Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3au6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A ND2 THR 42.A O no hydrogen 3.552 N/A LEU 6.A N ARG 2.A O no hydrogen 3.026 N/A ALA 7.A N ASN 3.A O no hydrogen 3.150 N/A ARG 8.A N GLN 4.A O no hydrogen 2.596 N/A ARG 8.A NH1 GLU 97.A OE1 no hydrogen 2.747 N/A ARG 8.A NH2 GLU 97.A OE1 no hydrogen 2.841 N/A ILE 9.A N GLU 5.A O no hydrogen 3.371 N/A PHE 10.A N LEU 6.A O no hydrogen 2.984 N/A GLU 11.A N ALA 7.A O no hydrogen 3.123 N/A GLU 12.A N ARG 8.A O no hydrogen 3.052 N/A ILE 13.A N ILE 9.A O no hydrogen 3.273 N/A GLY 14.A N PHE 10.A O no hydrogen 3.041 N/A LEU 15.A N GLU 11.A O no hydrogen 2.907 N/A MET 16.A N GLU 12.A O no hydrogen 3.019 N/A SER 17.A N ILE 13.A O no hydrogen 2.785 N/A SER 17.A OG ILE 13.A O no hydrogen 2.367 N/A GLU 18.A N GLY 14.A O no hydrogen 2.720 N/A PHE 19.A N LEU 15.A O no hydrogen 3.042 N/A LEU 20.A N MET 16.A O no hydrogen 2.794 N/A GLY 21.A N SER 17.A O no hydrogen 3.029 N/A GLY 21.A N GLU 18.A O no hydrogen 3.145 N/A ASP 22.A N SER 17.A O no hydrogen 3.299 N/A PHE 25.A N ASN 23.A OD1 no hydrogen 2.502 N/A ARG 26.A N ASN 23.A OD1 no hydrogen 3.403 N/A VAL 27.A N ASN 23.A O no hydrogen 3.249 N/A ARG 28.A N PRO 24.A O no hydrogen 3.135 N/A ALA 29.A N PHE 25.A O no hydrogen 2.981 N/A TYR 30.A N ARG 26.A O no hydrogen 3.141 N/A TYR 30.A N VAL 27.A O no hydrogen 3.108 N/A HIS 31.A N VAL 27.A O no hydrogen 3.478 N/A GLN 32.A N ARG 28.A O no hydrogen 2.959 N/A ALA 33.A N ALA 29.A O no hydrogen 3.064 N/A ALA 34.A N TYR 30.A O no hydrogen 2.924 N/A ARG 35.A N HIS 31.A O no hydrogen 3.164 N/A ARG 35.A NH2 TYR 495.A OH no hydrogen 3.252 N/A THR 36.A N GLN 32.A O no hydrogen 3.414 N/A THR 36.A OG1 GLN 32.A O no hydrogen 3.067 N/A THR 36.A OG1 PRO 59.A O no hydrogen 3.461 N/A LEU 37.A N ALA 33.A O no hydrogen 3.237 N/A TYR 38.A N ALA 34.A O no hydrogen 2.761 N/A ALA 48.A N ILE 44.A O no hydrogen 3.180 N/A GLU 49.A N GLU 45.A O no hydrogen 3.461 N/A MET 56.A N LYS 52.A O no hydrogen 3.003 N/A GLU 57.A N ALA 54.A O no hydrogen 3.308 N/A VAL 61.A N LEU 58.A O no hydrogen 3.196 N/A ALA 66.A N GLY 62.A O no hydrogen 2.397 N/A GLU 67.A N PRO 63.A O no hydrogen 2.946 N/A LYS 68.A N LEU 65.A O no hydrogen 2.418 N/A LYS 68.A NZ GLU 71.A OE1 no hydrogen 3.367 N/A ILE 69.A N LEU 65.A O no hydrogen 3.152 N/A LEU 70.A N ALA 66.A O no hydrogen 3.030 N/A GLU 71.A N GLU 67.A O no hydrogen 3.395 N/A PHE 72.A N LYS 68.A O no hydrogen 2.720 N/A LEU 73.A N ILE 69.A O no hydrogen 2.955 N/A THR 75.A N LEU 70.A O no hydrogen 3.350 N/A GLY 76.A N PHE 72.A O no hydrogen 2.373 N/A HIS 81.A NE2 GLU 12.A OE1 no hydrogen 2.530 N/A GLU 82.A N VAL 78.A O no hydrogen 3.073 N/A GLU 83.A N ARG 79.A O no hydrogen 2.960 N/A LEU 84.A N LYS 80.A O no hydrogen 2.682 N/A SER 85.A N HIS 81.A O no hydrogen 2.908 N/A SER 85.A OG HIS 81.A O no hydrogen 3.205 N/A ARG 86.A N GLU 82.A O no hydrogen 2.743 N/A LYS 87.A N GLU 83.A O no hydrogen 3.291 N/A VAL 88.A N SER 85.A O no hydrogen 3.064 N/A LEU 93.A N PRO 89.A O no hydrogen 3.005 N/A GLU 94.A N ARG 90.A O no hydrogen 3.060 N/A VAL 95.A N VAL 92.A O no hydrogen 2.825 N/A MET 96.A N VAL 92.A O no hydrogen 3.286 N/A GLU 97.A N LEU 93.A O no hydrogen 3.073 N/A VAL 98.A N VAL 95.A O no hydrogen 3.220 N/A VAL 101.A N VAL 98.A O no hydrogen 3.010 N/A GLY 102.A N MET 96.A O no hydrogen 3.168 N/A LYS 104.A NZ GLU 18.A OE2 no hydrogen 3.341 N/A ALA 106.A N GLY 102.A O no hydrogen 2.903 N/A ARG 107.A N PRO 103.A O no hydrogen 2.714 N/A ARG 107.A NE GLU 111.A OE1 no hydrogen 3.429 N/A ARG 107.A NH1 PHE 19.A O no hydrogen 2.846 N/A LEU 108.A N LYS 104.A O no hydrogen 2.687 N/A LEU 109.A N THR 105.A O no hydrogen 2.821 N/A TYR 110.A N ALA 106.A O no hydrogen 2.978 N/A TYR 110.A N ARG 107.A O no hydrogen 2.591 N/A GLU 111.A N ARG 107.A O no hydrogen 2.878 N/A LEU 113.A N LEU 109.A O no hydrogen 2.770 N/A SER 117.A OG GLU 119.A OE1 no hydrogen 3.209 N/A GLU 119.A N SER 117.A OG no hydrogen 3.302 N/A LYS 120.A NZ SER 117.A OG no hydrogen 2.804 N/A LYS 120.A NZ GLU 119.A OE1 no hydrogen 3.108 N/A LEU 121.A N SER 117.A O no hydrogen 2.984 N/A LYS 122.A N LEU 118.A O no hydrogen 2.703 N/A ALA 123.A N GLU 119.A O no hydrogen 2.889 N/A ALA 124.A N LYS 120.A O no hydrogen 3.240 N/A LEU 125.A N LEU 121.A O no hydrogen 2.627 N/A ASP 126.A N LYS 122.A O no hydrogen 3.033 N/A ASP 126.A N ALA 123.A O no hydrogen 2.537 N/A ARG 127.A N ALA 124.A O no hydrogen 2.874 N/A ALA 134.A N GLY 130.A O no hydrogen 3.371 N/A GLU 135.A N PRO 131.A O no hydrogen 3.331 N/A ARG 136.A N LYS 132.A O no hydrogen 2.479 N/A ILE 137.A N ARG 133.A O no hydrogen 3.060 N/A ARG 138.A N ALA 134.A O no hydrogen 3.153 N/A GLU 139.A N GLU 135.A O no hydrogen 3.171 N/A GLY 140.A N ARG 136.A O no hydrogen 3.047 N/A LEU 141.A N ILE 137.A O no hydrogen 2.879 N/A ALA 142.A N ARG 138.A O no hydrogen 2.967 N/A LEU 143.A N GLU 139.A O no hydrogen 3.249 N/A ALA 144.A N GLY 140.A O no hydrogen 2.782 N/A GLN 145.A N LEU 141.A O no hydrogen 3.009 N/A ALA 146.A N ALA 142.A O no hydrogen 2.526 N/A ALA 147.A N LEU 143.A O no hydrogen 2.725 N/A GLY 148.A N ALA 144.A O no hydrogen 3.160 N/A LYS 149.A NZ LYS 149.A O no hydrogen 3.411 N/A ARG 150.A NE THR 188.A OG1 no hydrogen 2.933 N/A ARG 150.A NH2 THR 188.A O no hydrogen 3.020 N/A ARG 151.A N VAL 189.A O no hydrogen 2.610 N/A LEU 153.A N ASP 187.A O no hydrogen 2.864 N/A ALA 155.A N PRO 152.A O no hydrogen 2.893 N/A VAL 156.A N LEU 153.A O no hydrogen 3.391 N/A ALA 160.A N VAL 156.A O no hydrogen 2.892 N/A ARG 161.A N LEU 157.A O no hydrogen 3.004 N/A SER 162.A N SER 158.A O no hydrogen 2.700 N/A LEU 163.A N LEU 159.A O no hydrogen 3.184 N/A GLU 165.A N ARG 161.A O no hydrogen 3.207 N/A ILE 167.A N LEU 163.A O no hydrogen 2.632 N/A ARG 168.A N LEU 164.A O no hydrogen 2.857 N/A ARG 168.A NE ALA 176.A O no hydrogen 2.425 N/A ARG 168.A NH2 ALA 176.A O no hydrogen 2.989 N/A ALA 169.A N GLU 165.A O no hydrogen 2.807 N/A LEU 170.A N ILE 167.A O no hydrogen 3.444 N/A GLU 174.A N ALA 197.A O no hydrogen 3.265 N/A LEU 178.A N GLU 177.A OE2 no hydrogen 3.241 N/A CYS 179.A N ASP 193.A O no hydrogen 2.634 N/A CYS 179.A SG GLU 177.A O no hydrogen 3.666 N/A ARG 183.A NE THR 253.A OG1 no hydrogen 3.427 N/A ARG 183.A NH2 GLU 290.A OE2 no hydrogen 2.476 N/A ARG 184.A N GLY 180.A O no hydrogen 3.146 N/A ARG 184.A NE GLU 308.A OE2 no hydrogen 2.804 N/A ARG 184.A NH1 THR 253.A O no hydrogen 3.418 N/A TYR 185.A N ALA 182.A O no hydrogen 3.117 N/A LYS 186.A N SER 181.A O no hydrogen 3.371 N/A THR 188.A N ASP 187.A OD2 no hydrogen 3.090 N/A THR 188.A OG1 ARG 151.A O no hydrogen 3.414 N/A VAL 189.A N ARG 151.A O no hydrogen 2.463 N/A LEU 192.A N GLN 234.A O no hydrogen 2.821 N/A LEU 195.A N GLU 177.A O no hydrogen 3.062 N/A VAL 196.A N ARG 238.A O no hydrogen 3.060 N/A ALA 197.A N ARG 175.A O no hydrogen 2.870 N/A SER 198.A N VAL 240.A O no hydrogen 3.266 N/A SER 198.A OG GLY 172.A O no hydrogen 3.087 N/A VAL 205.A N GLY 201.A O no hydrogen 2.582 N/A PHE 208.A N VAL 205.A O no hydrogen 3.003 N/A VAL 209.A N VAL 205.A O no hydrogen 3.459 N/A VAL 214.A N LEU 211.A O no hydrogen 3.192 N/A GLU 216.A N PHE 228.A O no hydrogen 3.085 N/A LYS 220.A NZ GLU 206.A O no hydrogen 3.273 N/A ALA 225.A N LEU 237.A O no hydrogen 3.268 N/A THR 226.A N ALA 219.A O no hydrogen 3.232 N/A THR 226.A OG1 ASP 236.A OD2 no hydrogen 3.262 N/A VAL 227.A N VAL 235.A O no hydrogen 3.246 N/A PHE 228.A N GLU 216.A O no hydrogen 3.001 N/A LEU 229.A N LEU 233.A O no hydrogen 2.804 N/A LYS 230.A N GLN 213.A O no hydrogen 3.462 N/A LYS 230.A NZ PRO 212.A O no hydrogen 2.714 N/A GLN 234.A NE2 ASP 236.A OD1 no hydrogen 3.283 N/A GLN 234.A NE2 ASP 236.A OD2 no hydrogen 2.778 N/A VAL 235.A N VAL 227.A O no hydrogen 3.138 N/A ASP 236.A N LEU 192.A O no hydrogen 2.868 N/A LEU 237.A N ALA 225.A O no hydrogen 2.836 N/A ARG 238.A N PHE 194.A O no hydrogen 3.369 N/A ARG 238.A NH2 TYR 276.A OH no hydrogen 3.155 N/A SER 244.A N PRO 241.A O no hydrogen 2.826 N/A SER 244.A OG TYR 276.A O no hydrogen 2.989 N/A TYR 245.A N PRO 242.A O no hydrogen 3.484 N/A GLY 246.A N GLY 287.A O no hydrogen 2.847 N/A GLY 248.A N SER 244.A O no hydrogen 2.888 N/A LEU 249.A N TYR 245.A O no hydrogen 2.902 N/A GLN 250.A N GLY 246.A O no hydrogen 2.931 N/A GLN 250.A NE2 SER 259.A OG no hydrogen 2.871 N/A TYR 251.A N ALA 247.A O no hydrogen 2.713 N/A LEU 252.A N GLY 248.A O no hydrogen 2.940 N/A THR 253.A N LEU 249.A O no hydrogen 2.976 N/A THR 253.A N GLN 250.A O no hydrogen 3.284 N/A THR 253.A OG1 LEU 249.A O no hydrogen 2.702 N/A GLY 254.A N GLN 250.A O no hydrogen 2.895 N/A GLY 254.A N TYR 251.A O no hydrogen 3.066 N/A SER 255.A OG ARG 307.A O no hydrogen 3.276 N/A SER 255.A OG GLU 308.A OE1 no hydrogen 3.565 N/A HIS 258.A N SER 255.A OG no hydrogen 3.167 N/A HIS 258.A NE2 TYR 294.A OH no hydrogen 3.119 N/A SER 259.A N SER 255.A O no hydrogen 2.474 N/A SER 259.A OG GLN 250.A OE1 no hydrogen 3.085 N/A ARG 261.A N HIS 258.A O no hydrogen 3.160 N/A ARG 261.A NE ASP 309.A OD1 no hydrogen 2.680 N/A LEU 262.A N HIS 258.A O no hydrogen 3.223 N/A ARG 263.A N SER 259.A O no hydrogen 3.166 N/A ARG 263.A NH2 GLU 275.A OE2 no hydrogen 3.487 N/A ALA 264.A N ILE 260.A O no hydrogen 3.272 N/A LEU 265.A N ARG 261.A O no hydrogen 3.205 N/A ALA 266.A N LEU 262.A O no hydrogen 3.175 N/A GLN 267.A N ARG 263.A O no hydrogen 2.998 N/A GLU 268.A N ALA 264.A O no hydrogen 2.939 N/A LYS 269.A N LEU 265.A O no hydrogen 2.995 N/A LYS 269.A N ALA 266.A O no hydrogen 3.308 N/A LYS 269.A NZ LEU 297.A O no hydrogen 2.965 N/A GLY 270.A N GLN 267.A O no hydrogen 2.782 N/A LEU 271.A N ALA 266.A O no hydrogen 2.452 N/A LYS 272.A N PHE 279.A O no hydrogen 3.032 N/A SER 274.A N GLY 277.A O no hydrogen 2.661 N/A GLU 275.A N GLU 275.A OE2 no hydrogen 2.672 N/A TYR 276.A N SER 274.A OG no hydrogen 2.547 N/A GLY 277.A N SER 274.A OG no hydrogen 2.968 N/A VAL 278.A N ALA 286.A O no hydrogen 3.283 N/A ARG 280.A N LYS 283.A O no hydrogen 3.216 N/A ILE 285.A N VAL 278.A O no hydrogen 2.623 N/A GLY 287.A N GLU 292.A OE1 no hydrogen 3.326 N/A GLU 292.A N THR 289.A OG1 no hydrogen 3.424 N/A VAL 293.A N THR 289.A O no hydrogen 3.205 N/A TYR 294.A N GLU 290.A O no hydrogen 3.211 N/A TYR 294.A OH HIS 258.A NE2 no hydrogen 3.119 N/A ALA 295.A N GLU 291.A O no hydrogen 2.781 N/A LEU 297.A N VAL 293.A O no hydrogen 3.085 N/A LEU 297.A N TYR 294.A O no hydrogen 3.213 N/A GLY 298.A N ALA 295.A O no hydrogen 3.049 N/A LEU 299.A N TYR 294.A O no hydrogen 2.818 N/A TRP 301.A NE1 GLU 290.A OE2 no hydrogen 3.377 N/A LEU 306.A N PRO 303.A O no hydrogen 2.581 N/A ARG 307.A N PRO 304.A O no hydrogen 2.470 N/A ARG 307.A NE ILE 302.A O no hydrogen 2.735 N/A ARG 307.A NH2 GLU 290.A OE2 no hydrogen 3.137 N/A ARG 307.A NH2 ILE 302.A O no hydrogen 3.155 N/A GLU 308.A N GLU 312.A OE1 no hydrogen 2.462 N/A ASP 309.A N GLU 312.A OE1 no hydrogen 2.177 N/A GLN 310.A N GLU 312.A OE1 no hydrogen 3.347 N/A GLN 310.A N GLU 312.A OE2 no hydrogen 3.285 N/A GLU 312.A N GLU 312.A OE2 no hydrogen 2.435 N/A GLU 314.A N GLU 314.A OE1 no hydrogen 2.533 N/A ALA 315.A N GLY 311.A O no hydrogen 2.901 N/A ALA 316.A N GLU 312.A O no hydrogen 2.895 N/A LEU 317.A N GLU 314.A O no hydrogen 3.122 N/A GLU 318.A N ALA 315.A O no hydrogen 3.241 N/A GLY 319.A N ALA 316.A O no hydrogen 3.221 N/A ARG 320.A N ALA 315.A O no hydrogen 2.791 N/A LEU 325.A N ILE 542.A O no hydrogen 2.866 N/A VAL 330.A N LEU 327.A O no hydrogen 3.187 N/A LYS 331.A N ASN 549.A O no hydrogen 2.558 N/A LYS 331.A NZ GLN 329.A O no hydrogen 3.103 N/A LYS 331.A NZ THR 550.A O no hydrogen 3.446 N/A LEU 334.A N LEU 517.A O no hydrogen 3.192 N/A HIS 337.A N ALA 521.A O no hydrogen 2.891 N/A HIS 337.A NE2 ASP 520.A OD2 no hydrogen 2.600 N/A SER 338.A N ASP 366.A OD1 no hydrogen 2.859 N/A SER 338.A OG ASP 366.A OD1 no hydrogen 3.302 N/A SER 338.A OG ASP 366.A OD2 no hydrogen 3.122 N/A THR 339.A N ASN 345.A O no hydrogen 2.758 N/A THR 339.A OG1 ASN 345.A O no hydrogen 3.124 N/A TYR 340.A N SER 338.A OG no hydrogen 3.039 N/A TYR 340.A OH GLU 386.A OE1 no hydrogen 2.751 N/A SER 341.A N SER 338.A O no hydrogen 3.291 N/A SER 341.A OG ASP 366.A OD1 no hydrogen 2.606 N/A GLN 344.A N HIS 522.A O no hydrogen 2.999 N/A GLU 349.A N THR 346.A OG1 no hydrogen 3.322 N/A LEU 350.A N THR 346.A O no hydrogen 3.297 N/A TRP 351.A N LEU 347.A O no hydrogen 2.768 N/A TRP 351.A NE1 PRO 397.A O no hydrogen 2.693 N/A GLU 352.A N GLU 348.A O no hydrogen 2.736 N/A ALA 353.A N GLU 349.A O no hydrogen 3.095 N/A ALA 354.A N LEU 350.A O no hydrogen 3.197 N/A ALA 354.A N TRP 351.A O no hydrogen 2.548 N/A LYS 355.A N TRP 351.A O no hydrogen 3.075 N/A THR 356.A N GLU 352.A O no hydrogen 3.143 N/A THR 356.A OG1 ALA 353.A O no hydrogen 3.404 N/A MET 357.A N ALA 353.A O no hydrogen 3.101 N/A GLY 358.A N ALA 354.A O no hydrogen 2.941 N/A GLY 358.A N LYS 355.A O no hydrogen 2.447 N/A TYR 359.A N ALA 354.A O no hydrogen 2.824 N/A ARG 360.A N LYS 331.A O no hydrogen 2.737 N/A TYR 361.A N LYS 331.A O no hydrogen 3.276 N/A TYR 361.A OH LEU 548.A O no hydrogen 2.938 N/A TYR 361.A OH LEU 551.A O no hydrogen 2.772 N/A LEU 362.A N TYR 398.A O no hydrogen 3.188 N/A ALA 363.A N ASP 333.A O no hydrogen 3.369 N/A VAL 364.A N LEU 400.A O no hydrogen 3.037 N/A THR 365.A OG1 VAL 336.A O no hydrogen 3.359 N/A THR 365.A OG1 THR 365.A O no hydrogen 2.454 N/A ASP 366.A N VAL 364.A O no hydrogen 2.874 N/A HIS 367.A ND1 GLU 404.A OE1 no hydrogen 2.540 N/A SER 368.A N GLU 404.A O no hydrogen 3.020 N/A SER 368.A OG ASP 414.A OD2 no hydrogen 2.763 N/A ALA 370.A N ASP 414.A OD2 no hydrogen 2.815 N/A VAL 371.A N PRO 369.A O no hydrogen 2.355 N/A SER 376.A OG GLU 379.A OE2 no hydrogen 2.623 N/A GLU 378.A N GLU 378.A OE1 no hydrogen 2.668 N/A GLU 379.A N SER 376.A OG no hydrogen 2.935 N/A ALA 380.A N SER 376.A O no hydrogen 2.456 N/A LEU 381.A N PRO 377.A O no hydrogen 3.140 N/A LYS 382.A N GLU 378.A O no hydrogen 2.934 N/A ARG 383.A N GLU 379.A O no hydrogen 3.037 N/A ARG 383.A NE ASP 366.A OD2 no hydrogen 2.957 N/A ARG 383.A NH2 VAL 364.A O no hydrogen 2.308 N/A ARG 383.A NH2 ASP 366.A OD2 no hydrogen 3.478 N/A ARG 383.A NH2 GLY 402.A O no hydrogen 2.443 N/A VAL 384.A N ALA 380.A O no hydrogen 2.901 N/A GLY 385.A N LEU 381.A O no hydrogen 2.850 N/A GLU 386.A N LYS 382.A O no hydrogen 2.584 N/A ILE 387.A N ARG 383.A O no hydrogen 2.866 N/A ARG 388.A N VAL 384.A O no hydrogen 2.821 N/A ARG 388.A NH1 ASP 424.A OD1 no hydrogen 2.849 N/A ARG 388.A NH1 ASP 424.A OD2 no hydrogen 3.106 N/A ARG 388.A NH2 ASP 424.A OD1 no hydrogen 2.430 N/A ARG 389.A N GLY 385.A O no hydrogen 2.801 N/A ASN 391.A N ILE 387.A O no hydrogen 2.482 N/A ASN 391.A ND2 LEU 399.A O no hydrogen 3.426 N/A THR 393.A OG1 PHE 390.A O no hydrogen 3.018 N/A THR 393.A OG1 HIS 394.A ND1 no hydrogen 3.300 N/A HIS 394.A N ASN 391.A O no hydrogen 3.197 N/A HIS 394.A ND1 PHE 390.A O no hydrogen 3.150 N/A HIS 394.A NE2 GLU 348.A OE2 no hydrogen 2.611 N/A TYR 398.A N ARG 360.A O no hydrogen 3.507 N/A LEU 400.A N LEU 362.A O no hydrogen 2.584 N/A ALA 401.A N ASP 424.A OD2 no hydrogen 2.218 N/A ALA 403.A N LEU 425.A O no hydrogen 3.248 N/A GLU 404.A N ASP 366.A O no hydrogen 2.639 N/A VAL 405.A N LEU 427.A O no hydrogen 2.911 N/A ASP 406.A N SER 368.A OG no hydrogen 3.121 N/A HIS 408.A N THR 412.A O no hydrogen 2.779 N/A HIS 408.A NE2 ASP 414.A OD1 no hydrogen 2.648 N/A GLY 411.A N HIS 408.A O no hydrogen 2.833 N/A THR 412.A N ASP 410.A OD1 no hydrogen 2.863 N/A THR 412.A OG1 ASP 410.A OD1 no hydrogen 2.687 N/A THR 412.A OG1 ASP 410.A OD2 no hydrogen 3.271 N/A TYR 415.A OH PRO 375.A O no hydrogen 3.387 N/A VAL 419.A N PRO 416.A O no hydrogen 2.955 N/A LEU 420.A N PRO 416.A O no hydrogen 2.910 N/A ARG 421.A N ASP 417.A O no hydrogen 3.113 N/A GLU 422.A N VAL 419.A O no hydrogen 2.689 N/A LEU 423.A N LEU 420.A O no hydrogen 2.709 N/A ASP 424.A N ALA 401.A O no hydrogen 2.606 N/A LEU 425.A N ALA 401.A O no hydrogen 3.421 N/A LEU 427.A N ALA 403.A O no hydrogen 2.776 N/A VAL 428.A N VAL 456.A O no hydrogen 3.122 N/A SER 429.A N VAL 405.A O no hydrogen 3.260 N/A SER 429.A OG GLU 404.A OE2 no hydrogen 2.892 N/A HIS 431.A N ASP 406.A OD1 no hydrogen 2.955 N/A HIS 431.A N SER 432.A OG no hydrogen 3.314 N/A SER 432.A OG ASP 406.A OD2 no hydrogen 3.081 N/A ARG 433.A NE ASN 435.A OD1 no hydrogen 2.257 N/A ARG 433.A NH2 ASN 435.A OD1 no hydrogen 2.579 N/A ASP 440.A N PRO 437.A O no hydrogen 2.844 N/A GLN 441.A N PRO 437.A O no hydrogen 2.858 N/A GLN 441.A NE2 GLN 441.A O no hydrogen 3.624 N/A THR 442.A OG1 LYS 438.A O no hydrogen 2.701 N/A ARG 444.A N ASP 440.A O no hydrogen 3.225 N/A ARG 444.A NE HIS 408.A O no hydrogen 3.019 N/A ARG 444.A NH1 SER 432.A O no hydrogen 2.662 N/A ARG 444.A NH2 ILE 407.A O no hydrogen 2.728 N/A ARG 444.A NH2 SER 432.A OG no hydrogen 3.236 N/A LEU 445.A N GLN 441.A O no hydrogen 3.430 N/A LEU 446.A N THR 442.A O no hydrogen 3.136 N/A LYS 447.A N LYS 443.A O no hydrogen 2.643 N/A ALA 448.A N ARG 444.A O no hydrogen 2.717 N/A LEU 449.A N LEU 445.A O no hydrogen 2.774 N/A ASN 451.A N ALA 448.A O no hydrogen 3.259 N/A PHE 453.A N ASN 451.A OD1 no hydrogen 2.458 N/A VAL 454.A N ASN 451.A OD1 no hydrogen 3.139 N/A HIS 455.A N VAL 426.A O no hydrogen 3.192 N/A HIS 455.A NE2 LEU 560.A O no hydrogen 3.034 N/A VAL 456.A N VAL 426.A O no hydrogen 3.104 N/A LEU 457.A N ALA 488.A O no hydrogen 2.778 N/A ALA 458.A N VAL 428.A O no hydrogen 3.003 N/A HIS 459.A N GLU 490.A OE1 no hydrogen 2.536 N/A HIS 459.A ND1 HIS 459.A O no hydrogen 2.643 N/A HIS 459.A NE2 GLU 404.A OE2 no hydrogen 2.592 N/A THR 461.A N ASP 499.A OD1 no hydrogen 2.593 N/A THR 461.A OG1 ASP 499.A OD1 no hydrogen 1.980 N/A ALA 462.A N HIS 459.A O no hydrogen 3.257 N/A ARG 463.A N THR 461.A OG1 no hydrogen 3.288 N/A ARG 463.A NH2 ASP 187.A OD1 no hydrogen 3.456 N/A ARG 463.A NH2 MET 498.A O no hydrogen 2.947 N/A LEU 464.A N ARG 468.A O no hydrogen 3.224 N/A LEU 465.A N ASP 496.A O no hydrogen 2.667 N/A ARG 467.A N LEU 464.A O no hydrogen 3.098 N/A ARG 467.A NH2 ASP 496.A OD1 no hydrogen 3.383 N/A ARG 468.A N LEU 464.A O no hydrogen 2.698 N/A ARG 468.A NE ALA 462.A O no hydrogen 3.117 N/A ARG 468.A NH2 ALA 462.A O no hydrogen 3.096 N/A ILE 471.A N THR 461.A O no hydrogen 2.885 N/A ASP 474.A N THR 442.A OG1 no hydrogen 2.952 N/A ALA 477.A N ASP 474.A OD2 no hydrogen 3.467 N/A VAL 478.A N ASP 474.A O no hydrogen 2.890 N/A PHE 479.A N TRP 475.A O no hydrogen 2.770 N/A GLN 480.A N GLU 476.A O no hydrogen 3.276 N/A GLN 480.A NE2 GLU 476.A OE1 no hydrogen 2.704 N/A LYS 481.A N ALA 477.A O no hydrogen 2.941 N/A LYS 481.A NZ LEU 446.A O no hydrogen 3.563 N/A LYS 481.A NZ GLU 450.A OE2 no hydrogen 3.121 N/A ALA 482.A N VAL 478.A O no hydrogen 2.882 N/A LYS 483.A N PHE 479.A O no hydrogen 2.616 N/A LYS 483.A NZ MET 511.A O no hydrogen 3.530 N/A GLU 484.A N GLN 480.A O no hydrogen 3.119 N/A LYS 485.A NZ GLU 450.A OE2 no hydrogen 3.046 N/A GLY 486.A N LYS 483.A O no hydrogen 2.861 N/A VAL 487.A N ALA 482.A O no hydrogen 2.923 N/A ALA 488.A N HIS 455.A O no hydrogen 2.903 N/A VAL 489.A N TRP 514.A O no hydrogen 3.403 N/A GLU 490.A N LEU 457.A O no hydrogen 3.087 N/A ILE 491.A N SER 516.A O no hydrogen 2.714 N/A ASP 492.A N ASP 499.A O no hydrogen 2.489 N/A GLY 493.A N SER 518.A O no hydrogen 2.696 N/A TYR 494.A N ASP 492.A OD1 no hydrogen 3.351 N/A TYR 494.A OH ASP 39.A OD2 no hydrogen 2.912 N/A TYR 495.A OH ASP 39.A OD1 no hydrogen 2.894 N/A ARG 497.A N TYR 494.A O no hydrogen 3.235 N/A LEU 500.A N GLU 490.A O no hydrogen 2.695 N/A ASP 503.A N ASP 502.A OD1 no hydrogen 2.347 N/A LEU 504.A N PRO 501.A O no hydrogen 3.016 N/A ALA 505.A N PRO 501.A O no hydrogen 2.747 N/A ARG 506.A N ASP 502.A O no hydrogen 2.969 N/A ARG 506.A NH2 GLN 310.A O no hydrogen 3.250 N/A ALA 508.A N LEU 504.A O no hydrogen 3.135 N/A TYR 509.A N ALA 505.A O no hydrogen 3.148 N/A TYR 509.A OH GLU 545.A O no hydrogen 2.647 N/A GLY 510.A N ARG 506.A O no hydrogen 2.949 N/A MET 511.A N ALA 508.A O no hydrogen 2.237 N/A GLY 512.A N TYR 509.A O no hydrogen 3.337 N/A SER 516.A N VAL 489.A O no hydrogen 2.389 N/A SER 518.A N ILE 491.A O no hydrogen 2.985 N/A SER 518.A OG GLU 490.A OE2 no hydrogen 2.362 N/A SER 518.A OG ILE 491.A O no hydrogen 3.512 N/A THR 519.A N ASP 333.A OD1 no hydrogen 3.101 N/A THR 519.A OG1 ASP 333.A OD2 no hydrogen 2.923 N/A THR 519.A OG1 HIS 526.A O no hydrogen 3.514 N/A THR 524.A OG1 GLN 523.A OE1 no hydrogen 2.222 N/A THR 524.A OG1 ASP 525.A OD1 no hydrogen 3.384 N/A HIS 526.A N GLN 523.A O no hydrogen 3.215 N/A LEU 527.A N THR 524.A O no hydrogen 3.347 N/A ARG 528.A N ASP 525.A O no hydrogen 3.227 N/A PHE 529.A N HIS 526.A O no hydrogen 3.145 N/A MET 530.A N ARG 528.A O no hydrogen 2.547 N/A ALA 533.A N MET 530.A O no hydrogen 2.453 N/A VAL 534.A N MET 530.A O no hydrogen 3.130 N/A GLY 535.A N GLU 531.A O no hydrogen 2.548 N/A THR 536.A N LEU 532.A O no hydrogen 3.169 N/A THR 536.A OG1 LEU 532.A O no hydrogen 2.318 N/A THR 536.A OG1 ALA 533.A O no hydrogen 3.285 N/A ALA 537.A N ALA 533.A O no hydrogen 2.686 N/A GLN 538.A N VAL 534.A O no hydrogen 2.783 N/A ARG 539.A N GLY 535.A O no hydrogen 3.181 N/A ARG 539.A NH1 ARG 184.A O no hydrogen 2.397 N/A ARG 539.A NH1 GLU 308.A OE2 no hydrogen 3.362 N/A ARG 539.A NH2 GLU 308.A OE2 no hydrogen 3.560 N/A ALA 540.A N ALA 537.A O no hydrogen 2.453 N/A TRP 541.A N GLN 538.A O no hydrogen 2.916 N/A GLY 543.A N TYR 509.A OH no hydrogen 3.285 N/A ARG 546.A NH1 TYR 509.A O no hydrogen 3.001 N/A ARG 546.A NH2 TYR 509.A O no hydrogen 2.688 N/A LEU 548.A N ILE 515.A O no hydrogen 3.080 N/A THR 550.A N VAL 547.A O no hydrogen 2.924 N/A THR 550.A OG1 PRO 544.A O no hydrogen 2.703 N/A THR 550.A OG1 VAL 547.A O no hydrogen 2.536 N/A LEU 556.A N ASP 552.A O no hydrogen 3.152 N/A LEU 557.A N TYR 553.A O no hydrogen 2.813 N/A SER 558.A N GLU 554.A O no hydrogen 2.654 N/A SER 558.A OG GLU 554.A O no hydrogen 2.582 N/A SER 558.A OG ASP 555.A O no hydrogen 2.859 N/A TRP 559.A N ASP 555.A O no hydrogen 2.774 N/A LEU 560.A N LEU 556.A O no hydrogen 2.773 N/A LYS 561.A N SER 558.A O no hydrogen 3.297 N/A ALA 562.A N SER 558.A O no hydrogen 3.436 N/A