/A SER 65.A N LEU 61.A O no hydrogen 2.685 N/A SER 65.A OG SER 77.A OG no hydrogen 2.965 N/A SER 71.A OG SER 73.A OG no hydrogen 3.306 N/A GLY 72.A N ASP 69.A O no hydrogen 3.238 N/A GLY 72.A N ASP 69.A OD1 no hydrogen 2.774 N/A SER 73.A OG SER 71.A OG no hydrogen 3.306 N/A SER 75.A N ILE 111.A O no hydrogen 2.903 N/A LEU 76.A N ILE 67.A O no hydrogen 2.850 N/A SER 77.A N GLU 109.A O no hydrogen 2.888 N/A SER 77.A OG SER 65.A OG no hydrogen 2.965 N/A SER 77.A OG PHE 78.A O no hydrogen 3.527 N/A SER 79.A N THR 107.A O no hydrogen 2.913 N/A ARG 82.A N PHE 105.A O no hydrogen 2.852 N/A ASP 84.A N PRO 103.A O no hydrogen 3.155 N/A LYS 87.A NZ ASP 127.A OD1 no hydrogen 3.380 N/A CYS 93.A N PRO 89.A O no hydrogen 3.036 N/A CYS 93.A SG ALA 88.A O no hydrogen 3.082 N/A CYS 93.A SG PRO 89.A O no hydrogen 3.264 N/A LYS 94.A N VAL 90.A O no hydrogen 2.842 N/A ASP 95.A N GLU 92.A O no hydrogen 2.908 N/A LYS 96.A N GLU 92.A O no hydrogen 2.932 N/A THR 99.A OG1 ILE 138.A O no hydrogen 3.225 N/A TYR 100.A N ILE 138.A O no hydrogen 3.173 N/A ALA 102.A N PHE 128.A O no hydrogen 2.910 N/A LEU 104.A N GLY 126.A O no hydrogen 2.923 N/A PHE 105.A N ARG 82.A O no hydrogen 2.879 N/A VAL 106.A N VAL 123.A O no hydrogen 3.246 N/A THR 107.A N SER 79.A O no hydrogen 2.898 N/A ALA 108.A N GLN 121.A O no hydrogen 3.091 N/A GLU 109.A N SER 77.A O no hydrogen 2.905 N/A PHE 110.A N LYS 119.A O no hydrogen 3.178 N/A ILE 111.A N SER 75.A O no hydrogen 2.906 N/A ASN 113.A N SER 73.A O no hydrogen 2.608 N/A ASN 113.A ND2 GLY 72.A O no hydrogen 2.276 N/A ASN 114.A N ASN 112.A OD1 no hydrogen 2.952 N/A LYS 119.A NZ ILE 383.A O no hydrogen 3.336 N/A GLN 121.A N ALA 108.A O no hydrogen 2.803 N/A VAL 123.A N VAL 106.A O no hydrogen 3.130 N/A MET 125.A N LEU 104.A O no hydrogen 2.959 N/A PHE 128.A N ALA 102.A O no hydrogen 2.862 N/A MET 130.A N TYR 100.A O no hydrogen 3.374 N/A THR 132.A N THR 136.A O no hydrogen 2.930 N/A THR 132.A OG1 THR 136.A O no hydrogen 2.333 N/A THR 132.A OG1 THR 136.A OG1 no hydrogen 3.072 N/A LYS 134.A NZ GLY 610.A O no hydrogen 1.969 N/A GLY 135.A N THR 132.A O no hydrogen 3.056 N/A THR 136.A N THR 132.A OG1 no hydrogen 3.105 N/A THR 136.A OG1 THR 132.A OG1 no hydrogen 3.072 N/A THR 136.A OG1 GLU 143.A OE2 no hydrogen 2.403 N/A PHE 137.A N ARG 144.A O no hydrogen 2.925 N/A ILE 139.A N THR 142.A O no hydrogen 2.897 N/A THR 142.A N ILE 139.A O no hydrogen 2.911 N/A THR 142.A OG1 ILE 139.A O no hydrogen 2.672 N/A ARG 144.A N PHE 137.A O no hydrogen 2.865 N/A ARG 144.A NE SER 408.A OG no hydrogen 3.128 N/A ARG 144.A NH2 SER 408.A O no hydrogen 2.368 N/A VAL 145.A N GLN 409.A O no hydrogen 2.877 N/A VAL 147.A N LEU 407.A O no hydrogen 3.250 N/A SER 148.A OG ARG 425.A O no hydrogen 2.947 N/A GLN 149.A N ARG 350.A O no hydrogen 2.925 N/A GLN 149.A NE2 PRO 431.A O no hydrogen 2.438 N/A VAL 151.A N ARG 348.A O no hydrogen 2.931 N/A SER 153.A N ASN 346.A O no hydrogen 3.429 N/A SER 153.A OG TYR 157.A OH no hydrogen 3.318 N/A GLY 155.A N ILE 176.A O no hydrogen 2.916 N/A TYR 157.A N LYS 174.A O no hydrogen 2.904 N/A TYR 157.A OH SER 153.A OG no hydrogen 3.318 N/A ASP 159.A N SER 172.A O no hydrogen 2.917 N/A THR 161.A N LEU 170.A O no hydrogen 2.897 N/A THR 161.A OG1 LEU 170.A O no hydrogen 3.406 N/A SER 165.A OG ASP 163.A OD1 no hydrogen 2.205 N/A THR 166.A N ASP 163.A OD1 no hydrogen 2.494 N/A ASP 167.A N ASP 163.A OD1 no hydrogen 3.362 N/A LYS 168.A N ASP 163.A OD2 no hydrogen 3.115 N/A LYS 168.A NZ LYS 189.A O no hydrogen 2.812 N/A LEU 170.A N THR 161.A O no hydrogen 2.910 N/A SER 172.A N ASP 159.A O no hydrogen 2.883 N/A SER 172.A OG VAL 173.A O no hydrogen 3.285 N/A LYS 174.A N TYR 157.A O no hydrogen 2.909 N/A ILE 176.A N GLY 155.A O no hydrogen 2.886 N/A SER 178.A OG ASP 278.A O no hydrogen 2.978 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.146 N/A VAL 195.A N GLN 203.A O no hydrogen 2.992 N/A ARG 196.A N GLY 194.A O no hydrogen 2.428 N/A ASP 198.A N TRP 182.A O no hydrogen 2.443 N/A LYS 200.A N ILE 197.A O no hydrogen 3.131 N/A LYS 200.A NZ LEU 252.A O no hydrogen 2.863 N/A ARG 202.A N LYS 200.A O no hydrogen 2.576 N/A ARG 202.A NH1 VAL 193.A O no hydrogen 1.995 N/A GLN 203.A NE2 ARG 202.A O no hydrogen 2.224 N/A VAL 207.A N PRO 204.A O no hydrogen 2.779 N/A LEU 209.A N VAL 205.A O no hydrogen 2.976 N/A LYS 210.A N THR 206.A O no hydrogen 2.905 N/A ALA 211.A N VAL 207.A O no hydrogen 2.829 N/A LEU 212.A N LEU 208.A O no hydrogen 2.936 N/A LEU 212.A N LEU 209.A O no hydrogen 3.005 N/A GLY 213.A N LYS 210.A O no hydrogen 2.594 N/A TRP 214.A N LYS 210.A O no hydrogen 3.081 N/A THR 215.A N GLN 218.A OE1 no hydrogen 2.779 N/A GLN 218.A N THR 215.A OG1 no hydrogen 3.242 N/A ILE 219.A N THR 215.A O no hydrogen 3.407 N/A GLU 221.A N GLU 217.A O no hydrogen 2.896 N/A ARG 222.A N GLN 218.A O no hydrogen 2.896 N/A PHE 223.A N ILE 219.A O no hydrogen 2.778 N/A SER 226.A N GLU 321.A OE2 no hydrogen 3.169 N/A GLU 227.A N GLU 227.A OE1 no hydrogen 2.872 N/A ARG 230.A N GLU 227.A O no hydrogen 2.726 N/A THR 232.A OG1 MET 229.A O no hydrogen 2.653 N/A LEU 233.A N MET 229.A O no hydrogen 2.924 N/A GLU 234.A N ARG 230.A O no hydrogen 2.880 N/A LYS 235.A N SER 231.A O no hydrogen 2.911 N/A ASP 236.A N LEU 233.A O no hydrogen 3.327 N/A THR 238.A OG1 ASP 236.A O no hydrogen 3.395 N/A THR 238.A OG1 ASN 237.A OD1 no hydrogen 2.602 N/A LEU 245.A N THR 241.A O no hydrogen 2.819 N/A LEU 246.A N ASP 242.A O no hydrogen 2.960 N/A ILE 248.A N ALA 244.A O no hydrogen 2.880 N/A TYR 249.A N LEU 245.A O no hydrogen 2.946 N/A ARG 250.A N LEU 246.A O no hydrogen 2.858 N/A LYS 251.A N ASP 247.A O no hydrogen 2.931 N/A LEU 252.A N ILE 248.A O no hydrogen 2.893 N/A LEU 252.A N TYR 249.A O no hydrogen 3.125 N/A ARG 253.A N TYR 249.A O no hydrogen 2.923 N/A ARG 253.A NE GLU 256.A OE1 no hydrogen 3.194 N/A THR 259.A N SER 262.A OG no hydrogen 2.534 N/A THR 259.A OG1 SER 262.A OG no hydrogen 3.107 N/A SER 262.A N THR 259.A OG1 no hydrogen 3.145 N/A SER 262.A OG THR 259.A O no hydrogen 3.284 N/A SER 262.A OG THR 259.A OG1 no hydrogen 3.107 N/A GLN 264.A N LYS 260.A O no hydrogen 3.175 N/A THR 265.A N GLU 261.A O no hydrogen 2.888 N/A THR 265.A OG1 GLU 261.A O no hydrogen 2.298 N/A GLU 268.A N GLN 264.A O no hydrogen 2.972 N/A ASN 269.A N LEU 266.A O no hydrogen 2.726 N/A LYS 275.A N LYS 273.A O no hydrogen 2.611 N/A ARG 276.A N LYS 273.A O no hydrogen 3.376 N/A ALA 280.A N SER 178.A OG no hydrogen 3.117 N/A ARG 284.A N ALA 280.A O no hydrogen 3.276 N/A ARG 284.A NE ARG 284.A O no hydrogen 2.606 N/A TYR 285.A N VAL 282.A O no hydrogen 2.591 N/A LYS 286.A N VAL 282.A O no hydrogen 2.875 N/A LYS 286.A NZ ASN 346.A OD1 no hydrogen 3.344 N/A VAL 287.A N GLY 283.A O no hydrogen 2.901 N/A LYS 289.A N TYR 285.A O no hydrogen 2.925 N/A LYS 290.A N LYS 286.A O no hydrogen 2.928 N/A LYS 290.A NZ GLU 337.A O no hydrogen 3.185 N/A LYS 290.A NZ ASP 339.A OD1 no hydrogen 2.089 N/A LYS 290.A NZ ASP 339.A OD2 no hydrogen 3.055 N/A LEU 291.A N VAL 287.A O no hydrogen 2.926 N/A GLY 292.A N ASN 288.A O no hydrogen 2.825 N/A LEU 293.A N ASN 288.A O no hydrogen 3.225 N/A VAL 295.A N LEU 293.A O no hydrogen 2.377 N/A SER 302.A OG ASP 278.A OD1 no hydrogen 2.820 N/A LEU 304.A N PHE 271.A O no hydrogen 3.076 N/A VAL 310.A N GLU 306.A O no hydrogen 3.209 N/A ALA 311.A N GLU 307.A O no hydrogen 3.010 N/A THR 312.A N ASP 308.A O no hydrogen 3.031 N/A ILE 313.A N VAL 309.A O no hydrogen 2.954 N/A GLU 314.A N VAL 310.A O no hydrogen 3.146 N/A TYR 315.A N ALA 311.A O no hydrogen 2.836 N/A TYR 315.A OH PRO 335.A O no hydrogen 2.732 N/A LEU 316.A N THR 312.A O no hydrogen 2.726 N/A VAL 317.A N ILE 313.A O no hydrogen 3.174 N/A ARG 318.A N GLU 314.A O no hydrogen 2.700 N/A ARG 318.A NH2 THR 325.A O no hydrogen 2.850 N/A LEU 319.A N TYR 315.A O no hydrogen 2.884 N/A HIS 320.A N LEU 316.A O no hydrogen 3.188 N/A GLY 322.A N LEU 319.A O no hydrogen 3.259 N/A GLN 323.A NE2 GLU 321.A OE1 no hydrogen 3.347 N/A THR 325.A OG1 VAL 334.A O no hydrogen 3.171 N/A MET 326.A N VAL 334.A O no hydrogen 2.574 N/A GLY 331.A N VAL 328.A O no hydrogen 2.707 N/A VAL 334.A N MET 326.A O no hydrogen 2.659 N/A VAL 336.A N THR 324.A O no hydrogen 2.244 N/A ASP 342.A N ASP 340.A OD1 no hydrogen 3.180 N/A HIS 343.A NE2 ASP 508.A OD2 no hydrogen 2.682 N/A PHE 344.A N SER 449.A OG no hydrogen 3.160 N/A GLY 345.A N HIS 343.A ND1 no hydrogen 2.913 N/A ASN 346.A N HIS 343.A O no hydrogen 2.926 N/A ASN 346.A ND2 ASP 340.A O no hydrogen 2.832 N/A ARG 348.A N VAL 151.A O no hydrogen 2.883 N/A ARG 348.A NE PHE 480.A O no hydrogen 3.222 N/A ARG 348.A NH1 GLU 354.A OE1 no hydrogen 2.766 N/A ARG 348.A NH1 GLU 354.A OE2 no hydrogen 3.094 N/A ARG 348.A NH2 GLU 354.A OE1 no hydrogen 2.895 N/A ARG 348.A NH2 PHE 480.A O no hydrogen 2.380 N/A LEU 349.A N GLY 481.A O no hydrogen 2.677 N/A ARG 350.A N GLN 149.A O no hydrogen 2.877 N/A THR 351.A OG1 SER 31.A OG no hydrogen 2.530 N/A VAL 352.A N THR 351.A OG1 no hydrogen 2.443 N/A LEU 355.A N THR 351.A O no hydrogen 3.363 N/A ILE 356.A N VAL 352.A O no hydrogen 3.484 N/A GLN 357.A N GLY 353.A O no hydrogen 2.918 N/A GLN 357.A NE2 GLY 56.A O no hydrogen 2.280 N/A ASN 358.A N GLU 354.A O no hydrogen 2.839 N/A GLN 359.A N LEU 355.A O no hydrogen 3.030 N/A ILE 360.A N ILE 356.A O no hydrogen 2.865 N/A ARG 361.A N GLN 357.A O no hydrogen 2.878 N/A ARG 361.A NE GLU 63.A OE2 no hydrogen 3.044 N/A ARG 361.A NH1 ASN 358.A OD1 no hydrogen 2.910 N/A VAL 362.A N ASN 358.A O no hydrogen 2.907 N/A GLY 363.A N GLN 359.A O no hydrogen 2.930 N/A MET 364.A N ILE 360.A O no hydrogen 2.887 N/A SER 365.A N ARG 361.A O no hydrogen 2.902 N/A SER 365.A OG ARG 361.A O no hydrogen 3.157 N/A ARG 366.A N GLY 363.A O no hydrogen 2.790 N/A MET 367.A N GLY 363.A O no hydrogen 2.936 N/A GLU 368.A N MET 364.A O no hydrogen 2.679 N/A VAL 371.A N GLU 368.A O no hydrogen 3.265 N/A ARG 372.A NH2 GLU 68.A O no hydrogen 2.419 N/A ARG 374.A NH1 THR 387.A O no hydrogen 3.497 N/A THR 377.A OG1 THR 377.A O no hydrogen 2.302 N/A ALA 382.A N ASP 379.A O no hydrogen 3.051 N/A THR 384.A N THR 387.A OG1 no hydrogen 2.566 N/A THR 384.A OG1 GLN 121.A OE1 no hydrogen 3.301 N/A GLN 386.A N GLN 121.A OE1 no hydrogen 2.603 N/A THR 387.A N THR 384.A O no hydrogen 2.629 N/A THR 387.A OG1 THR 384.A O no hydrogen 2.131 N/A LEU 388.A N PRO 385.A O no hydrogen 3.393 N/A ILE 389.A N GLN 386.A O no hydrogen 3.380 N/A VAL 394.A N ILE 391.A O no hydrogen 2.707 N/A ALA 396.A N ARG 392.A O no hydrogen 2.971 N/A ALA 397.A N PRO 393.A O no hydrogen 2.900 N/A ILE 398.A N VAL 394.A O no hydrogen 2.921 N/A LYS 399.A N VAL 395.A O no hydrogen 2.915 N/A GLU 400.A N ALA 396.A O no hydrogen 2.859 N/A PHE 401.A N ALA 397.A O no hydrogen 2.916 N/A PHE 401.A N ILE 398.A O no hydrogen 2.930 N/A PHE 402.A N ILE 398.A O no hydrogen 2.935 N/A GLY 403.A N LYS 399.A O no hydrogen 3.130 N/A THR 404.A OG1 GLU 400.A O no hydrogen 3.054 N/A THR 404.A OG1 GLY 403.A O no hydrogen 2.329 N/A SER 408.A N SER 405.A O no hydrogen 3.184 N/A SER 408.A OG PHE 402.A O no hydrogen 3.386 N/A GLN 409.A N VAL 145.A O no hydrogen 2.927 N/A MET 411.A N GLU 143.A O no hydrogen 2.984 N/A ASP 412.A N HIS 422.A ND1 no hydrogen 2.940 N/A ASN 414.A N SER 418.A OG no hydrogen 3.338 N/A ASN 415.A N SER 418.A OG no hydrogen 3.071 N/A ASN 415.A ND2 GLN 583.A O no hydrogen 3.194 N/A SER 418.A OG ASP 412.A O no hydrogen 3.407 N/A SER 418.A OG ASN 414.A OD1 no hydrogen 2.827 N/A SER 418.A OG ASN 415.A O no hydrogen 2.612 N/A SER 418.A OG ASN 415.A OD1 no hydrogen 2.330 N/A GLY 419.A N ASN 415.A O no hydrogen 3.216 N/A LEU 420.A N PRO 416.A O no hydrogen 2.913 N/A THR 421.A N LEU 417.A O no hydrogen 2.888 N/A THR 421.A OG1 LEU 417.A O no hydrogen 2.827 N/A THR 421.A OG1 SER 418.A O no hydrogen 3.305 N/A HIS 422.A N SER 418.A O no hydrogen 2.922 N/A HIS 422.A N GLY 419.A O no hydrogen 3.259 N/A HIS 422.A NE2 GLN 409.A OE1 no hydrogen 2.934 N/A LYS 423.A NZ GLY 419.A O no hydrogen 3.430 N/A ARG 424.A NH1 LEU 24.A O no hydrogen 2.535 N/A LEU 426.A N GLY 469.A O no hydrogen 2.911 N/A SER 427.A N SER 148.A O no hydrogen 3.506 N/A ALA 428.A N LEU 467.A O no hydrogen 2.759 N/A GLY 433.A N GLY 430.A O no hydrogen 3.353 N/A GLU 442.A N GLY 440.A O no hydrogen 2.742 N/A ARG 444.A NH1 ILE 465.A O no hydrogen 3.138 N/A HIS 450.A N HIS 447.A O no hydrogen 2.804 N/A TYR 451.A OH ASP 551.A OD2 no hydrogen 3.058 N/A ARG 453.A N HIS 450.A O no hydrogen 3.027 N/A ARG 453.A NE ILE 483.A O no hydrogen 2.962 N/A ARG 453.A NH1 GLU 507.A OE1 no hydrogen 2.795 N/A ARG 453.A NH2 SER 449.A O no hydrogen 3.147 N/A ARG 453.A NH2 GLU 507.A OE1 no hydrogen 3.132 N/A MET 454.A N HIS 450.A O no hydrogen 3.145 N/A CYS 455.A N SER 470.A O no hydrogen 3.117 N/A CYS 455.A SG MET 557.A O no hydrogen 3.590 N/A CYS 455.A SG SER 559.A OG no hydrogen 3.436 N/A THR 459.A OG1 ILE 468.A O no hydrogen 3.272 N/A LEU 467.A N ASN 464.A O no hydrogen 2.934 N/A GLY 469.A N LEU 426.A O no hydrogen 2.898 N/A SER 470.A OG GLU 458.A OE1 no hydrogen 2.571 N/A LEU 471.A N ARG 424.A O no hydrogen 2.956 N/A SER 472.A N ARG 453.A O no hydrogen 2.993 N/A ARG 476.A N GLU 484.A O no hydrogen 3.382 N/A ASN 478.A N PHE 482.A O no hydrogen 2.641 N/A GLU 484.A N ARG 476.A O no hydrogen 2.592 N/A THR 485.A N LEU 502.A O no hydrogen 2.911 N/A THR 485.A OG1 GLY 452.A O no hydrogen 2.964 N/A TYR 487.A N VAL 500.A O no hydrogen 2.977 N/A TYR 487.A OH GLU 507.A OE1 no hydrogen 2.926 N/A ARG 488.A N MET 550.A O no hydrogen 2.881 N/A ARG 488.A NH2 ASP 497.A OD1 no hydrogen 3.549 N/A LYS 489.A N GLU 498.A O no hydrogen 3.457 N/A VAL 490.A N ASP 548.A O no hydrogen 2.306 N/A VAL 491.A N VAL 494.A O no hydrogen 3.476 N/A VAL 494.A N VAL 491.A O no hydrogen 3.259 N/A VAL 495.A N GLY 523.A O no hydrogen 2.273 N/A SER 496.A OG LYS 489.A O no hydrogen 2.326 N/A VAL 500.A N TYR 487.A O no hydrogen 2.863 N/A LEU 502.A N THR 485.A O no hydrogen 2.849 N/A HIS 510.A N GLU 507.A O no hydrogen 3.192 N/A ALA 513.A N TYR 549.A O no hydrogen 2.482 N/A SER 517.A OG GLN 514.A O no hydrogen 3.296 N/A ILE 519.A N SER 517.A O no hydrogen 2.616 N/A ASP 520.A N ARG 524.A O no hydrogen 3.162 N/A VAL 526.A N PRO 518.A O no hydrogen 2.845 N/A VAL 530.A N VAL 542.A O no hydrogen 2.869 N/A ARG 533.A N VAL 512.A O no hydrogen 3.087 N/A ARG 533.A NH2 TYR 487.A OH no hydrogen 3.551 N/A ARG 534.A NH2 GLU 546.A OE1 no hydrogen 3.535 N/A VAL 542.A N VAL 530.A O no hydrogen 2.930 N/A SER 544.A N PRO 528.A O no hydrogen 2.890 N/A SER 544.A OG PRO 528.A O no hydrogen 3.002 N/A TYR 549.A N VAL 511.A O no hydrogen 3.386 N/A MET 550.A N ARG 488.A O no hydrogen 2.891 N/A SER 553.A OG GLU 17.A OE1 no hydrogen 2.987 N/A SER 553.A OG TYR 474.A OH no hydrogen 3.326 N/A SER 553.A OG PRO 554.A O no hydrogen 3.178 N/A ARG 555.A NH1 GLU 17.A OE2 no hydrogen 2.965 N/A GLN 556.A NE2 PRO 486.A O no hydrogen 3.451 N/A VAL 558.A N ARG 555.A O no hydrogen 3.133 N/A SER 559.A OG GLU 458.A OE1 no hydrogen 2.611 N/A ALA 563.A N SER 559.A O no hydrogen 3.191 N/A ALA 563.A N VAL 560.A O no hydrogen 3.054 N/A ILE 565.A N THR 562.A O no hydrogen 3.277 N/A GLU 569.A N GLU 569.A OE1 no hydrogen 2.141 N/A HIS 570.A N PHE 567.A O no hydrogen 3.294 N/A ASP 571.A N LEU 568.A O no hydrogen 3.155 N/A ASP 572.A N MET 897.A O no hydrogen 3.031 N/A ALA 573.A N ASP 572.A OD1 no hydrogen 2.454 N/A ALA 576.A N ASP 572.A O no hydrogen 2.828 N/A LEU 577.A N ALA 573.A O no hydrogen 2.868 N/A MET 578.A N ASN 574.A O no hydrogen 2.933 N/A GLY 579.A N ARG 575.A O no hydrogen 2.873 N/A ALA 580.A N ALA 576.A O no hydrogen 2.898 N/A ASN 581.A N LEU 577.A O no hydrogen 2.921 N/A ASN 581.A ND2 THR 459.A O no hydrogen 2.279 N/A MET 582.A N GLY 579.A O no hydrogen 3.299 N/A ARG 584.A NH1 ASN 581.A OD1 no hydrogen 2.230 N/A ALA 586.A N GLN 583.A O no hydrogen 3.361 N/A VAL 587.A N LYS 1003.A O no hydrogen 3.257 N/A SER 592.A OG THR 679.A O no hydrogen 2.517 N/A LEU 596.A N ASN 689.A OD1 no hydrogen 2.979 N/A THR 599.A N GLU 602.A OE1 no hydrogen 3.056 N/A THR 599.A OG1 ALA 563.A O no hydrogen 3.116 N/A MET 601.A N THR 599.A OG1 no hydrogen 3.259 N/A GLU 602.A N THR 599.A O no hydrogen 3.502 N/A ARG 604.A NH1 ARG 604.A O no hydrogen 3.430 N/A ALA 605.A N GLU 602.A O no hydrogen 3.335 N/A ALA 609.A N ALA 606.A O no hydrogen 3.096 N/A VAL 613.A N ALA 674.A O no hydrogen 3.356 N/A ALA 615.A N GLN 671.A O no hydrogen 2.877 N/A GLU 616.A N TYR 641.A OH no hydrogen 2.847 N/A VAL 620.A N MET 632.A O no hydrogen 3.295 N/A ILE 621.A N ASP 665.A O no hydrogen 3.162 N/A GLU 622.A N THR 630.A O no hydrogen 3.047 N/A SER 625.A N TYR 628.A O no hydrogen 2.900 N/A TYR 628.A OH GLU 623.A OE1 no hydrogen 3.231 N/A ILE 629.A N TYR 641.A O no hydrogen 2.920 N/A THR 630.A N GLU 623.A O no hydrogen 2.909 N/A THR 630.A OG1 GLU 623.A O no hydrogen 3.195 N/A VAL 631.A N ARG 639.A O no hydrogen 2.900 N/A MET 632.A N VAL 620.A O no hydrogen 2.905 N/A ARG 639.A N VAL 631.A O no hydrogen 2.914 N/A TYR 641.A N ILE 629.A O no hydrogen 2.866 N/A LYS 645.A NZ ASN 656.A OD1 no hydrogen 2.666 N/A LYS 645.A NZ GLN 657.A O no hydrogen 2.514 N/A ARG 648.A NE ILE 723.A O no hydrogen 2.827 N/A SER 649.A N THR 653.A O no hydrogen 3.379 N/A SER 649.A OG GLN 413.A O no hydrogen 2.128 N/A ASN 650.A N SER 649.A OG no hydrogen 2.669 N/A ASN 650.A ND2 GLU 143.A O no hydrogen 3.689 N/A ASN 650.A ND2 MET 411.A O no hydrogen 3.032 N/A ALA 655.A N ALA 647.A O no hydrogen 2.939 N/A GLN 657.A N ASN 656.A OD1 no hydrogen 2.678 N/A ILE 660.A N ILE 673.A O no hydrogen 2.803 N/A ASP 662.A N ASP 665.A OD2 no hydrogen 2.676 N/A ARG 666.A NH1 GLY 619.A O no hydrogen 2.022 N/A VAL 667.A N GLY 619.A O no hydrogen 3.331 N/A GLU 668.A N GLN 671.A OE1 no hydrogen 3.356 N/A GLY 670.A N ALA 615.A O no hydrogen 2.935 N/A GLN 671.A N GLU 668.A O no hydrogen 3.003 N/A ILE 673.A N VAL 613.A O no hydrogen 2.931 N/A ASP 675.A N CYS 658.A O no hydrogen 2.896 N/A GLY 676.A N THR 679.A OG1 no hydrogen 2.309 N/A ASP 680.A N GLU 683.A O no hydrogen 2.990 N/A ASP 681.A N ASP 675.A OD2 no hydrogen 3.507 N/A GLY 682.A N ASP 675.A OD1 no hydrogen 3.244 N/A ALA 685.A N CYS 678.A O no hydrogen 2.729 N/A GLY 687.A N TYR 1000.A OH no hydrogen 2.352 N/A LYS 688.A N ILE 1001.A O no hydrogen 2.905 N/A LYS 688.A NZ VAL 717.A O no hydrogen 2.790 N/A ASN 689.A ND2 ALA 594.A O no hydrogen 3.300 N/A LEU 690.A N MET 999.A O no hydrogen 2.866 N/A LEU 691.A N ASP 885.A OD2 no hydrogen 3.177 N/A VAL 692.A N GLY 997.A O no hydrogen 2.869 N/A ALA 693.A N ILE 886.A O no hydrogen 3.207 N/A ILE 694.A N THR 995.A O no hydrogen 3.158 N/A TRP 697.A N ASN 701.A OD1 no hydrogen 3.197 N/A HIS 700.A N TRP 697.A O no hydrogen 3.149 N/A ASN 701.A ND2 MET 695.A O no hydrogen 3.597 N/A ASN 701.A ND2 ILE 887.A O no hydrogen 2.842 N/A ILE 706.A N VAL 865.A O no hydrogen 3.108 N/A LEU 708.A N LYS 868.A O no hydrogen 3.097 N/A SER 709.A OG VAL 884.A O no hydrogen 2.637 N/A SER 709.A OG ASP 885.A O no hydrogen 3.055 N/A ARG 711.A NE ASP 885.A OD1 no hydrogen 3.173 N/A ARG 711.A NH1 GLU 715.A OE1 no hydrogen 3.208 N/A ARG 711.A NH2 ASP 885.A OD2 no hydrogen 2.581 N/A LEU 712.A N SER 709.A O no hydrogen 3.263 N/A VAL 713.A N ASN 710.A O no hydrogen 2.868 N/A GLU 714.A N ASN 710.A O no hydrogen 2.851 N/A GLU 715.A N ARG 711.A O no hydrogen 2.987 N/A THR 719.A OG1 ASP 716.A OD1 no hydrogen 2.812 N/A SER 720.A N ARG 848.A O no hydrogen 2.936 N/A SER 720.A OG HIS 722.A NE2 no hydrogen 3.142 N/A HIS 722.A N GLN 846.A O no hydrogen 2.917 N/A ILE 723.A N GLY 652.A O no hydrogen 2.917 N/A GLU 724.A N VAL 844.A O no hydrogen 2.911 N/A HIS 726.A N VAL 842.A O no hydrogen 2.917 N/A ILE 728.A N VAL 840.A O no hydrogen 2.931 N/A ALA 730.A N GLU 838.A O no hydrogen 2.860 N/A ARG 731.A NE ASP 729.A OD2 no hydrogen 2.988 N/A ARG 731.A NH2 ASP 729.A OD2 no hydrogen 2.983 N/A THR 733.A N GLY 736.A O no hydrogen 2.484 N/A GLU 738.A N ARG 731.A O no hydrogen 2.834 N/A GLU 739.A N VAL 777.A O no hydrogen 3.132 N/A ARG 742.A NH2 LEU 752.A O no hydrogen 3.354 N/A GLU 750.A N SER 748.A OG no hydrogen 3.253 N/A ASP 756.A N ILE 760.A O no hydrogen 3.242 N/A ARG 758.A N ASP 756.A OD1 no hydrogen 3.270 N/A ARG 758.A NH1 ASP 756.A OD2 no hydrogen 3.546 N/A GLY 759.A N ASP 756.A O no hydrogen 3.086 N/A VAL 761.A N LEU 773.A O no hydrogen 3.203 N/A ARG 762.A N ASP 754.A O no hydrogen 3.348 N/A GLY 764.A N VAL 818.A O no hydrogen 3.150 N/A ALA 765.A N ARG 762.A O no hydrogen 3.231 N/A ARG 768.A N ASP 771.A OD2 no hydrogen 2.627 N/A ASP 771.A N ARG 768.A O no hydrogen 3.421 N/A LEU 773.A N LEU 808.A O no hydrogen 2.944 N/A VAL 774.A N LEU 808.A O no hydrogen 3.346 N/A LYS 776.A NZ ASP 729.A O no hydrogen 3.389 N/A LYS 776.A NZ GLU 738.A OE1 no hydrogen 1.994 N/A VAL 777.A N GLU 739.A O no hydrogen 3.054 N/A THR 778.A N ARG 804.A O no hydrogen 3.043 N/A LYS 780.A N GLU 802.A O no hydrogen 2.293 N/A GLU 788.A N GLU 788.A OE1 no hydrogen 2.137 N/A GLU 789.A N THR 786.A O no hydrogen 3.214 N/A ARG 790.A N THR 786.A O no hydrogen 3.281 N/A ARG 790.A NH1 LEU 785.A O no hydrogen 3.133 N/A LEU 791.A N PRO 787.A O no hydrogen 2.877 N/A LEU 792.A N GLU 789.A O no hydrogen 3.067 N/A ARG 793.A N GLU 789.A O no hydrogen 2.931 N/A ALA 794.A N ARG 790.A O no hydrogen 3.195 N/A PHE 796.A N LEU 792.A O no hydrogen 3.205 N/A GLY 797.A N ALA 794.A O no hydrogen 3.248 N/A GLU 798.A N ARG 793.A O no hydrogen 3.259 N/A ARG 801.A NH1 ILE 744.A O no hydrogen 3.194 N/A GLU 802.A N GLU 802.A OE1 no hydrogen 2.157 N/A ARG 804.A N THR 778.A O no hydrogen 2.380 N/A SER 807.A OG VAL 774.A O no hydrogen 2.053 N/A LEU 808.A N VAL 774.A O no hydrogen 3.241 N/A VAL 810.A N ASP 771.A O no hydrogen 3.101 N/A LYS 817.A NZ GLU 766.A OE1 no hydrogen 3.002 N/A ILE 819.A N TYR 843.A O no hydrogen 2.780 N/A ARG 822.A N ARG 841.A O no hydrogen 2.906 N/A ARG 822.A NH2 ASP 95.A OD1 no hydrogen 2.798 N/A ARG 822.A NH2 ASP 95.A OD2 no hydrogen 2.848 N/A PHE 824.A N LEU 839.A O no hydrogen 2.886 N/A SER 825.A N ASP 830.A OD2 no hydrogen 3.157 N/A SER 825.A OG ASN 837.A O no hydrogen 3.437 N/A ARG 826.A N ASN 837.A O no hydrogen 2.973 N/A ARG 826.A NH1 LEU 832.A O no hydrogen 3.479 N/A GLU 827.A N SER 825.A OG no hydrogen 3.291 N/A ASP 828.A N SER 825.A O no hydrogen 3.154 N/A GLU 829.A N ARG 826.A O no hydrogen 3.313 N/A ASP 830.A N SER 825.A O no hydrogen 3.011 N/A ASN 837.A N ALA 730.A O no hydrogen 2.820 N/A ASN 837.A ND2 ASP 732.A OD2 no hydrogen 3.420 N/A GLU 838.A N ALA 730.A O no hydrogen 2.951 N/A LEU 839.A N PHE 824.A O no hydrogen 2.901 N/A VAL 840.A N ILE 728.A O no hydrogen 2.904 N/A ARG 841.A N ARG 822.A O no hydrogen 2.877 N/A ARG 841.A NH1 GLU 727.A OE1 no hydrogen 3.381 N/A ARG 841.A NH1 GLU 727.A OE2 no hydrogen 3.223 N/A ARG 841.A NH2 ASP 97.A OD2 no hydrogen 2.871 N/A VAL 842.A N HIS 726.A O no hydrogen 2.875 N/A TYR 843.A N GLY 820.A O no hydrogen 2.897 N/A VAL 844.A N GLU 724.A O no hydrogen 2.887 N/A ALA 845.A N LYS 817.A O no hydrogen 2.993 N/A ARG 848.A N SER 720.A O no hydrogen 2.871 N/A ARG 848.A NH1 ASP 1010.A OD1 no hydrogen 3.459 N/A SER 851.A N ASP 854.A OD2 no hydrogen 2.680 N/A SER 851.A OG ASP 852.A OD1 no hydrogen 3.029 N/A GLY 853.A N ILE 866.A O no hydrogen 2.736 N/A ASP 854.A N SER 851.A O no hydrogen 2.963 N/A LEU 856.A N GLY 864.A O no hydrogen 2.968 N/A ALA 857.A N MET 1002.A O no hydrogen 2.967 N/A GLY 858.A N ASN 862.A O no hydrogen 3.169 N/A ARG 859.A NH2 VAL 597.A O no hydrogen 2.504 N/A ARG 859.A NH2 GLU 904.A OE1 no hydrogen 3.471 N/A HIS 860.A ND1 ASP 571.A OD2 no hydrogen 2.769 N/A GLY 867.A N ILE 706.A O no hydrogen 2.901 N/A LEU 870.A N LEU 708.A O no hydrogen 3.216 N/A GLU 873.A N GLU 873.A OE1 no hydrogen 2.626 N/A ASP 874.A N PRO 871.A O no hydrogen 3.302 N/A PHE 877.A N PHE 982.A O no hydrogen 3.382 N/A LEU 878.A N THR 882.A O no hydrogen 2.999 N/A GLY 881.A N LEU 878.A O no hydrogen 2.969 N/A VAL 884.A N PRO 876.A O no hydrogen 3.026 N/A ASP 885.A N LEU 691.A O no hydrogen 2.733 N/A ILE 886.A N LEU 691.A O no hydrogen 3.033 N/A ILE 887.A N ILE 707.A O no hydrogen 3.299 N/A LEU 888.A N ALA 693.A O no hydrogen 2.970 N/A ASN 889.A ND2 ASN 701.A O no hydrogen 2.851 N/A THR 890.A OG1 ILE 694.A O no hydrogen 2.439 N/A HIS 891.A N ASN 889.A OD1 no hydrogen 3.054 N/A VAL 893.A N THR 890.A O no hydrogen 2.898 N/A ARG 895.A NE HIS 891.A O no hydrogen 2.967 N/A MET 897.A N PRO 894.A O no hydrogen 3.156 N/A GLN 901.A N ASN 898.A O no hydrogen 3.079 N/A ILE 902.A N ILE 899.A O no hydrogen 2.896 N/A LEU 903.A N ILE 899.A O no hydrogen 3.335 N/A GLU 904.A N GLY 900.A O no hydrogen 3.316 N/A THR 905.A OG1 GLN 901.A O no hydrogen 2.887 N/A HIS 906.A N ILE 902.A O no hydrogen 2.992 N/A LEU 907.A N LEU 903.A O no hydrogen 2.844 N/A GLY 908.A N GLU 904.A O no hydrogen 2.591 N/A TRP 909.A N HIS 906.A O no hydrogen 2.912 N/A CYS 910.A N HIS 906.A O no hydrogen 3.331 N/A CYS 910.A SG HIS 906.A O no hydrogen 3.934 N/A CYS 910.A SG LEU 959.A O no hydrogen 3.050 N/A ALA 911.A N LEU 907.A O no hydrogen 2.978 N/A HIS 912.A N TRP 909.A O no hydrogen 2.913 N/A SER 913.A N TRP 909.A O no hydrogen 2.786 N/A SER 913.A OG TRP 909.A O no hydrogen 3.386 N/A SER 913.A OG CYS 910.A O no hydrogen 3.209 N/A SER 913.A OG THR 963.A OG1 no hydrogen 3.176 N/A GLY 914.A N CYS 910.A O no hydrogen 2.565 N/A TRP 915.A NE1 LEU 934.A O no hydrogen 3.111 N/A VAL 917.A N LEU 935.A O no hydrogen 2.310 N/A ALA 920.A N ASP 918.A O no hydrogen 2.714 N/A ALA 927.A N PRO 924.A O no hydrogen 3.175 N/A GLU 933.A N ASP 932.A OD1 no hydrogen 2.156 N/A ALA 937.A N TRP 915.A O no hydrogen 2.929 N/A ASN 940.A N HIS 912.A O no hydrogen 2.918 N/A ALA 941.A N ALA 911.A O no hydrogen 2.808 N/A VAL 943.A N LEU 596.A O no hydrogen 3.440 N/A SER 944.A OG VAL 10.A O no hydrogen 2.797 N/A THR 945.A N GLY 598.A O no hydrogen 2.832 N/A GLU 955.A N GLN 952.A O no hydrogen 2.576 N/A LEU 956.A N GLN 952.A O no hydrogen 3.326 N/A LEU 959.A N GLU 955.A O no hydrogen 2.709 N/A SER 961.A OG GLY 958.A O no hydrogen 3.303 N/A CYS 962.A SG LYS 916.A O no hydrogen 2.941 N/A THR 963.A OG1 SER 913.A OG no hydrogen 3.176 N/A ASP 974.A N LYS 978.A O no hydrogen 3.414 N/A GLY 977.A N ASP 974.A O no hydrogen 2.719 N/A LYS 978.A N ASP 974.A OD1 no hydrogen 2.784 N/A ALA 979.A N VAL 994.A O no hydrogen 2.715 N/A PHE 982.A N PHE 877.A O no hydrogen 3.259 N/A ASP 983.A N GLU 988.A O no hydrogen 2.994 N/A ARG 985.A N ASP 983.A OD1 no hydrogen 3.150 N/A SER 986.A OG ASP 983.A OD2 no hydrogen 2.403 N/A GLY 987.A N ASP 983.A O no hydrogen 2.768 N/A PHE 990.A N LEU 981.A O no hydrogen 3.177 N/A VAL 994.A N ALA 979.A O no hydrogen 2.978 N/A GLY 997.A N VAL 692.A O no hydrogen 2.928 N/A MET 999.A N LEU 690.A O no hydrogen 2.926 N/A TYR 1000.A OH GLY 687.A O no hydrogen 3.320 N/A ILE 1001.A N LYS 688.A O no hydrogen 2.939 N/A MET 1002.A N ALA 857.A O no hydrogen 2.877 N/A LYS 1003.A NZ LEU 718.A O no hydrogen 3.553 N/A LYS 1003.A NZ SER 720.A OG no hydrogen 3.426 N/A LEU 1004.A N LYS 855.A O no hydrogen 3.310 N/A HIS 1005.A N GLN 585.A O no hydrogen 3.177 N/A ASP 1010.A N LEU 1007.A O no hydrogen 3.223 N/A ILE 1012.A N VAL 1008.A O no hydrogen 2.883 N/A ARG 1015.A NH2 PRO 1019.A O no hydrogen 2.521 N/A THR 1017.A OG1 SER 1016.A O no hydrogen 2.536 N/A SER 1021.A N GLN 1026.A O no hydrogen 3.151 N/A LEU 1028.A N PRO 1019.A O no hydrogen 2.910 N/A GLU 1043.A N GLU 1043.A OE1 no hydrogen 2.709 N/A CYS 1044.A SG GLY 1040.A O no hydrogen 3.258 N/A TRP 1045.A N GLU 1041.A O no hydrogen 2.921 N/A ALA 1046.A N MET 1042.A O no hydrogen 2.904 N/A MET 1047.A N GLU 1043.A O no hydrogen 2.903 N/A GLN 1048.A N CYS 1044.A O no hydrogen 2.911 N/A ALA 1049.A N TRP 1045.A O no hydrogen 2.882 N/A TYR 1050.A N ALA 1046.A O no hydrogen 2.934 N/A GLY 1051.A N GLN 1048.A O no hydrogen 2.819 N/A ALA 1052.A N MET 1047.A O no hydrogen 3.341 N/A GLN 1057.A N ALA 1053.A O no hydrogen 2.923 N/A GLU 1058.A N TYR 1054.A O no hydrogen 2.889 N/A LEU 1059.A N THR 1055.A O no hydrogen 2.925 N/A LEU 1060.A N GLN 1057.A O no hydrogen 3.011 N/A THR 1061.A N GLN 1057.A O no hydrogen 2.764 N/A THR 1061.A OG1 GLN 1057.A O no hydrogen 2.640 N/A SER 1064.A OG LEU 1060.A O no hydrogen 2.621 N/A ASP 1066.A N THR 1061.A O no hydrogen 3.038 N/A THR 1067.A OG1 ASP 1065.A O no hydrogen 3.393 N/A GLY 1069.A N ASP 1066.A O no hydrogen 2.851 N/A ARG 1070.A N ASP 1066.A O no hydrogen 2.947 N/A VAL 1073.A N GLY 1069.A O no hydrogen 2.894 N/A TYR 1074.A N ARG 1070.A O no hydrogen 2.903 N/A GLU 1075.A N VAL 1071.A O no hydrogen 2.907 N/A ILE 1077.A N VAL 1073.A O no hydrogen 2.884 N/A VAL 1078.A N TYR 1074.A O no hydrogen 2.926 N/A LYS 1079.A N GLU 1075.A O no hydrogen 2.898 N/A LYS 1079.A NZ GLU 1075.A OE2 no hydrogen 3.422 N/A GLY 1080.A N ILE 1077.A O no hydrogen 2.933 N/A GLU 1081.A N ALA 1076.A O no hydrogen 2.982 N/A GLU 1090.A N ASP 1066.A OD1 no hydrogen 3.022 N/A SER 1091.A OG SER 1091.A O no hydrogen 2.527 N/A GLU 1098.A N VAL 1094.A O no hydrogen 2.909 N/A LEU 1099.A N LEU 1095.A O no hydrogen 2.888 N/A GLN 1100.A N LEU 1096.A O no hydrogen 2.871 N/A SER 1101.A N LYS 1097.A O no hydrogen 2.923 N/A SER 1101.A OG LYS 1097.A O no hydrogen 2.881 N/A LEU 1102.A N LEU 1099.A O no hydrogen 2.522 N/A CYS 1103.A N GLN 1100.A O no hydrogen 3.078 N/A SER 1111.A N SER 1110.A OG no hydrogen 2.603 N/A