Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ahu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N ILE 35.A O no hydrogen 2.617 N/A THR 6.A OG1 LEU 5.A O no hydrogen 2.883 N/A LYS 10.A NZ GLN 547.A O no hydrogen 2.596 N/A ASP 15.A N SER 12.A OG no hydrogen 3.033 N/A PHE 16.A N SER 12.A O no hydrogen 2.819 N/A ASN 17.A N LEU 13.A O no hydrogen 2.957 N/A ASN 17.A ND2 PHE 2.A O no hydrogen 3.074 N/A ASN 17.A ND2 LEU 13.A O no hydrogen 2.653 N/A GLU 18.A N SER 14.A O no hydrogen 2.707 N/A PHE 19.A N ASP 15.A O no hydrogen 2.734 N/A ILE 20.A N PHE 16.A O no hydrogen 2.435 N/A GLN 21.A N ASN 17.A O no hydrogen 2.722 N/A ASP 22.A N GLU 18.A O no hydrogen 2.884 N/A ILE 23.A N PHE 19.A O no hydrogen 3.002 N/A ILE 24.A N ILE 20.A O no hydrogen 2.984 N/A ARG 25.A N GLN 21.A O no hydrogen 2.838 N/A ILE 26.A N ILE 23.A O no hydrogen 3.101 N/A VAL 27.A N ILE 23.A O no hydrogen 3.127 N/A GLY 28.A N ILE 24.A O no hydrogen 2.936 N/A ASN 31.A N GLY 28.A O no hydrogen 2.677 N/A ASN 31.A ND2 VAL 27.A O no hydrogen 2.832 N/A GLU 33.A N ILE 69.A O no hydrogen 2.927 N/A ILE 35.A N SER 67.A O no hydrogen 3.180 N/A SER 36.A OG ARG 3.A O no hydrogen 3.254 N/A ILE 41.A N LYS 38.A O no hydrogen 2.835 N/A SER 45.A OG LYS 48.A O no hydrogen 3.221 N/A LYS 48.A N SER 45.A OG no hydrogen 2.783 N/A THR 50.A OG1 THR 52.A OG1 no hydrogen 2.818 N/A THR 52.A OG1 THR 50.A OG1 no hydrogen 2.818 N/A THR 52.A OG1 HIS 53.A ND1 no hydrogen 2.913 N/A HIS 53.A NE2 ASP 43.A OD1 no hydrogen 2.907 N/A HIS 56.A NE2 HIS 417.A ND1 no hydrogen 2.275 N/A HIS 57.A N HIS 57.A ND1 no hydrogen 2.466 N/A HIS 57.A ND1 PRO 55.A O no hydrogen 2.239 N/A GLN 61.A NE2 ILE 41.A O no hydrogen 3.650 N/A GLN 61.A NE2 HIS 53.A NE2 no hydrogen 2.904 N/A TYR 63.A N ASP 60.A O no hydrogen 2.704 N/A LEU 65.A N SER 111.A OG no hydrogen 3.049 N/A ALA 66.A N THR 52.A O no hydrogen 3.116 N/A SER 67.A N SER 113.A O no hydrogen 2.727 N/A SER 67.A OG GLY 112.A O no hydrogen 2.862 N/A SER 67.A OG SER 113.A O no hydrogen 3.093 N/A ILE 69.A N GLU 33.A O no hydrogen 2.694 N/A VAL 70.A N VAL 115.A O no hydrogen 2.594 N/A ALA 71.A N ASN 31.A O no hydrogen 2.623 N/A ARG 73.A N ASP 77.A OD2 no hydrogen 3.090 N/A VAL 78.A N ASN 74.A O no hydrogen 3.135 N/A GLN 79.A N VAL 75.A O no hydrogen 2.697 N/A GLN 79.A NE2 GLY 202.A O no hydrogen 2.723 N/A SER 80.A N ALA 76.A O no hydrogen 2.830 N/A SER 80.A OG ALA 76.A O no hydrogen 3.182 N/A ILE 81.A N ASP 77.A O no hydrogen 3.131 N/A VAL 82.A N VAL 78.A O no hydrogen 3.007 N/A GLY 83.A N GLN 79.A O no hydrogen 3.168 N/A LEU 84.A N SER 80.A O no hydrogen 2.900 N/A ALA 85.A N ILE 81.A O no hydrogen 2.509 N/A ASN 86.A N VAL 82.A O no hydrogen 2.587 N/A LYS 87.A N GLY 83.A O no hydrogen 2.511 N/A PHE 88.A N LEU 84.A O no hydrogen 2.705 N/A PHE 90.A N ALA 85.A O no hydrogen 3.001 N/A LEU 92.A N ILE 535.A O no hydrogen 2.456 N/A TRP 93.A N VAL 114.A O no hydrogen 2.536 N/A ILE 95.A N LEU 116.A O no hydrogen 3.029 N/A ARG 99.A NE TYR 46.A O no hydrogen 3.104 N/A ARG 99.A NH1 GLY 168.A O no hydrogen 3.409 N/A SER 101.A N ARG 99.A O no hydrogen 2.381 N/A SER 101.A OG ARG 99.A O no hydrogen 3.196 N/A GLY 105.A N ASN 100.A O no hydrogen 2.811 N/A ALA 107.A N GLY 104.A O no hydrogen 3.342 N/A ARG 109.A NH1 TRP 553.A O no hydrogen 3.336 N/A SER 111.A OG TYR 63.A O no hydrogen 2.673 N/A GLY 112.A N LEU 65.A O no hydrogen 2.449 N/A SER 113.A OG VAL 110.A O no hydrogen 2.509 N/A VAL 114.A N PRO 91.A O no hydrogen 2.999 N/A VAL 115.A N ALA 68.A O no hydrogen 3.094 N/A LEU 116.A N TRP 93.A O no hydrogen 2.615 N/A ASP 117.A N VAL 70.A O no hydrogen 2.750 N/A MET 118.A N ILE 95.A O no hydrogen 2.848 N/A LYS 120.A N ASP 117.A OD1 no hydrogen 2.702 N/A LYS 120.A NZ GLU 30.A O no hydrogen 3.295 N/A LYS 120.A NZ ASN 31.A OD1 no hydrogen 3.458 N/A ASN 121.A ND2 ASN 31.A OD1 no hydrogen 3.144 N/A ASN 121.A ND2 PRO 72.A O no hydrogen 3.126 N/A MET 122.A N MET 118.A O no hydrogen 3.386 N/A ASN 123.A ND2 LYS 120.A O no hydrogen 3.327 N/A ARG 124.A N GLU 138.A OE1 no hydrogen 2.925 N/A LEU 126.A N VAL 136.A O no hydrogen 2.788 N/A GLU 127.A N VAL 136.A O no hydrogen 3.159 N/A ASN 129.A N TYR 134.A O no hydrogen 2.893 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.600 N/A GLY 132.A N ASN 129.A OD1 no hydrogen 2.228 N/A TYR 134.A N ASN 129.A O no hydrogen 3.010 N/A CYS 135.A N ILE 262.A O no hydrogen 2.988 N/A CYS 135.A SG ILE 262.A O no hydrogen 3.667 N/A VAL 136.A N GLU 127.A O no hydrogen 2.494 N/A VAL 137.A N ILE 260.A O no hydrogen 2.829 N/A GLU 138.A N ARG 124.A O no hydrogen 3.024 N/A GLY 140.A N MET 122.A O no hydrogen 3.187 N/A VAL 141.A N GLU 138.A O no hydrogen 3.010 N/A THR 142.A N ASP 145.A OD2 no hydrogen 2.950 N/A TYR 143.A N GLY 169.A O no hydrogen 2.917 N/A HIS 144.A N GLY 167.A O no hydrogen 3.237 N/A ASP 145.A N THR 142.A OG1 no hydrogen 3.188 N/A LEU 146.A N THR 142.A O no hydrogen 2.938 N/A HIS 147.A N TYR 143.A O no hydrogen 2.834 N/A ASN 148.A N HIS 144.A O no hydrogen 2.659 N/A TYR 149.A N ASP 145.A O no hydrogen 2.669 N/A LEU 150.A N LEU 146.A O no hydrogen 3.281 N/A GLU 151.A N HIS 147.A O no hydrogen 2.993 N/A ALA 152.A N ASN 148.A O no hydrogen 2.872 N/A ASN 153.A N LEU 150.A O no hydrogen 3.154 N/A ASN 154.A N GLU 151.A O no hydrogen 2.787 N/A LEU 155.A N LEU 150.A O no hydrogen 2.829 N/A LYS 158.A N LEU 155.A O no hydrogen 2.298 N/A LEU 159.A N LEU 155.A O no hydrogen 2.791 N/A TRP 160.A N MET 265.A O no hydrogen 2.519 N/A SER 170.A OG PRO 139.A O no hydrogen 2.788 N/A VAL 171.A N VAL 141.A O no hydrogen 3.035 N/A GLY 173.A N SER 170.A OG no hydrogen 2.691 N/A ASN 174.A N SER 170.A O no hydrogen 3.067 N/A ALA 175.A N VAL 171.A O no hydrogen 3.172 N/A VAL 176.A N LEU 172.A O no hydrogen 3.310 N/A VAL 176.A N GLY 173.A O no hydrogen 3.132 N/A GLU 177.A N GLY 173.A O no hydrogen 2.963 N/A ARG 178.A N ALA 175.A O no hydrogen 3.197 N/A ARG 178.A NE SER 250.A OG no hydrogen 3.074 N/A ARG 178.A NH2 SER 250.A O no hydrogen 3.017 N/A GLY 179.A N ASN 174.A O no hydrogen 2.841 N/A GLY 181.A N GLY 186.A O no hydrogen 3.027 N/A TYR 182.A N VAL 163.A O no hydrogen 3.174 N/A THR 183.A OG1 ASP 162.A OD2 no hydrogen 2.750 N/A TYR 185.A N THR 183.A OG1 no hydrogen 2.527 N/A HIS 188.A ND1 ASN 174.A OD1 no hydrogen 2.482 N/A HIS 188.A NE2 ASP 162.A OD1 no hydrogen 2.752 N/A MET 190.A N ASP 187.A OD1 no hydrogen 3.182 N/A MET 191.A N HIS 188.A O no hydrogen 2.800 N/A HIS 192.A N TRP 189.A O no hydrogen 2.837 N/A SER 193.A N GLY 261.A O no hydrogen 2.680 N/A SER 193.A OG ALA 234.A O no hydrogen 3.272 N/A MET 195.A N THR 207.A OG1 no hydrogen 2.679 N/A GLU 196.A N LYS 259.A O no hydrogen 2.750 N/A VAL 197.A N LEU 205.A O no hydrogen 2.862 N/A VAL 198.A N ILE 256.A O no hydrogen 2.614 N/A LEU 199.A N GLU 203.A O no hydrogen 2.702 N/A GLY 202.A N LEU 199.A O no hydrogen 2.969 N/A GLU 203.A N ASN 201.A OD1 no hydrogen 2.301 N/A LEU 205.A N VAL 197.A O no hydrogen 2.753 N/A ARG 206.A NE GLU 196.A OE1 no hydrogen 2.766 N/A ARG 206.A NH1 GLN 228.A O no hydrogen 3.345 N/A ARG 206.A NH1 PRO 229.A O no hydrogen 3.432 N/A ARG 206.A NH2 GLU 196.A OE1 no hydrogen 3.353 N/A ARG 206.A NH2 GLN 228.A O no hydrogen 3.051 N/A THR 207.A N MET 195.A O no hydrogen 2.782 N/A THR 207.A OG1 MET 195.A O no hydrogen 3.085 N/A THR 207.A OG1 ASP 246.A OD2 no hydrogen 3.387 N/A GLY 210.A N THR 207.A O no hydrogen 2.515 N/A ALA 211.A N GLY 208.A O no hydrogen 3.125 N/A LEU 212.A N MET 209.A O no hydrogen 3.043 N/A ARG 217.A NH1 ASP 214.A OD2 no hydrogen 2.864 N/A THR 220.A N ARG 217.A O no hydrogen 2.532 N/A THR 220.A OG1 ARG 217.A O no hydrogen 2.531 N/A GLN 228.A N PRO 225.A O no hydrogen 3.021 N/A GLN 228.A NE2 LEU 223.A O no hydrogen 2.454 N/A LEU 236.A N ILE 233.A O no hydrogen 2.962 N/A LEU 248.A N ILE 245.A O no hydrogen 3.029 N/A PHE 249.A N ASP 246.A O no hydrogen 2.622 N/A SER 250.A N GLY 247.A O no hydrogen 3.037 N/A SER 250.A OG GLY 247.A O no hydrogen 3.276 N/A GLN 251.A NE2 GLU 177.A O no hydrogen 2.843 N/A GLN 251.A NE2 TYR 498.A O no hydrogen 3.216 N/A SER 252.A OG LEU 248.A O no hydrogen 2.291 N/A ASN 253.A ND2 ALA 537.A O no hydrogen 3.121 N/A ASN 253.A ND2 VAL 543.A O no hydrogen 3.384 N/A MET 254.A N SER 252.A OG no hydrogen 3.262 N/A ILE 256.A N VAL 198.A O no hydrogen 2.784 N/A THR 258.A N GLU 196.A O no hydrogen 2.607 N/A THR 258.A OG1 GLU 196.A O no hydrogen 2.893 N/A THR 258.A OG1 GLU 196.A OE2 no hydrogen 2.445 N/A LYS 259.A N GLU 196.A O no hydrogen 3.179 N/A LYS 259.A NZ GLU 196.A OE2 no hydrogen 2.693 N/A ILE 260.A N VAL 137.A O no hydrogen 2.980 N/A GLY 261.A N GLY 194.A O no hydrogen 2.916 N/A ILE 262.A N CYS 135.A O no hydrogen 2.897 N/A TRP 263.A N MET 191.A O no hydrogen 2.585 N/A TRP 263.A NE1 HIS 235.A O no hydrogen 2.800 N/A LEU 264.A N ALA 133.A O no hydrogen 2.683 N/A MET 265.A N TRP 160.A O no hydrogen 2.907 N/A ASN 267.A N LYS 158.A O no hydrogen 3.019 N/A ARG 269.A N ASN 267.A OD1 no hydrogen 2.820 N/A TYR 271.A OH ASP 394.A O no hydrogen 2.238 N/A GLN 272.A N LEU 352.A O no hydrogen 3.005 N/A GLN 272.A NE2 SER 273.A O no hydrogen 3.064 N/A SER 273.A OG ASP 394.A OD2 no hydrogen 2.284 N/A TYR 274.A N GLY 350.A O no hydrogen 3.075 N/A LEU 275.A N TYR 379.A O no hydrogen 3.213 N/A ILE 276.A N PHE 348.A O no hydrogen 2.963 N/A THR 277.A N LYS 377.A O no hydrogen 2.835 N/A LEU 278.A N TRP 346.A O no hydrogen 2.751 N/A LYS 280.A N ASP 283.A OD2 no hydrogen 2.831 N/A ASP 283.A N LYS 280.A O no hydrogen 2.721 N/A LYS 285.A N GLY 282.A O no hydrogen 3.002 N/A GLN 286.A NE2 ALA 372.A O no hydrogen 3.300 N/A ALA 287.A N ASP 283.A O no hydrogen 2.766 N/A VAL 288.A N LEU 284.A O no hydrogen 3.441 N/A ASP 289.A N LYS 285.A O no hydrogen 3.489 N/A ILE 290.A N GLN 286.A O no hydrogen 2.850 N/A ILE 291.A N ALA 287.A O no hydrogen 2.592 N/A ARG 292.A N VAL 288.A O no hydrogen 2.736 N/A ARG 295.A N ILE 291.A O no hydrogen 3.159 N/A LEU 296.A N ARG 292.A O no hydrogen 3.369 N/A GLY 297.A N PRO 293.A O no hydrogen 2.711 N/A MET 298.A N ARG 295.A O no hydrogen 2.736 N/A ALA 299.A N LEU 294.A O no hydrogen 2.592 N/A LEU 300.A N LEU 294.A O no hydrogen 2.825 N/A GLN 301.A NE2 TYR 353.A O no hydrogen 2.940 N/A ASN 302.A ND2 TYR 182.A O no hydrogen 2.893 N/A VAL 303.A N TYR 182.A O no hydrogen 3.257 N/A THR 305.A N TYR 349.A O no hydrogen 3.336 N/A ILE 306.A N PHE 453.A O no hydrogen 3.062 N/A ARG 307.A N ASN 347.A O no hydrogen 2.843 N/A HIS 308.A N GLY 451.A O no hydrogen 3.029 N/A ILE 309.A N ARG 345.A O no hydrogen 3.211 N/A LEU 310.A N HIS 308.A ND1 no hydrogen 3.318 N/A LEU 311.A N HIS 308.A O no hydrogen 2.738 N/A ALA 313.A N ILE 309.A O no hydrogen 2.618 N/A ALA 314.A N LEU 310.A O no hydrogen 2.295 N/A VAL 315.A N LEU 311.A O no hydrogen 2.738 N/A LEU 316.A N ASP 312.A O no hydrogen 2.745 N/A GLY 317.A N ALA 313.A O no hydrogen 2.749 N/A LYS 319.A N TRP 411.A O no hydrogen 3.096 N/A LYS 319.A NZ ARG 325.A O no hydrogen 3.405 N/A LYS 319.A NZ GLU 327.A O no hydrogen 2.880 N/A LYS 319.A NZ ASP 448.A OD2 no hydrogen 3.012 N/A SER 321.A N ASP 318.A OD1 no hydrogen 2.345 N/A SER 321.A OG ASP 318.A O no hydrogen 2.501 N/A SER 321.A OG ASP 318.A OD1 no hydrogen 2.780 N/A TYR 322.A N LYS 319.A O no hydrogen 2.975 N/A TYR 322.A OH ALA 313.A O no hydrogen 2.482 N/A SER 323.A N LYS 319.A O no hydrogen 2.873 N/A SER 323.A N ARG 320.A O no hydrogen 3.114 N/A SER 323.A OG GLU 333.A OE2 no hydrogen 3.336 N/A ARG 325.A NE PRO 328.A O no hydrogen 3.412 N/A LEU 329.A N ASP 448.A OD1 no hydrogen 3.043 N/A SER 330.A N GLU 333.A OE1 no hydrogen 2.981 N/A SER 330.A OG GLU 333.A OE1 no hydrogen 2.411 N/A GLU 333.A N SER 330.A OG no hydrogen 2.454 N/A LYS 336.A N GLU 332.A O no hydrogen 3.145 N/A ILE 337.A N GLU 333.A O no hydrogen 2.555 N/A ALA 338.A N LEU 334.A O no hydrogen 2.239 N/A LYS 339.A N ASP 335.A O no hydrogen 2.742 N/A GLN 340.A N LYS 336.A O no hydrogen 2.911 N/A LEU 341.A N ILE 337.A O no hydrogen 3.194 N/A ASN 342.A N LYS 339.A O no hydrogen 3.077 N/A LEU 343.A N ALA 338.A O no hydrogen 3.137 N/A GLY 344.A N ASN 347.A OD1 no hydrogen 2.929 N/A ARG 345.A N LEU 278.A O no hydrogen 2.484 N/A ARG 345.A NH2 ASP 331.A O no hydrogen 2.808 N/A ARG 345.A NH2 ASP 331.A OD1 no hydrogen 2.278 N/A TRP 346.A N LEU 278.A O no hydrogen 3.342 N/A TRP 346.A NE1 ASP 281.A O no hydrogen 2.553 N/A ASN 347.A N ARG 307.A O no hydrogen 2.689 N/A ASN 347.A ND2 ASP 312.A OD2 no hydrogen 3.323 N/A ASN 347.A ND2 GLY 344.A O no hydrogen 3.566 N/A TYR 349.A N THR 305.A O no hydrogen 3.107 N/A TYR 349.A OH ASP 312.A OD2 no hydrogen 2.906 N/A GLY 350.A N TYR 274.A O no hydrogen 3.331 N/A LEU 352.A N GLN 272.A O no hydrogen 2.783 N/A TYR 353.A N GLN 301.A OE1 no hydrogen 2.708 N/A TYR 353.A OH MET 397.A O no hydrogen 2.426 N/A GLY 354.A N GLY 270.A O no hydrogen 2.567 N/A ILE 358.A N PRO 355.A O no hydrogen 2.615 N/A ARG 359.A N PRO 355.A O no hydrogen 2.965 N/A ARG 359.A NE GLY 354.A O no hydrogen 2.381 N/A ARG 360.A N GLU 356.A O no hydrogen 2.704 N/A VAL 361.A N PRO 357.A O no hydrogen 3.470 N/A LEU 362.A N ILE 358.A O no hydrogen 3.027 N/A TRP 363.A N ARG 359.A O no hydrogen 2.895 N/A GLU 364.A N ARG 360.A O no hydrogen 3.103 N/A THR 365.A N VAL 361.A O no hydrogen 3.002 N/A THR 365.A OG1 VAL 361.A O no hydrogen 2.702 N/A THR 365.A OG1 LEU 362.A O no hydrogen 3.273 N/A ILE 366.A N LEU 362.A O no hydrogen 2.840 N/A LYS 367.A N TRP 363.A O no hydrogen 2.657 N/A ASP 368.A N GLU 364.A O no hydrogen 2.452 N/A PHE 370.A N ILE 366.A O no hydrogen 2.788 N/A SER 371.A OG LYS 367.A O no hydrogen 2.982 N/A ILE 373.A N PHE 370.A O no hydrogen 3.265 N/A TYR 379.A N LEU 275.A O no hydrogen 2.809 N/A ASP 383.A N PHE 380.A O no hydrogen 2.400 N/A THR 384.A N PRO 381.A O no hydrogen 3.115 N/A THR 384.A OG1 PRO 381.A O no hydrogen 2.711 N/A THR 384.A OG1 SER 388.A OG no hydrogen 3.079 N/A SER 388.A N PRO 385.A O no hydrogen 3.344 N/A SER 388.A OG THR 384.A OG1 no hydrogen 3.079 N/A ARG 391.A N SER 388.A O no hydrogen 3.057 N/A ARG 391.A N SER 388.A OG no hydrogen 3.051 N/A ARG 391.A NE PRO 381.A O no hydrogen 3.051 N/A ARG 391.A NH2 PRO 381.A O no hydrogen 2.708 N/A ARG 393.A N VAL 389.A O no hydrogen 2.886 N/A ARG 393.A NH1 ASP 165.A OD1 no hydrogen 2.785 N/A ARG 393.A NH1 GLU 405.A OE2 no hydrogen 2.973 N/A ASP 394.A N LEU 390.A O no hydrogen 2.976 N/A ASP 394.A N ARG 391.A O no hydrogen 2.967 N/A THR 396.A N VAL 392.A O no hydrogen 2.892 N/A THR 396.A OG1 ILE 400.A O no hydrogen 3.128 N/A MET 397.A N ARG 393.A O no hydrogen 2.705 N/A GLN 398.A N LYS 395.A O no hydrogen 2.995 N/A GLN 398.A NE2 ASP 394.A O no hydrogen 2.704 N/A GLY 399.A N THR 396.A O no hydrogen 3.096 N/A ILE 400.A N LYS 395.A O no hydrogen 2.607 N/A THR 402.A OG1 ASP 165.A O no hydrogen 2.991 N/A TYR 403.A N ASP 404.A OD1 no hydrogen 3.346 N/A TYR 403.A OH HIS 144.A ND1 no hydrogen 2.258 N/A LYS 407.A N ASP 404.A O no hydrogen 3.242 N/A TRP 408.A N GLU 405.A O no hydrogen 2.859 N/A ILE 409.A N LEU 406.A O no hydrogen 2.494 N/A ASP 410.A N LYS 407.A O no hydrogen 2.920 N/A TRP 411.A N TRP 408.A O no hydrogen 3.369 N/A TRP 411.A NE1 ASP 448.A OD2 no hydrogen 3.089 N/A PHE 420.A N VAL 464.A O no hydrogen 3.104 N/A SER 421.A OG GLU 497.A OE2 no hydrogen 2.583 N/A ALA 424.A N MET 460.A O no hydrogen 2.694 N/A GLY 428.A N ASP 289.A OD1 no hydrogen 3.425 N/A ALA 431.A N SER 427.A O no hydrogen 2.566 N/A MET 432.A N GLY 428.A O no hydrogen 2.856 N/A MET 433.A N GLU 429.A O no hydrogen 2.531 N/A GLN 434.A N ASP 430.A O no hydrogen 2.569 N/A TYR 435.A N ALA 431.A O no hydrogen 3.110 N/A TYR 435.A OH ASP 281.A OD1 no hydrogen 2.578 N/A ALA 436.A N MET 432.A O no hydrogen 2.908 N/A THR 438.A N GLN 434.A O no hydrogen 3.258 N/A THR 438.A OG1 GLN 434.A O no hydrogen 2.839 N/A THR 438.A OG1 TYR 435.A O no hydrogen 2.832 N/A LYS 439.A N TYR 435.A O no hydrogen 2.669 N/A LYS 439.A NZ ASP 281.A OD2 no hydrogen 3.133 N/A LYS 440.A N ALA 436.A O no hydrogen 2.917 N/A ARG 441.A N VAL 437.A O no hydrogen 3.327 N/A ARG 441.A NE ASP 489.A OD2 no hydrogen 3.156 N/A CYS 442.A N THR 438.A O no hydrogen 3.236 N/A CYS 442.A SG THR 438.A O no hydrogen 2.848 N/A GLN 443.A N LYS 439.A O no hydrogen 2.712 N/A GLU 444.A N LYS 440.A O no hydrogen 3.011 N/A ALA 445.A N ARG 441.A O no hydrogen 2.515 N/A GLY 446.A N GLN 443.A O no hydrogen 2.339 N/A LEU 447.A N CYS 442.A O no hydrogen 2.493 N/A PHE 453.A N ILE 306.A O no hydrogen 3.229 N/A THR 454.A N HIS 461.A O no hydrogen 3.074 N/A VAL 455.A N PRO 304.A O no hydrogen 2.556 N/A ARG 458.A N GLU 459.A OE1 no hydrogen 3.360 N/A MET 460.A N ALA 424.A O no hydrogen 2.373 N/A HIS 461.A N THR 454.A O no hydrogen 3.157 N/A HIS 462.A N PRO 422.A O no hydrogen 3.215 N/A ILE 463.A N THR 452.A O no hydrogen 2.731 N/A VAL 464.A N PHE 420.A O no hydrogen 2.710 N/A CYS 465.A N ILE 450.A O no hydrogen 2.623 N/A CYS 465.A SG ILE 463.A O no hydrogen 3.389 N/A ILE 466.A N LEU 418.A O no hydrogen 2.825 N/A ASN 469.A N GLN 475.A OE1 no hydrogen 3.437 N/A LYS 470.A N ASN 414.A O no hydrogen 3.310 N/A LYS 471.A N ASN 469.A OD1 no hydrogen 3.005 N/A ASP 472.A N ASN 469.A O no hydrogen 3.364 N/A GLN 475.A N ASP 472.A OD1 no hydrogen 2.629 N/A LYS 476.A N ASP 472.A O no hydrogen 3.059 N/A LYS 476.A NZ LYS 470.A O no hydrogen 2.766 N/A ARG 477.A N LEU 473.A O no hydrogen 3.218 N/A LYS 478.A N ILE 474.A O no hydrogen 3.187 N/A VAL 479.A N GLN 475.A O no hydrogen 2.676 N/A GLN 480.A N LYS 476.A O no hydrogen 2.934 N/A TRP 481.A N ARG 477.A O no hydrogen 2.813 N/A LEU 482.A N LYS 478.A O no hydrogen 2.797 N/A MET 483.A N VAL 479.A O no hydrogen 2.652 N/A ARG 484.A N GLN 480.A O no hydrogen 3.026 N/A ARG 484.A NE GLN 507.A OE1 no hydrogen 2.399 N/A ARG 484.A NH2 ALA 503.A O no hydrogen 3.112 N/A THR 485.A N TRP 481.A O no hydrogen 2.831 N/A THR 485.A OG1 TRP 481.A O no hydrogen 2.184 N/A LEU 486.A N LEU 482.A O no hydrogen 2.670 N/A ILE 487.A N MET 483.A O no hydrogen 2.832 N/A ASP 488.A N ARG 484.A O no hydrogen 3.319 N/A ASP 489.A N THR 485.A O no hydrogen 3.157 N/A CYS 490.A N LEU 486.A O no hydrogen 2.760 N/A CYS 490.A SG LEU 486.A O no hydrogen 3.230 N/A ALA 491.A N ILE 487.A O no hydrogen 3.113 N/A ALA 492.A N ASP 488.A O no hydrogen 2.964 N/A ASN 493.A N ASP 489.A O no hydrogen 2.920 N/A ASN 493.A N CYS 490.A O no hydrogen 2.822 N/A ASN 493.A ND2 ASP 489.A O no hydrogen 2.697 N/A GLY 494.A N ALA 491.A O no hydrogen 2.800 N/A TRP 495.A N CYS 490.A O no hydrogen 3.001 N/A HIS 501.A NE2 ASP 54.A OD2 no hydrogen 2.936 N/A LEU 502.A N TYR 103.A O no hydrogen 2.865 N/A ALA 503.A N HIS 501.A ND1 no hydrogen 2.479 N/A PHE 504.A N HIS 501.A O no hydrogen 3.165 N/A MET 505.A N LEU 502.A O no hydrogen 3.300 N/A GLN 507.A NE2 ARG 484.A O no hydrogen 2.637 N/A GLN 507.A NE2 ASP 488.A OD1 no hydrogen 2.981 N/A ILE 508.A N PHE 504.A O no hydrogen 2.634 N/A MET 509.A N MET 505.A O no hydrogen 2.669 N/A GLU 510.A N ASP 506.A O no hydrogen 2.780 N/A THR 511.A N ILE 508.A O no hydrogen 3.086 N/A THR 511.A OG1 ILE 508.A O no hydrogen 3.160 N/A TYR 512.A N MET 509.A O no hydrogen 3.192 N/A TYR 512.A OH GLU 497.A O no hydrogen 2.935 N/A ASN 513.A ND2 GLU 510.A OE2 no hydrogen 3.038 N/A SER 517.A N ASN 513.A O no hydrogen 3.308 N/A ARG 521.A N SER 517.A O no hydrogen 2.615 N/A ARG 521.A NH1 GLU 524.A OE1 no hydrogen 2.667 N/A PHE 522.A N SER 518.A O no hydrogen 3.095 N/A ASN 523.A N PHE 519.A O no hydrogen 2.898 N/A ASN 523.A ND2 PHE 519.A O no hydrogen 2.738 N/A GLU 524.A N LEU 520.A O no hydrogen 2.794 N/A VAL 525.A N ARG 521.A O no hydrogen 2.993 N/A LEU 526.A N PHE 522.A O no hydrogen 3.050 N/A LYS 527.A N ASN 523.A O no hydrogen 2.822 N/A LYS 527.A NZ ASN 253.A O no hydrogen 3.089 N/A LYS 527.A NZ ASP 531.A OD2 no hydrogen 2.752 N/A LYS 527.A NZ ILE 536.A O no hydrogen 2.322 N/A ASN 528.A N GLU 524.A O no hydrogen 2.712 N/A ALA 529.A N VAL 525.A O no hydrogen 3.062 N/A VAL 530.A N LEU 526.A O no hydrogen 3.057 N/A ASP 531.A N LYS 527.A O no hydrogen 2.596 N/A ASP 531.A N ASN 528.A O no hydrogen 3.107 N/A GLY 534.A N ASP 531.A O no hydrogen 2.506 N/A ILE 535.A N ASP 531.A OD1 no hydrogen 3.306 N/A ILE 536.A N ASP 531.A OD2 no hydrogen 2.753 N/A ALA 537.A N LEU 92.A O no hydrogen 2.741 N/A GLY 539.A N VAL 543.A O no hydrogen 2.874 N/A LYS 540.A N ALA 537.A O no hydrogen 3.334 N/A LYS 540.A NZ GLU 177.A OE1 no hydrogen 3.252 N/A LYS 540.A NZ GLU 177.A OE2 no hydrogen 3.453 N/A SER 541.A OG GLN 251.A O no hydrogen 2.842 N/A VAL 543.A N LYS 540.A O no hydrogen 2.669 N/A SER 546.A N ASN 528.A OD1 no hydrogen 3.351 N/A SER 546.A OG GLN 547.A OE1 no hydrogen 3.197 N/A GLN 547.A NE2 ASN 528.A OD1 no hydrogen 2.606 N/A TYR 548.A N PRO 545.A O no hydrogen 2.615 N/A SER 549.A OG THR 552.A OG1 no hydrogen 2.852 N/A THR 552.A N SER 549.A OG no hydrogen 2.591 N/A THR 552.A OG1 SER 549.A OG no hydrogen 2.852 N/A TRP 553.A N SER 549.A O no hydrogen 2.599 N/A LYS 554.A N HIS 550.A O no hydrogen 2.865 N/A