Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ai5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 8.A N ASN 5.A O no hydrogen 3.234 N/A GLN 14.A N THR 10.A O no hydrogen 3.040 N/A GLN 14.A NE2 ASP 7.A O no hydrogen 3.495 N/A GLN 14.A NE2 HIS 9.A O no hydrogen 2.709 N/A GLN 15.A N PRO 11.A O no hydrogen 3.281 N/A GLN 15.A NE2 VAL 105.A O no hydrogen 2.762 N/A TYR 16.A N MET 12.A O no hydrogen 3.169 N/A LEU 17.A N MET 13.A O no hydrogen 2.807 N/A ARG 18.A N GLN 14.A O no hydrogen 3.307 N/A LEU 19.A N GLN 15.A O no hydrogen 3.201 N/A LYS 20.A N TYR 16.A O no hydrogen 2.681 N/A LYS 20.A NZ PRO 24.A O no hydrogen 2.840 N/A LYS 20.A NZ ILE 26.A O no hydrogen 2.856 N/A ALA 21.A N LEU 17.A O no hydrogen 2.958 N/A GLN 22.A N ARG 18.A O no hydrogen 3.196 N/A GLN 22.A N LEU 19.A O no hydrogen 3.295 N/A PHE 29.A N ALA 90.A O no hydrogen 2.783 N/A TYR 30.A OH MET 12.A O no hydrogen 3.394 N/A MET 32.A N PHE 35.A O no hydrogen 2.785 N/A PHE 35.A N MET 32.A O no hydrogen 3.153 N/A TYR 36.A N ILE 70.A O no hydrogen 3.112 N/A TYR 36.A OH GLU 93.A OE2 no hydrogen 2.682 N/A GLU 37.A N TYR 30.A O no hydrogen 2.765 N/A LEU 38.A N ALA 68.A O no hydrogen 2.548 N/A TYR 40.A N PRO 66.A O no hydrogen 2.529 N/A ALA 43.A N PHE 39.A O no hydrogen 3.140 N/A LYS 44.A N TYR 40.A O no hydrogen 3.234 N/A ARG 45.A N ASP 41.A O no hydrogen 3.178 N/A ALA 46.A N ASP 42.A O no hydrogen 2.904 N/A SER 47.A N ALA 43.A O no hydrogen 3.131 N/A SER 47.A OG ILE 52.A O no hydrogen 3.058 N/A GLN 48.A N LYS 44.A O no hydrogen 3.286 N/A LEU 49.A N ARG 45.A O no hydrogen 3.077 N/A LEU 50.A N ALA 46.A O no hydrogen 2.706 N/A THR 55.A N MET 67.A O no hydrogen 2.958 N/A ARG 57.A N ILE 65.A O no hydrogen 2.799 N/A SER 60.A N GLY 58.A O no hydrogen 3.057 N/A MET 67.A N THR 55.A O no hydrogen 2.731 N/A ALA 68.A N LEU 38.A O no hydrogen 2.853 N/A TYR 72.A N ASP 34.A O no hydrogen 3.116 N/A ALA 74.A N PRO 71.A O no hydrogen 3.297 N/A VAL 75.A N TYR 72.A O no hydrogen 3.410 N/A ASN 77.A N ALA 74.A O no hydrogen 3.272 N/A ASN 77.A ND2 ALA 74.A O no hydrogen 3.118 N/A LEU 79.A N VAL 75.A O no hydrogen 2.840 N/A ALA 80.A N GLU 76.A O no hydrogen 2.967 N/A LYS 81.A N ASN 77.A O no hydrogen 3.152 N/A LEU 82.A N TYR 78.A O no hydrogen 2.985 N/A VAL 83.A N LEU 79.A O no hydrogen 2.783 N/A ASN 84.A N ALA 80.A O no hydrogen 3.025 N/A GLN 85.A N LYS 81.A O no hydrogen 3.406 N/A GLY 86.A N VAL 83.A O no hydrogen 2.940 N/A GLU 87.A N LEU 82.A O no hydrogen 3.062 N/A VAL 89.A N VAL 113.A O no hydrogen 2.914 N/A ALA 90.A N LEU 27.A O no hydrogen 2.865 N/A ILE 91.A N ARG 111.A O no hydrogen 2.755 N/A CYS 92.A N PHE 29.A O no hydrogen 3.198 N/A GLU 93.A N LYS 108.A O no hydrogen 2.975 N/A ILE 95.A N GLU 106.A O no hydrogen 2.930 N/A THR 100.A N ASP 97.A O no hydrogen 3.061 N/A THR 100.A OG1 ASP 97.A O no hydrogen 2.776 N/A SER 101.A N ASP 97.A O no hydrogen 3.303 N/A ARG 107.A NE ARG 31.A O no hydrogen 3.170 N/A ARG 107.A NH1 GLN 15.A OE1 no hydrogen 2.893 N/A LYS 108.A N GLU 93.A O no hydrogen 3.230 N/A VAL 110.A N ILE 91.A O no hydrogen 2.761 N/A ARG 111.A N ILE 91.A O no hydrogen 3.183 N/A ILE 112.A N THR 246.A O no hydrogen 2.743 N/A THR 114.A OG1 THR 117.A OG1 no hydrogen 2.749 N/A THR 114.A OG1 GLU 176.A OE1 no hydrogen 2.915 N/A GLY 116.A N GLU 176.A OE1 no hydrogen 2.856 N/A THR 117.A N THR 114.A OG1 no hydrogen 3.330 N/A THR 117.A OG1 THR 114.A OG1 no hydrogen 2.749 N/A LEU 123.A N ASP 120.A O no hydrogen 3.186 N/A LEU 124.A N GLU 121.A O no hydrogen 2.839 N/A ARG 127.A NH2 THR 297.A O no hydrogen 3.009 N/A GLN 128.A N GLN 125.A O no hydrogen 2.995 N/A ASN 130.A ND2 GLY 116.A O no hydrogen 2.801 N/A ASN 130.A ND2 ILE 118.A O no hydrogen 3.363 N/A LEU 132.A N LEU 147.A O no hydrogen 3.102 N/A ILE 135.A N LEU 178.A O no hydrogen 2.790 N/A TRP 136.A N GLY 143.A O no hydrogen 3.161 N/A ASP 138.A N GLY 141.A O no hydrogen 2.861 N/A GLY 143.A N TRP 136.A O no hydrogen 3.122 N/A TYR 144.A N SER 157.A O no hydrogen 2.919 N/A TYR 144.A OH THR 172.A OG1 no hydrogen 2.846 N/A ALA 145.A N ALA 134.A O no hydrogen 3.348 N/A THR 146.A N ARG 155.A O no hydrogen 3.067 N/A LEU 147.A N LEU 132.A O no hydrogen 2.785 N/A ASP 148.A N ARG 153.A O no hydrogen 2.723 N/A SER 150.A OG ASP 148.A OD1 no hydrogen 2.832 N/A SER 151.A N ASP 148.A O no hydrogen 3.025 N/A SER 151.A OG ASP 148.A O no hydrogen 3.348 N/A GLY 152.A N ASP 148.A O no hydrogen 2.791 N/A ARG 153.A N SER 151.A OG no hydrogen 2.965 N/A ARG 153.A NH2 ASP 148.A OD2 no hydrogen 2.973 N/A ARG 155.A N THR 146.A O no hydrogen 2.795 N/A ARG 155.A NH1 PHE 154.A O no hydrogen 3.563 N/A SER 157.A N TYR 144.A O no hydrogen 2.753 N/A SER 157.A OG TYR 144.A O no hydrogen 3.326 N/A ARG 162.A NH2 SER 187.A OG no hydrogen 2.796 N/A THR 164.A N ASP 161.A O no hydrogen 3.078 N/A THR 164.A OG1 ASP 161.A OD1 no hydrogen 3.549 N/A MET 165.A N ASP 161.A O no hydrogen 3.230 N/A ALA 166.A N ARG 162.A O no hydrogen 3.173 N/A ALA 167.A N GLU 163.A O no hydrogen 3.234 N/A GLU 168.A N THR 164.A O no hydrogen 2.885 N/A LEU 169.A N MET 165.A O no hydrogen 2.743 N/A GLN 170.A N ALA 166.A O no hydrogen 2.928 N/A GLN 170.A NE2 ALA 270.A O no hydrogen 2.921 N/A ARG 171.A N ALA 167.A O no hydrogen 3.003 N/A ARG 171.A NE GLU 168.A OE2 no hydrogen 3.456 N/A ARG 171.A NH2 GLU 168.A OE1 no hydrogen 3.094 N/A ARG 171.A NH2 GLU 168.A OE2 no hydrogen 3.304 N/A THR 172.A N GLU 168.A O no hydrogen 2.882 N/A THR 172.A OG1 TYR 144.A OH no hydrogen 2.846 N/A THR 172.A OG1 GLU 168.A O no hydrogen 2.789 N/A THR 172.A OG1 LEU 169.A O no hydrogen 3.116 N/A ASN 173.A N LEU 169.A O no hydrogen 2.692 N/A LEU 177.A N GLY 194.A O no hydrogen 3.358 N/A LEU 178.A N ALA 133.A O no hydrogen 2.898 N/A TYR 179.A N ARG 196.A O no hydrogen 2.831 N/A PHE 183.A N ALA 180.A O no hydrogen 2.968 N/A ALA 184.A N GLN 137.A OE1 no hydrogen 3.312 N/A GLU 190.A N MET 186.A O no hydrogen 3.259 N/A ARG 192.A N ILE 189.A O no hydrogen 3.347 N/A ARG 196.A N LEU 177.A O no hydrogen 3.011 N/A ARG 196.A NE GLU 176.A OE2 no hydrogen 3.039 N/A ARG 196.A NH1 LEU 195.A O no hydrogen 2.681 N/A ARG 196.A NH2 GLY 86.A O no hydrogen 2.960 N/A ARG 197.A NH1 TYR 179.A OH no hydrogen 3.521 N/A ARG 198.A NE GLU 202.A OE1 no hydrogen 3.158 N/A ARG 198.A NH2 GLU 202.A OE2 no hydrogen 2.892 N/A PHE 203.A N LEU 200.A O no hydrogen 2.976 N/A ASP 206.A N GLU 204.A OE2 no hydrogen 3.032 N/A ARG 209.A N ILE 205.A O no hydrogen 2.902 N/A ARG 209.A NH2 GLU 227.A O no hydrogen 3.155 N/A GLN 210.A N ASP 206.A O no hydrogen 3.203 N/A GLN 211.A N THR 207.A O no hydrogen 2.824 N/A GLN 211.A NE2 GLN 210.A OE1 no hydrogen 3.513 N/A LEU 212.A N ALA 208.A O no hydrogen 2.936 N/A ASN 213.A N ARG 209.A O no hydrogen 3.339 N/A LEU 214.A N GLN 210.A O no hydrogen 2.899 N/A GLN 215.A N GLN 211.A O no hydrogen 2.975 N/A PHE 216.A N LEU 212.A O no hydrogen 3.058 N/A GLY 217.A N ASN 213.A O no hydrogen 2.799 N/A THR 218.A OG1 ASP 220.A O no hydrogen 3.540 N/A GLY 223.A N ASP 220.A O no hydrogen 3.326 N/A PHE 224.A N LEU 221.A O no hydrogen 2.888 N/A GLY 225.A N VAL 222.A O no hydrogen 3.205 N/A ALA 229.A N VAL 226.A O no hydrogen 3.073 N/A GLY 232.A N GLU 158.A OE2 no hydrogen 3.185 N/A CYS 234.A N PRO 230.A O no hydrogen 3.154 N/A CYS 234.A SG PRO 230.A O no hydrogen 2.842 N/A CYS 234.A SG ARG 231.A O no hydrogen 3.538 N/A ALA 236.A N GLY 232.A O no hydrogen 3.116 N/A GLY 237.A N LEU 233.A O no hydrogen 2.893 N/A CYS 238.A N CYS 234.A O no hydrogen 3.239 N/A CYS 238.A SG GLU 202.A OE1 no hydrogen 3.150 N/A LEU 239.A N ALA 235.A O no hydrogen 2.835 N/A LEU 240.A N ALA 236.A O no hydrogen 2.564 N/A GLN 241.A N GLY 237.A O no hydrogen 2.724 N/A TYR 242.A N CYS 238.A O no hydrogen 2.491 N/A TYR 242.A OH GLU 176.A OE2 no hydrogen 3.372 N/A ALA 243.A N LEU 239.A O no hydrogen 2.563 N/A LYS 244.A N LEU 240.A O no hydrogen 2.764 N/A LYS 244.A NZ GLN 211.A OE1 no hydrogen 2.862 N/A ASP 245.A N GLN 241.A O no hydrogen 2.577 N/A THR 246.A N TYR 242.A O no hydrogen 2.621 N/A THR 246.A OG1 TYR 242.A O no hydrogen 2.702 N/A THR 246.A OG1 ALA 243.A O no hydrogen 2.612 N/A GLN 247.A N ALA 243.A O no hydrogen 2.879 N/A GLN 247.A N LYS 244.A O no hydrogen 3.270 N/A ARG 248.A N LYS 244.A O no hydrogen 2.506 N/A ARG 248.A NH2 HIS 23.A NE2 no hydrogen 3.221 N/A THR 249.A OG1 GLN 247.A O no hydrogen 2.927 N/A ILE 254.A N LEU 251.A O no hydrogen 3.167 N/A ARG 255.A NE GLN 542.A OE1 no hydrogen 3.403 N/A ARG 255.A NH2 GLN 542.A OE1 no hydrogen 3.482 N/A GLU 260.A N LEU 156.A O no hydrogen 3.091 N/A ASP 264.A N ARG 261.A O no hydrogen 3.155 N/A SER 265.A N GLU 262.A O no hydrogen 3.452 N/A SER 265.A OG ARG 261.A O no hydrogen 3.138 N/A ILE 266.A N PRO 313.A O no hydrogen 3.030 N/A ILE 267.A N ASP 650.A O no hydrogen 2.689 N/A THR 272.A OG1 ASP 269.A OD1 no hydrogen 2.850 N/A THR 272.A OG1 ASP 269.A OD2 no hydrogen 3.363 N/A THR 272.A OG1 ILE 652.A O no hydrogen 2.715 N/A ARG 273.A N ASP 269.A O no hydrogen 3.345 N/A ARG 273.A N ALA 270.A O no hydrogen 3.075 N/A ARG 273.A NH1 MET 268.A O no hydrogen 2.957 N/A ARG 273.A NH2 MET 268.A O no hydrogen 3.494 N/A ARG 274.A N ALA 271.A O no hydrogen 3.022 N/A ASN 275.A N THR 272.A O no hydrogen 3.243 N/A ASN 275.A ND2 THR 654.A O no hydrogen 2.935 N/A LEU 276.A N THR 272.A O no hydrogen 3.096 N/A ASN 281.A N GLY 285.A O no hydrogen 3.108 N/A GLY 284.A N ASN 281.A O no hydrogen 2.992 N/A THR 289.A OG1 SER 292.A OG no hydrogen 3.093 N/A LEU 290.A N GLU 277.A O no hydrogen 3.114 N/A ALA 291.A N ILE 278.A O no hydrogen 3.012 N/A SER 292.A N THR 289.A OG1 no hydrogen 2.799 N/A SER 292.A OG THR 289.A O no hydrogen 2.971 N/A SER 292.A OG THR 289.A OG1 no hydrogen 3.093 N/A LEU 294.A N LEU 290.A O no hydrogen 3.125 N/A LEU 294.A N ALA 291.A O no hydrogen 3.002 N/A THR 297.A N ASP 295.A OD1 no hydrogen 3.037 N/A THR 297.A OG1 ASP 295.A OD1 no hydrogen 2.872 N/A THR 299.A N ASP 552.A OD2 no hydrogen 3.166 N/A THR 299.A OG1 ASP 552.A OD2 no hydrogen 2.655 N/A GLY 302.A N THR 299.A O no hydrogen 3.147 N/A SER 303.A N THR 299.A O no hydrogen 3.424 N/A SER 303.A OG ASP 295.A OD2 no hydrogen 3.259 N/A ARG 304.A N PRO 300.A O no hydrogen 2.977 N/A ARG 304.A NE GLU 126.A O no hydrogen 3.070 N/A MET 305.A N MET 301.A O no hydrogen 3.018 N/A LEU 306.A N GLY 302.A O no hydrogen 2.875 N/A LYS 307.A N SER 303.A O no hydrogen 2.821 N/A LYS 307.A NZ ARG 127.A O no hydrogen 3.079 N/A ARG 308.A N ARG 304.A O no hydrogen 2.679 N/A ARG 308.A NH1 ASP 129.A OD2 no hydrogen 2.862 N/A TRP 309.A N MET 305.A O no hydrogen 2.803 N/A LEU 310.A N LEU 306.A O no hydrogen 2.808 N/A HIS 311.A N LYS 307.A O no hydrogen 3.014 N/A MET 312.A N ARG 308.A O no hydrogen 2.574 N/A LEU 321.A N THR 317.A O no hydrogen 2.893 N/A GLU 322.A N ARG 318.A O no hydrogen 2.958 N/A ARG 323.A N VAL 319.A O no hydrogen 3.256 N/A GLN 324.A N LEU 320.A O no hydrogen 2.965 N/A GLN 324.A NE2 PRO 569.A O no hydrogen 3.277 N/A GLN 325.A N LEU 321.A O no hydrogen 3.392 N/A THR 326.A N GLU 322.A O no hydrogen 3.423 N/A THR 326.A OG1 GLU 322.A O no hydrogen 2.823 N/A ILE 327.A N ARG 323.A O no hydrogen 2.980 N/A GLY 328.A N GLN 324.A O no hydrogen 2.880 N/A ALA 329.A N GLN 325.A O no hydrogen 3.032 N/A LEU 330.A N THR 326.A O no hydrogen 2.884 N/A PHE 333.A N LEU 330.A O no hydrogen 2.945 N/A THR 334.A OG1 GLN 331.A O no hydrogen 2.725 N/A GLY 336.A N PHE 333.A O no hydrogen 2.606 N/A LEU 337.A N PHE 333.A O no hydrogen 2.952 N/A LEU 337.A N THR 334.A O no hydrogen 3.145 N/A GLN 338.A N THR 334.A O no hydrogen 2.967 N/A LEU 341.A N LEU 337.A O no hydrogen 3.225 N/A ARG 342.A N PRO 339.A O no hydrogen 3.304 N/A GLN 343.A N VAL 340.A O no hydrogen 3.335 N/A LEU 347.A N GLY 345.A O no hydrogen 2.852 N/A ARG 349.A N ASP 346.A OD1 no hydrogen 3.458 N/A ARG 349.A NH2 GLN 128.A O no hydrogen 2.767 N/A ILE 350.A N ASP 346.A O no hydrogen 3.171 N/A LEU 351.A N LEU 347.A O no hydrogen 2.867 N/A ALA 352.A N GLU 348.A O no hydrogen 3.314 N/A ARG 353.A N ARG 349.A O no hydrogen 3.074 N/A ARG 353.A NE SER 119.A O no hydrogen 3.359 N/A ARG 353.A NH1 ASP 363.A OD2 no hydrogen 3.254 N/A LEU 354.A N ILE 350.A O no hydrogen 2.876 N/A ALA 355.A N LEU 351.A O no hydrogen 2.860 N/A LEU 356.A N ALA 352.A O no hydrogen 2.874 N/A ARG 357.A N LEU 354.A O no hydrogen 3.051 N/A ARG 357.A NH1 ASP 532.A OD1 no hydrogen 3.218 N/A ARG 357.A NH2 ASP 532.A OD1 no hydrogen 3.044 N/A THR 358.A N ARG 353.A O no hydrogen 2.739 N/A THR 358.A OG1 ARG 353.A O no hydrogen 3.231 N/A ARG 362.A NE PRO 414.A O no hydrogen 2.645 N/A ASP 363.A N ARG 360.A O no hydrogen 2.682 N/A ALA 365.A N PRO 361.A O no hydrogen 2.979 N/A ARG 366.A NE ARG 362.A O no hydrogen 3.090 N/A MET 367.A N ASP 363.A O no hydrogen 3.084 N/A ARG 368.A N LEU 364.A O no hydrogen 3.052 N/A ARG 368.A NH1 ASP 412.A O no hydrogen 3.040 N/A ARG 368.A NH2 ILE 411.A O no hydrogen 3.350 N/A ARG 368.A NH2 ASP 412.A O no hydrogen 3.206 N/A HIS 369.A N ALA 365.A O no hydrogen 2.961 N/A ALA 370.A N ARG 366.A O no hydrogen 2.996 N/A PHE 371.A N MET 367.A O no hydrogen 2.991 N/A GLN 372.A N ARG 368.A O no hydrogen 2.938 N/A GLN 372.A NE2 GLU 407.A OE2 no hydrogen 3.125 N/A GLN 373.A N HIS 369.A O no hydrogen 3.088 N/A LEU 377.A N GLN 373.A O no hydrogen 3.187 N/A ARG 378.A N LEU 374.A O no hydrogen 2.802 N/A ALA 379.A N PRO 375.A O no hydrogen 2.875 N/A GLN 380.A N GLU 376.A O no hydrogen 2.946 N/A GLN 380.A NE2 GLY 336.A O no hydrogen 3.383 N/A GLN 380.A NE2 GLU 376.A OE2 no hydrogen 2.623 N/A LEU 381.A N LEU 377.A O no hydrogen 2.765 N/A GLU 382.A N ARG 378.A O no hydrogen 2.979 N/A GLU 382.A N ALA 379.A O no hydrogen 3.333 N/A THR 383.A OG1 GLN 380.A O no hydrogen 2.862 N/A GLN 390.A NE2 LEU 381.A O no hydrogen 2.862 N/A GLN 390.A NE2 GLU 382.A O no hydrogen 3.424 N/A GLN 390.A NE2 VAL 384.A O no hydrogen 2.613 N/A ALA 391.A N ALA 387.A O no hydrogen 3.258 N/A LEU 392.A N PRO 388.A O no hydrogen 2.785 N/A ARG 393.A N VAL 389.A O no hydrogen 2.918 N/A ARG 393.A NE GLN 390.A OE1 no hydrogen 3.366 N/A ARG 393.A NH1 ARG 378.A O no hydrogen 3.282 N/A GLU 394.A N GLN 390.A O no hydrogen 3.006 N/A LYS 395.A N ALA 391.A O no hydrogen 3.092 N/A MET 396.A N LEU 392.A O no hydrogen 3.319 N/A GLY 397.A N GLU 394.A O no hydrogen 3.217 N/A ARG 403.A N PHE 399.A O no hydrogen 3.041 N/A ARG 403.A NE GLU 407.A OE2 no hydrogen 3.477 N/A ASP 404.A N ALA 400.A O no hydrogen 2.988 N/A LEU 405.A N GLU 401.A O no hydrogen 2.942 N/A LEU 406.A N LEU 402.A O no hydrogen 2.759 N/A GLU 407.A N ARG 403.A O no hydrogen 2.746 N/A ARG 408.A N ASP 404.A O no hydrogen 2.842 N/A ALA 409.A N LEU 406.A O no hydrogen 2.958 N/A ILE 411.A N VAL 423.A O no hydrogen 2.650 N/A GLY 421.A N VAL 418.A O no hydrogen 3.087 N/A VAL 423.A N GLU 523.A OE2 no hydrogen 3.059 N/A GLU 431.A N ASN 429.A OD1 no hydrogen 3.025 N/A ASP 433.A N ASN 429.A O no hydrogen 3.400 N/A GLU 434.A N GLU 430.A O no hydrogen 3.069 N/A TRP 435.A N GLU 431.A O no hydrogen 3.009 N/A ARG 436.A N LEU 432.A O no hydrogen 2.852 N/A ARG 436.A NH1 ILE 424.A O no hydrogen 2.934 N/A ARG 436.A NH2 ILE 424.A O no hydrogen 2.897 N/A ARG 436.A NH2 GLU 523.A OE2 no hydrogen 2.913 N/A ALA 437.A N ASP 433.A O no hydrogen 2.885 N/A ASP 440.A N ARG 436.A O no hydrogen 2.926 N/A GLY 441.A N ALA 437.A O no hydrogen 3.020 N/A ALA 442.A N ALA 439.A O no hydrogen 3.234 N/A TYR 445.A N ASP 444.A OD1 no hydrogen 2.728 N/A TYR 445.A OH GLU 504.A OE1 no hydrogen 2.758 N/A ARG 448.A N ASP 444.A O no hydrogen 2.697 N/A LEU 449.A N TYR 445.A O no hydrogen 2.766 N/A GLU 450.A N LEU 446.A O no hydrogen 2.885 N/A VAL 451.A N GLU 447.A O no hydrogen 2.977 N/A ARG 452.A N ARG 448.A O no hydrogen 2.941 N/A GLU 453.A N LEU 449.A O no hydrogen 2.728 N/A GLU 455.A N VAL 451.A O no hydrogen 2.819 N/A ARG 456.A N ARG 452.A O no hydrogen 2.974 N/A ARG 456.A NE GLU 453.A OE2 no hydrogen 3.183 N/A THR 457.A N GLU 453.A O no hydrogen 3.054 N/A THR 457.A OG1 GLU 453.A O no hydrogen 2.607 N/A THR 461.A OG1 SER 477.A OG no hydrogen 3.004 N/A THR 461.A OG1 GLN 480.A OE1 no hydrogen 2.729 N/A LYS 463.A N GLN 475.A O no hydrogen 3.085 N/A ASN 467.A N GLY 471.A O no hydrogen 2.792 N/A ASN 467.A ND2 GLN 492.A OE1 no hydrogen 3.612 N/A TYR 472.A N GLU 509.A OE1 no hydrogen 2.782 N/A TYR 473.A N GLY 465.A O no hydrogen 3.036 N/A ILE 474.A N TYR 500.A O no hydrogen 2.725 N/A GLN 475.A N LYS 463.A O no hydrogen 2.608 N/A ILE 476.A N GLU 498.A O no hydrogen 2.959 N/A SER 477.A OG THR 461.A OG1 no hydrogen 3.004 N/A ARG 478.A N ASN 496.A O no hydrogen 3.021 N/A GLN 480.A N SER 477.A O no hydrogen 2.899 N/A GLN 480.A NE2 ASP 460.A OD1 no hydrogen 3.090 N/A SER 481.A OG ARG 478.A O no hydrogen 3.391 N/A LEU 483.A N GLN 480.A O no hydrogen 3.225 N/A TYR 488.A N PRO 485.A O no hydrogen 3.350 N/A MET 489.A N ILE 501.A O no hydrogen 2.704 N/A ARG 490.A NH2 THR 493.A OG1 no hydrogen 2.974 N/A ARG 491.A N ARG 499.A O no hydrogen 2.593 N/A ARG 491.A NH1 GLU 509.A OE1 no hydrogen 3.197 N/A GLN 492.A N ARG 499.A O no hydrogen 3.310 N/A THR 493.A OG1 GLU 498.A OE2 no hydrogen 3.204 N/A LEU 494.A N ALA 497.A O no hydrogen 3.152 N/A GLU 498.A N ILE 476.A O no hydrogen 2.885 N/A ARG 499.A N GLN 492.A O no hydrogen 2.835 N/A ARG 499.A NH2 GLN 475.A OE1 no hydrogen 3.390 N/A TYR 500.A N ILE 474.A O no hydrogen 2.859 N/A ILE 501.A N MET 489.A O no hydrogen 2.535 N/A LYS 506.A N ILE 502.A O no hydrogen 2.939 N/A GLU 507.A N PRO 503.A O no hydrogen 2.774 N/A TYR 508.A N GLU 504.A O no hydrogen 2.970 N/A GLU 509.A N LEU 505.A O no hydrogen 2.678 N/A ASP 510.A N LYS 506.A O no hydrogen 2.743 N/A LYS 511.A N GLU 507.A O no hydrogen 3.034 N/A VAL 512.A N TYR 508.A O no hydrogen 2.885 N/A LEU 513.A N GLU 509.A O no hydrogen 3.402 N/A THR 514.A N ASP 510.A O no hydrogen 3.096 N/A THR 514.A OG1 ASP 510.A O no hydrogen 2.950 N/A THR 514.A OG1 LYS 511.A O no hydrogen 2.759 N/A SER 515.A N LYS 511.A O no hydrogen 3.001 N/A SER 515.A OG LYS 511.A O no hydrogen 2.714 N/A SER 515.A OG VAL 512.A O no hydrogen 2.708 N/A LYS 516.A N VAL 512.A O no hydrogen 2.795 N/A GLY 517.A N LEU 513.A O no hydrogen 2.985 N/A LYS 518.A N THR 514.A O no hydrogen 2.742 N/A ALA 519.A N SER 515.A O no hydrogen 2.793 N/A LEU 520.A N LYS 516.A O no hydrogen 2.778 N/A ALA 521.A N GLY 517.A O no hydrogen 3.047 N/A LEU 522.A N LYS 518.A O no hydrogen 3.105 N/A GLU 523.A N ALA 519.A O no hydrogen 2.916 N/A LYS 524.A N LEU 520.A O no hydrogen 2.864 N/A GLN 525.A N ALA 521.A O no hydrogen 2.916 N/A LEU 526.A N LEU 522.A O no hydrogen 2.846 N/A TYR 527.A N GLU 523.A O no hydrogen 2.834 N/A TYR 527.A OH ALA 359.A O no hydrogen 2.713 N/A GLU 528.A N LYS 524.A O no hydrogen 2.957 N/A LEU 530.A N LEU 526.A O no hydrogen 2.860 N/A ASP 532.A N GLU 528.A O no hydrogen 3.208 N/A LEU 533.A N GLU 529.A O no hydrogen 2.738 N/A LEU 534.A N LEU 530.A O no hydrogen 3.124 N/A LEU 534.A N PHE 531.A O no hydrogen 3.193 N/A HIS 537.A N LEU 534.A O no hydrogen 3.270 N/A LEU 538.A N LEU 535.A O no hydrogen 3.119 N/A LEU 541.A N HIS 537.A O no hydrogen 2.873 N/A GLN 542.A N LEU 538.A O no hydrogen 2.812 N/A GLN 542.A NE2 HIS 253.A O no hydrogen 3.392 N/A GLN 543.A N GLU 539.A O no hydrogen 3.047 N/A SER 544.A N ALA 540.A O no hydrogen 2.791 N/A SER 544.A OG MET 396.A O no hydrogen 3.252 N/A ALA 545.A N LEU 541.A O no hydrogen 2.982 N/A SER 546.A N GLN 542.A O no hydrogen 3.316 N/A ALA 547.A N SER 544.A O no hydrogen 3.096 N/A LEU 548.A N SER 544.A O no hydrogen 2.940 N/A ALA 549.A N ALA 545.A O no hydrogen 3.444 N/A LEU 551.A N LEU 548.A O no hydrogen 2.959 N/A ASP 552.A N LEU 548.A O no hydrogen 2.894 N/A VAL 553.A N ALA 549.A O no hydrogen 3.162 N/A VAL 555.A N LEU 551.A O no hydrogen 2.895 N/A VAL 555.A N ASP 552.A O no hydrogen 3.295 N/A ASN 556.A N ASP 552.A O no hydrogen 2.984 N/A ASN 556.A ND2 GLU 559.A OE1 no hydrogen 3.357 N/A LEU 557.A N VAL 553.A O no hydrogen 2.910 N/A ALA 558.A N VAL 555.A O no hydrogen 3.085 N/A GLU 559.A N VAL 555.A O no hydrogen 2.865 N/A ARG 560.A N ASN 556.A O no hydrogen 2.777 N/A ARG 560.A NE GLU 559.A OE2 no hydrogen 3.313 N/A ARG 560.A NH1 VAL 293.A O no hydrogen 2.922 N/A TYR 562.A N ALA 558.A O no hydrogen 2.841 N/A THR 563.A N GLU 559.A O no hydrogen 2.771 N/A THR 563.A OG1 GLU 559.A O no hydrogen 2.956 N/A THR 563.A OG1 GLU 559.A OE2 no hydrogen 3.315 N/A LEU 564.A N ARG 560.A O no hydrogen 2.758 N/A TYR 566.A N ALA 561.A O no hydrogen 2.750 N/A THR 567.A N VAL 639.A O no hydrogen 3.043 N/A THR 567.A OG1 ALA 641.A O no hydrogen 2.591 N/A THR 567.A OG1 GLN 642.A O no hydrogen 2.533 N/A ILE 572.A N ILE 646.A O no hydrogen 2.822 N/A ARG 578.A N GLU 645.A O no hydrogen 2.970 N/A ARG 578.A NE GLU 645.A OE1 no hydrogen 2.830 N/A ILE 579.A N LEU 600.A O no hydrogen 2.730 N/A THR 580.A N LYS 643.A O no hydrogen 3.252 N/A GLY 582.A N ASN 598.A O no hydrogen 3.022 N/A VAL 587.A N HIS 584.A ND1 no hydrogen 3.218 N/A GLN 589.A N VAL 586.A O no hydrogen 3.173 N/A VAL 590.A N VAL 587.A O no hydrogen 3.053 N/A GLU 593.A N GLU 593.A OE1 no hydrogen 2.809 N/A ASN 598.A N GLY 582.A O no hydrogen 2.796 N/A ASN 598.A ND2 HIS 748.A O no hydrogen 2.888 N/A LEU 600.A N ILE 579.A O no hydrogen 3.080 N/A LEU 602.A N ILE 577.A O no hydrogen 2.702 N/A GLN 605.A N SER 603.A OG no hydrogen 2.994 N/A GLN 605.A NE2 GLU 728.A OE2 no hydrogen 3.217 N/A ARG 606.A N SER 603.A OG no hydrogen 2.717 N/A ARG 606.A NH1 ASN 601.A O no hydrogen 2.919 N/A ARG 607.A NH1 PRO 604.A O no hydrogen 3.077 N/A ARG 607.A NH1 GLU 728.A OE1 no hydrogen 3.278 N/A ARG 607.A NH2 ALA 704.A O no hydrogen 3.203 N/A ARG 607.A NH2 GLU 728.A OE1 no hydrogen 3.083 N/A MET 608.A N GLY 729.A O no hydrogen 3.127 N/A LEU 609.A N THR 711.A O no hydrogen 2.942 N/A ILE 610.A N ALA 731.A O no hydrogen 3.194 N/A ILE 611.A N PHE 713.A O no hydrogen 2.697 N/A THR 612.A N VAL 733.A O no hydrogen 3.291 N/A GLY 617.A N PRO 614.A O no hydrogen 3.128 N/A LYS 619.A NZ GLY 613.A O no hydrogen 3.549 N/A LYS 619.A NZ PRO 614.A O no hydrogen 3.075 N/A SER 620.A OG ASP 681.A OD2 no hydrogen 3.063 N/A THR 621.A OG1 GLY 618.A O no hydrogen 2.908 N/A MET 623.A N SER 620.A O no hydrogen 2.960 N/A ARG 624.A N SER 620.A O no hydrogen 3.452 N/A GLN 625.A N THR 621.A O no hydrogen 3.332 N/A GLN 625.A NE2 ASN 598.A O no hydrogen 3.379 N/A THR 626.A N MET 623.A O no hydrogen 2.807 N/A ALA 627.A N MET 623.A O no hydrogen 3.220 N/A LEU 628.A N ARG 624.A O no hydrogen 2.985 N/A ILE 629.A N GLN 625.A O no hydrogen 2.986 N/A ALA 630.A N THR 626.A O no hydrogen 2.736 N/A LEU 631.A N ALA 627.A O no hydrogen 2.783 N/A MET 632.A N LEU 628.A O no hydrogen 2.854 N/A ALA 633.A N ILE 629.A O no hydrogen 2.779 N/A TYR 634.A N LEU 631.A O no hydrogen 2.979 N/A ILE 635.A N MET 632.A O no hydrogen 3.151 N/A GLY 636.A N MET 632.A O no hydrogen 3.256 N/A GLY 636.A N ALA 633.A O no hydrogen 3.340 N/A SER 637.A N MET 632.A O no hydrogen 3.388 N/A SER 637.A OG TYR 638.A O no hydrogen 3.390 N/A TYR 638.A OH GLN 324.A O no hydrogen 3.014 N/A VAL 639.A N THR 567.A O no hydrogen 3.168 N/A ALA 641.A N VAL 639.A O no hydrogen 2.649 N/A GLN 642.A N THR 580.A O no hydrogen 3.259 N/A LYS 643.A NZ LYS 643.A O no hydrogen 3.417 N/A LYS 643.A NZ GLU 645.A OE2 no hydrogen 3.099 N/A GLU 645.A N ARG 578.A O no hydrogen 2.971 N/A ILE 646.A N THR 570.A O no hydrogen 3.125 N/A ASP 650.A N TYR 675.A O no hydrogen 2.754 N/A ARG 651.A NE ILE 267.A O no hydrogen 3.048 N/A PHE 653.A N LEU 677.A O no hydrogen 2.817 N/A GLY 657.A N ASP 681.A OD1 no hydrogen 3.352 N/A THR 663.A OG1 MET 659.A O no hydrogen 2.911 N/A THR 665.A N GLU 661.A O no hydrogen 3.315 N/A THR 665.A OG1 GLU 661.A O no hydrogen 2.959 N/A ALA 666.A N MET 662.A O no hydrogen 2.683 N/A ASN 667.A N THR 663.A O no hydrogen 3.032 N/A ILE 668.A N GLU 664.A O no hydrogen 3.090 N/A LEU 669.A N THR 665.A O no hydrogen 3.039 N/A ASN 671.A N ASN 667.A O no hydrogen 3.212 N/A ASN 671.A N ILE 668.A O no hydrogen 2.994 N/A ALA 672.A N ILE 668.A O no hydrogen 2.752 N/A THR 673.A N SER 676.A OG no hydrogen 2.852 N/A THR 673.A OG1 ASP 650.A OD2 no hydrogen 3.153 N/A THR 673.A OG1 SER 676.A OG no hydrogen 3.297 N/A SER 676.A OG ASP 650.A OD1 no hydrogen 2.982 N/A SER 676.A OG THR 673.A O no hydrogen 3.561 N/A SER 676.A OG THR 673.A OG1 no hydrogen 3.297 N/A LEU 677.A N ARG 651.A O no hydrogen 2.820 N/A VAL 678.A N LEU 710.A O no hydrogen 2.741 N/A THR 689.A N THR 687.A O no hydrogen 2.668 N/A THR 689.A OG1 SER 688.A O no hydrogen 2.633 N/A LEU 695.A N GLY 692.A O no hydrogen 3.103 N/A ALA 696.A N GLY 692.A O no hydrogen 3.141 N/A TRP 697.A N LEU 693.A O no hydrogen 3.148 N/A CYS 699.A N LEU 695.A O no hydrogen 2.973 N/A CYS 699.A SG LEU 695.A O no hydrogen 3.474 N/A ALA 700.A N ALA 696.A O no hydrogen 2.958 N/A ASN 702.A N ALA 698.A O no hydrogen 3.012 N/A LEU 703.A N CYS 699.A O no hydrogen 3.021 N/A ALA 704.A N GLU 701.A O no hydrogen 3.269 N/A LYS 706.A N ASN 702.A O no hydrogen 3.419 N/A ILE 707.A N ASN 702.A O no hydrogen 3.341 N/A LYS 708.A NZ ALA 704.A O no hydrogen 2.966 N/A LEU 710.A N SER 676.A O no hydrogen 2.949 N/A THR 711.A N ARG 607.A O no hydrogen 2.804 N/A ALA 714.A N MET 680.A O no hydrogen 3.145 N/A THR 715.A N ILE 611.A O no hydrogen 2.961 N/A TYR 717.A OH GLY 684.A O no hydrogen 2.793 N/A THR 721.A OG1 PHE 718.A O no hydrogen 2.641 N/A LYS 726.A N LEU 723.A O no hydrogen 2.794 N/A MET 727.A N LEU 723.A O no hydrogen 2.517 N/A ASN 732.A ND2 THR 721.A O no hydrogen 2.638 N/A VAL 733.A N ILE 610.A O no hydrogen 2.890 N/A HIS 734.A N GLN 751.A O no hydrogen 3.042 N/A LEU 735.A N THR 612.A O no hydrogen 3.415 N/A ALA 745.A N LEU 738.A O no hydrogen 2.976 N/A VAL 750.A N ASN 598.A OD1 no hydrogen 3.182 N/A GLN 751.A N HIS 734.A O no hydrogen 3.285 N/A SER 756.A OG GLU 785.A OE1 no hydrogen 2.780 N/A ALA 762.A N TYR 759.A O no hydrogen 3.131 N/A VAL 763.A N TYR 759.A O no hydrogen 2.734 N/A ALA 764.A N GLY 760.A O no hydrogen 2.701 N/A LEU 766.A N ALA 762.A O no hydrogen 3.326 N/A VAL 769.A N ALA 764.A O no hydrogen 3.395 N/A LYS 771.A NZ VAL 769.A O no hydrogen 3.130 N/A ILE 774.A N PRO 770.A O no hydrogen 3.177 N/A LYS 775.A N LYS 771.A O no hydrogen 2.945 N/A LYS 775.A NZ GLU 772.A OE2 no hydrogen 3.288 N/A LYS 775.A NZ GLN 779.A OE1 no hydrogen 2.958 N/A ARG 776.A N GLU 772.A O no hydrogen 2.752 N/A ARG 776.A NH1 GLU 772.A OE2 no hydrogen 3.066 N/A ARG 776.A NH1 GLN 779.A OE1 no hydrogen 2.767 N/A ARG 776.A NH2 GLU 772.A OE2 no hydrogen 3.009 N/A ALA 777.A N VAL 773.A O no hydrogen 3.097 N/A ARG 778.A N ILE 774.A O no hydrogen 3.140 N/A GLN 779.A N LYS 775.A O no hydrogen 2.945 N/A LYS 780.A N ARG 776.A O no hydrogen 3.098 N/A LEU 781.A N ALA 777.A O no hydrogen 2.615 N/A ARG 782.A N ARG 778.A O no hydrogen 3.059 N/A GLU 783.A N GLN 779.A O no hydrogen 3.162 N/A LEU 784.A N LYS 780.A O no hydrogen 3.011 N/A GLU 785.A N LEU 781.A O no hydrogen 3.452 N/A SER 786.A N ARG 782.A O no hydrogen 3.048 N/A SER 786.A OG ARG 782.A O no hydrogen 2.685 N/A SER 786.A OG GLU 783.A O no hydrogen 2.849 N/A ILE 787.A N GLU 783.A O no hydrogen 3.186 N/A SER 788.A N LEU 784.A O no hydrogen 3.469 N/A