Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ahc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LYS 21.A O no hydrogen 2.508 N/A LEU 3.A N PHE 19.A O no hydrogen 2.920 N/A ASP 4.A N PHE 19.A O no hydrogen 3.447 N/A ASP 6.A N ARG 17.A O no hydrogen 3.266 N/A ILE 8.A N VAL 15.A O no hydrogen 2.852 N/A GLU 10.A N LYS 13.A O no hydrogen 2.873 N/A LYS 13.A N GLU 10.A O no hydrogen 3.038 N/A VAL 15.A N ILE 8.A O no hydrogen 2.738 N/A ILE 16.A N ASP 31.A O no hydrogen 3.059 N/A ARG 17.A N ASP 6.A O no hydrogen 3.062 N/A ARG 17.A NE ASP 6.A OD1 no hydrogen 3.180 N/A ARG 17.A NH2 ASP 6.A OD2 no hydrogen 3.036 N/A LEU 18.A N GLU 29.A O no hydrogen 2.876 N/A PHE 19.A N ASP 4.A O no hydrogen 2.991 N/A LYS 20.A N LYS 27.A O no hydrogen 2.981 N/A LYS 20.A NZ GLU 29.A OE1 no hydrogen 2.682 N/A LYS 21.A N MET 1.A O no hydrogen 2.903 N/A LYS 21.A NZ ASP 204.A OD1 no hydrogen 2.745 N/A LYS 21.A NZ ASP 204.A OD2 no hydrogen 2.816 N/A GLU 22.A N LYS 25.A O no hydrogen 2.850 N/A ASN 23.A N GLU 133.A OE2 no hydrogen 3.092 N/A GLY 24.A N GLU 133.A OE1 no hydrogen 3.047 N/A LYS 25.A N GLU 22.A O no hydrogen 3.130 N/A LYS 27.A N LYS 20.A O no hydrogen 3.225 N/A GLU 29.A N LEU 18.A O no hydrogen 3.053 N/A ASP 31.A N ILE 16.A O no hydrogen 2.863 N/A ARG 32.A NH2 GLU 10.A OE1 no hydrogen 3.050 N/A THR 33.A N ASP 31.A OD1 no hydrogen 2.978 N/A THR 33.A OG1 ASP 31.A OD1 no hydrogen 3.305 N/A TYR 37.A OH ASP 123.A OD2 no hydrogen 2.697 N/A ILE 38.A N LEU 85.A O no hydrogen 3.050 N/A TYR 39.A N PHE 110.A O no hydrogen 3.174 N/A ALA 40.A N TRP 83.A O no hydrogen 2.809 N/A LEU 41.A N ASP 108.A O no hydrogen 2.981 N/A ARG 43.A N ALA 105.A O no hydrogen 2.706 N/A SER 46.A N ASP 44.A OD1 no hydrogen 2.842 N/A SER 46.A OG ASP 44.A OD1 no hydrogen 2.858 N/A SER 46.A OG ASP 44.A OD2 no hydrogen 2.724 N/A LYS 47.A N ASP 44.A O no hydrogen 3.272 N/A ILE 48.A N ASP 45.A O no hydrogen 3.379 N/A GLU 50.A N LYS 47.A O no hydrogen 2.918 N/A VAL 51.A N LYS 47.A O no hydrogen 3.237 N/A LYS 52.A N ILE 48.A O no hydrogen 2.763 N/A ILE 54.A N VAL 51.A O no hydrogen 3.283 N/A THR 55.A OG1 GLY 56.A O no hydrogen 3.376 N/A THR 55.A OG1 VAL 63.A O no hydrogen 3.422 N/A GLY 56.A N VAL 63.A O no hydrogen 2.752 N/A GLU 57.A N THR 95.A OG1 no hydrogen 3.069 N/A ARG 58.A N LYS 61.A O no hydrogen 3.449 N/A ARG 58.A NE ASP 92.A OD1 no hydrogen 2.778 N/A ARG 58.A NH2 ASP 92.A OD1 no hydrogen 2.898 N/A LYS 61.A N ARG 58.A O no hydrogen 2.925 N/A VAL 63.A N GLY 56.A O no hydrogen 3.173 N/A VAL 66.A N TYR 86.A O no hydrogen 3.172 N/A LYS 70.A NZ ASP 45.A OD2 no hydrogen 3.517 N/A VAL 71.A N VAL 82.A O no hydrogen 3.074 N/A GLU 72.A N GLU 72.A OE1 no hydrogen 2.606 N/A LYS 73.A N ILE 80.A O no hydrogen 2.894 N/A LYS 73.A NZ TYR 39.A OH no hydrogen 3.355 N/A LYS 73.A NZ ASN 365.A OD1 no hydrogen 3.220 N/A LYS 74.A N ASN 365.A O no hydrogen 3.353 N/A LYS 74.A NZ ARG 364.A O no hydrogen 3.203 N/A PHE 75.A N LYS 78.A O no hydrogen 2.979 N/A GLY 77.A N GLU 366.A OE2 no hydrogen 2.784 N/A ILE 80.A N LYS 73.A O no hydrogen 2.802 N/A VAL 82.A N VAL 71.A O no hydrogen 3.145 N/A TRP 83.A N ALA 40.A O no hydrogen 2.868 N/A LYS 84.A N GLU 69.A O no hydrogen 2.904 N/A LYS 84.A NZ TYR 86.A OH no hydrogen 3.247 N/A LEU 85.A N ILE 38.A O no hydrogen 2.758 N/A TYR 86.A N ASP 67.A O no hydrogen 2.748 N/A TYR 86.A OH GLU 69.A OE1 no hydrogen 3.363 N/A LEU 87.A N PRO 36.A O no hydrogen 2.991 N/A HIS 89.A N ASP 92.A OD2 no hydrogen 3.432 N/A GLN 91.A NE2 TYR 7.A OH no hydrogen 3.550 N/A ASP 92.A N HIS 89.A O no hydrogen 3.121 N/A GLN 93.A N PRO 90.A O no hydrogen 3.167 N/A THR 95.A OG1 GLU 57.A O no hydrogen 3.324 N/A ILE 96.A N ASP 92.A O no hydrogen 3.072 N/A ARG 97.A N GLN 93.A O no hydrogen 2.885 N/A GLU 98.A N PRO 94.A O no hydrogen 3.047 N/A LYS 99.A N THR 95.A O no hydrogen 3.383 N/A VAL 100.A N ILE 96.A O no hydrogen 3.002 N/A ARG 101.A N ARG 97.A O no hydrogen 3.154 N/A ARG 101.A NH2 ASP 108.A OD1 no hydrogen 2.822 N/A HIS 103.A N VAL 100.A O no hydrogen 3.302 N/A VAL 106.A N HIS 103.A O no hydrogen 3.199 N/A VAL 107.A N LEU 41.A O no hydrogen 2.704 N/A ILE 109.A N ASP 108.A OD1 no hydrogen 2.856 N/A PHE 110.A N TYR 39.A O no hydrogen 3.160 N/A ARG 119.A N PRO 115.A O no hydrogen 2.835 N/A ARG 119.A NE ARG 119.A O no hydrogen 3.489 N/A ARG 119.A NE ASP 123.A OD1 no hydrogen 2.825 N/A ARG 119.A NH1 GLU 111.A OE1 no hydrogen 2.862 N/A ARG 119.A NH2 ASP 123.A OD1 no hydrogen 2.687 N/A TYR 120.A N PHE 116.A O no hydrogen 2.987 N/A TYR 120.A OH ASP 31.A OD2 no hydrogen 2.558 N/A LEU 121.A N ALA 117.A O no hydrogen 3.447 N/A ILE 122.A N LYS 118.A O no hydrogen 3.167 N/A ASP 123.A N ARG 119.A O no hydrogen 3.108 N/A LYS 124.A N TYR 120.A O no hydrogen 2.949 N/A GLY 125.A N ILE 122.A O no hydrogen 3.336 N/A LEU 126.A N LEU 121.A O no hydrogen 2.915 N/A MET 129.A N ILE 2.A O no hydrogen 3.077 N/A LYS 136.A N ASP 204.A OD2 no hydrogen 2.755 N/A LEU 138.A N ILE 205.A O no hydrogen 3.115 N/A ALA 139.A N ALA 163.A O no hydrogen 2.906 N/A PHE 140.A N VAL 207.A O no hydrogen 3.214 N/A ALA 141.A N SER 161.A O no hydrogen 3.029 N/A ALA 143.A N MET 159.A O no hydrogen 2.885 N/A LEU 145.A N PRO 156.A O no hydrogen 3.152 N/A GLU 150.A N GLU 148.A O no hydrogen 2.762 N/A LYS 154.A N GLU 151.A O no hydrogen 3.524 N/A LYS 154.A NZ GLU 151.A OE2 no hydrogen 2.970 N/A ILE 157.A N GLU 187.A OE2 no hydrogen 2.629 N/A ILE 158.A N ALA 143.A O no hydrogen 2.714 N/A MET 159.A N ALA 143.A O no hydrogen 3.188 N/A ILE 160.A N ILE 171.A O no hydrogen 2.885 N/A SER 161.A N ALA 141.A O no hydrogen 2.946 N/A SER 161.A OG ALA 141.A O no hydrogen 3.199 N/A SER 161.A OG SER 312.A O no hydrogen 2.644 N/A SER 161.A OG SER 312.A OG no hydrogen 3.113 N/A TYR 162.A N LYS 169.A O no hydrogen 2.912 N/A TYR 162.A OH GLU 182.A OE2 no hydrogen 2.747 N/A ALA 163.A N ALA 139.A O no hydrogen 2.987 N/A ASP 164.A N GLU 167.A O no hydrogen 2.929 N/A ASN 166.A N ASP 164.A OD1 no hydrogen 3.031 N/A GLU 167.A N ASP 164.A OD1 no hydrogen 2.962 N/A LYS 169.A N TYR 162.A O no hydrogen 2.850 N/A LYS 169.A NZ PRO 179.A O no hydrogen 3.471 N/A VAL 170.A N TYR 180.A O no hydrogen 2.946 N/A ILE 171.A N ILE 160.A O no hydrogen 2.828 N/A THR 172.A N GLU 182.A O no hydrogen 2.960 N/A THR 172.A OG1 ILE 158.A O no hydrogen 3.027 N/A TRP 173.A NE1 ILE 157.A O no hydrogen 3.149 N/A LYS 174.A NZ TRP 299.A O no hydrogen 3.144 N/A GLU 182.A N VAL 170.A O no hydrogen 2.688 N/A VAL 184.A N THR 172.A O no hydrogen 2.792 N/A MET 190.A N SER 186.A O no hydrogen 2.890 N/A ILE 191.A N GLU 187.A O no hydrogen 3.022 N/A LYS 192.A N ARG 188.A O no hydrogen 3.097 N/A LYS 192.A NZ GLU 189.A OE2 no hydrogen 2.692 N/A ARG 193.A N GLU 189.A O no hydrogen 2.773 N/A PHE 194.A N MET 190.A O no hydrogen 3.125 N/A LEU 195.A N ILE 191.A O no hydrogen 3.061 N/A ARG 196.A N LYS 192.A O no hydrogen 3.075 N/A ILE 197.A N ARG 193.A O no hydrogen 2.911 N/A ILE 198.A N PHE 194.A O no hydrogen 3.079 N/A ARG 199.A N LEU 195.A O no hydrogen 2.988 N/A GLU 200.A N ARG 196.A O no hydrogen 2.741 N/A LYS 201.A N ILE 197.A O no hydrogen 2.880 N/A LYS 201.A NZ ASP 164.A OD2 no hydrogen 2.741 N/A LYS 201.A NZ GLU 167.A OE2 no hydrogen 3.259 N/A ASP 202.A N ILE 198.A O no hydrogen 2.859 N/A ASP 204.A N LYS 136.A O no hydrogen 2.706 N/A ILE 205.A N LYS 136.A O no hydrogen 3.238 N/A ILE 206.A N ILE 256.A O no hydrogen 2.948 N/A VAL 207.A N LEU 138.A O no hydrogen 2.836 N/A THR 208.A N PHE 258.A O no hydrogen 3.103 N/A TYR 209.A OH TYR 273.A O no hydrogen 2.711 N/A ASN 210.A N ASP 259.A OD1 no hydrogen 2.888 N/A ASP 212.A N ASP 259.A OD2 no hydrogen 2.976 N/A PHE 214.A N ASN 210.A O no hydrogen 3.248 N/A PHE 216.A N GLY 211.A O no hydrogen 3.088 N/A TYR 218.A N PHE 214.A O no hydrogen 3.102 N/A TYR 218.A OH GLY 155.A O no hydrogen 2.590 N/A LEU 219.A N ASP 215.A O no hydrogen 3.114 N/A ALA 220.A N PHE 216.A O no hydrogen 2.916 N/A LYS 221.A N PRO 217.A O no hydrogen 3.035 N/A ARG 222.A N TYR 218.A O no hydrogen 3.164 N/A ARG 222.A NE GLY 153.A O no hydrogen 2.756 N/A ARG 222.A NH1 GLU 187.A OE1 no hydrogen 3.117 N/A ARG 222.A NH1 GLU 187.A OE2 no hydrogen 3.531 N/A ARG 222.A NH2 GLY 153.A O no hydrogen 2.863 N/A ALA 223.A N LEU 219.A O no hydrogen 2.876 N/A GLU 224.A N ALA 220.A O no hydrogen 2.864 N/A LYS 225.A N LYS 221.A O no hydrogen 3.166 N/A LEU 226.A N ARG 222.A O no hydrogen 2.999 N/A GLY 227.A N GLU 224.A O no hydrogen 3.290 N/A ILE 228.A N ALA 223.A O no hydrogen 2.958 N/A LEU 230.A N GLU 238.A OE2 no hydrogen 2.988 N/A ILE 232.A N LEU 230.A O no hydrogen 2.784 N/A GLY 233.A N SER 237.A O no hydrogen 3.086 N/A ARG 234.A N LYS 253.A O no hydrogen 2.900 N/A ARG 234.A NE ASP 202.A OD1 no hydrogen 3.029 N/A ARG 234.A NH1 ASP 204.A OD1 no hydrogen 3.245 N/A ARG 234.A NH1 GLY 254.A O no hydrogen 3.312 N/A ARG 234.A NH2 ASP 202.A O no hydrogen 3.336 N/A ARG 234.A NH2 ASP 202.A OD1 no hydrogen 3.452 N/A ARG 234.A NH2 ASP 204.A OD1 no hydrogen 2.868 N/A GLY 236.A N GLY 233.A O no hydrogen 3.162 N/A SER 237.A N ASP 235.A OD1 no hydrogen 3.079 N/A SER 237.A OG ASP 235.A OD1 no hydrogen 2.614 N/A LYS 240.A N GLU 251.A O no hydrogen 2.928 N/A GLN 242.A N ALA 249.A O no hydrogen 2.688 N/A ARG 243.A NH1 THR 248.A OG1 no hydrogen 2.784 N/A ILE 244.A N MET 247.A O no hydrogen 3.304 N/A ALA 249.A N GLN 242.A O no hydrogen 2.590 N/A VAL 250.A N ASP 212.A OD1 no hydrogen 2.951 N/A GLU 251.A N LYS 240.A O no hydrogen 2.729 N/A ARG 255.A N VAL 252.A O no hydrogen 3.264 N/A ARG 255.A NE ILE 232.A O no hydrogen 2.868 N/A ARG 255.A NH1 ASP 202.A OD1 no hydrogen 2.741 N/A ARG 255.A NH1 PRO 203.A O no hydrogen 2.758 N/A ARG 255.A NH2 ILE 232.A O no hydrogen 3.170 N/A ILE 256.A N ASP 204.A O no hydrogen 3.042 N/A PHE 258.A N ILE 206.A O no hydrogen 2.698 N/A LEU 260.A N THR 208.A O no hydrogen 2.690 N/A TYR 261.A N ASP 259.A OD1 no hydrogen 2.975 N/A HIS 262.A NE2 ASP 212.A OD2 no hydrogen 2.740 N/A VAL 263.A N LEU 260.A O no hydrogen 3.224 N/A ILE 264.A N LEU 260.A O no hydrogen 3.297 N/A THR 265.A N TYR 261.A O no hydrogen 3.357 N/A THR 265.A OG1 TYR 261.A O no hydrogen 3.398 N/A THR 265.A OG1 HIS 262.A O no hydrogen 2.665 N/A ARG 266.A NE SER 347.A O no hydrogen 3.096 N/A ARG 266.A NH2 GLU 330.A OE2 no hydrogen 2.564 N/A THR 267.A OG1 VAL 263.A O no hydrogen 2.859 N/A ILE 268.A N ILE 264.A O no hydrogen 3.364 N/A TYR 273.A OH ILE 268.A O no hydrogen 3.192 N/A ALA 277.A N THR 274.A OG1 no hydrogen 3.283 N/A VAL 278.A N THR 274.A O no hydrogen 3.078 N/A TYR 279.A N LEU 275.A O no hydrogen 3.294 N/A TYR 279.A OH GLU 321.A OE1 no hydrogen 2.693 N/A GLU 280.A N GLU 276.A O no hydrogen 3.221 N/A ALA 281.A N ALA 277.A O no hydrogen 2.905 N/A ILE 282.A N VAL 278.A O no hydrogen 3.102 N/A PHE 283.A N TYR 279.A O no hydrogen 2.927 N/A GLY 284.A N GLU 280.A O no hydrogen 2.798 N/A LYS 287.A NZ ASP 315.A OD1 no hydrogen 2.893 N/A ILE 295.A N TYR 291.A O no hydrogen 2.980 N/A ALA 296.A N ALA 292.A O no hydrogen 2.838 N/A LYS 297.A N ASP 293.A O no hydrogen 3.103 N/A ALA 298.A N GLU 294.A O no hydrogen 3.255 N/A TRP 299.A N ILE 295.A O no hydrogen 2.946 N/A SER 301.A OG LYS 297.A O no hydrogen 2.680 N/A GLY 302.A N ALA 298.A O no hydrogen 3.352 N/A ALA 309.A N LEU 305.A O no hydrogen 3.032 N/A LYS 310.A N GLU 306.A O no hydrogen 2.999 N/A LYS 310.A NZ GLU 314.A OE2 no hydrogen 3.484 N/A TYR 311.A N ARG 307.A O no hydrogen 3.286 N/A TYR 311.A OH GLU 276.A OE2 no hydrogen 3.096 N/A SER 312.A N VAL 308.A O no hydrogen 2.961 N/A SER 312.A OG SER 161.A OG no hydrogen 3.113 N/A MET 313.A N ALA 309.A O no hydrogen 3.036 N/A GLU 314.A N LYS 310.A O no hydrogen 2.930 N/A ASP 315.A N TYR 311.A O no hydrogen 2.971 N/A ALA 316.A N SER 312.A O no hydrogen 3.365 N/A LYS 317.A N MET 313.A O no hydrogen 2.912 N/A LYS 317.A NZ GLU 321.A OE2 no hydrogen 3.115 N/A ALA 318.A N GLU 314.A O no hydrogen 2.710 N/A THR 319.A N ASP 315.A O no hydrogen 3.155 N/A THR 319.A OG1 ASP 315.A O no hydrogen 2.772 N/A TYR 320.A N ALA 316.A O no hydrogen 3.161 N/A GLU 321.A N LYS 317.A O no hydrogen 3.289 N/A LEU 322.A N ALA 318.A O no hydrogen 2.824 N/A GLY 323.A N THR 319.A O no hydrogen 2.805 N/A LYS 324.A N TYR 320.A O no hydrogen 2.787 N/A LYS 324.A NZ TYR 320.A OH no hydrogen 3.239 N/A GLU 325.A N LEU 322.A O no hydrogen 2.988 N/A PHE 326.A N LEU 322.A O no hydrogen 3.040 N/A LEU 327.A N GLY 323.A O no hydrogen 3.033 N/A GLU 330.A N PHE 326.A O no hydrogen 3.137 N/A ILE 331.A N LEU 327.A O no hydrogen 2.896 N/A LEU 333.A N MET 329.A O no hydrogen 3.263 N/A SER 334.A N GLU 330.A O no hydrogen 3.057 N/A SER 334.A OG GLU 330.A O no hydrogen 3.294 N/A SER 334.A OG ILE 331.A O no hydrogen 2.686 N/A ARG 335.A N ILE 331.A O no hydrogen 2.923 N/A LEU 336.A N LEU 333.A O no hydrogen 2.807 N/A ILE 337.A N LEU 333.A O no hydrogen 2.602 N/A GLY 338.A N SER 334.A O no hydrogen 2.880 N/A GLN 339.A N SER 334.A O no hydrogen 3.264 N/A TRP 342.A NE1 VAL 250.A O no hydrogen 2.996 N/A VAL 344.A N PRO 340.A O no hydrogen 2.932 N/A SER 345.A N LEU 341.A O no hydrogen 3.122 N/A SER 345.A OG LEU 341.A O no hydrogen 2.767 N/A SER 345.A OG TRP 342.A O no hydrogen 3.550 N/A ARG 346.A N ASP 343.A O no hydrogen 2.929 N/A ARG 346.A NE TRP 342.A O no hydrogen 2.951 N/A ARG 346.A NH1 ASP 212.A OD2 no hydrogen 2.848 N/A ARG 346.A NH2 HIS 257.A O no hydrogen 2.379 N/A ARG 346.A NH2 TRP 342.A O no hydrogen 3.473 N/A SER 347.A N VAL 344.A O no hydrogen 3.282 N/A SER 347.A OG SER 348.A O no hydrogen 2.976 N/A ASN 351.A ND2 SER 347.A OG no hydrogen 3.325 N/A LEU 352.A N SER 348.A O no hydrogen 2.902 N/A VAL 353.A N THR 349.A O no hydrogen 3.213 N/A GLU 354.A N GLY 350.A O no hydrogen 3.325 N/A TRP 355.A N ASN 351.A O no hydrogen 3.122 N/A PHE 356.A N LEU 352.A O no hydrogen 3.163 N/A LEU 357.A N VAL 353.A O no hydrogen 2.945 N/A LEU 358.A N GLU 354.A O no hydrogen 2.949 N/A ARG 359.A N TRP 355.A O no hydrogen 3.316 N/A ARG 359.A NE ILE 337.A O no hydrogen 3.250 N/A ARG 359.A NH1 LEU 121.A O no hydrogen 3.373 N/A ARG 359.A NH2 LEU 126.A O no hydrogen 3.061 N/A ARG 359.A NH2 GLY 338.A O no hydrogen 2.681 N/A LYS 360.A N PHE 356.A O no hydrogen 3.063 N/A ALA 361.A N LEU 357.A O no hydrogen 2.780 N/A TYR 362.A N LEU 358.A O no hydrogen 3.371 N/A GLU 363.A N ARG 359.A O no hydrogen 3.190 N/A ARG 364.A N LYS 360.A O no hydrogen 2.942 N/A ARG 364.A NH2 SER 452.A OG no hydrogen 2.678 N/A ASN 365.A N TYR 362.A O no hydrogen 3.417 N/A ASN 365.A ND2 GLU 72.A O no hydrogen 2.994 N/A GLU 366.A N ALA 361.A O no hydrogen 2.773 N/A VAL 367.A N LYS 74.A O no hydrogen 2.757 N/A ALA 368.A N GLU 111.A OE2 no hydrogen 2.990 N/A ASN 370.A ND2 ILE 109.A O no hydrogen 2.709 N/A GLU 376.A N SER 373.A OG no hydrogen 3.198 N/A TYR 377.A N SER 373.A O no hydrogen 2.659 N/A GLN 378.A N GLU 374.A O no hydrogen 3.109 N/A ARG 379.A N GLU 375.A O no hydrogen 3.143 N/A ARG 380.A N GLU 376.A O no hydrogen 3.089 N/A ARG 380.A NE GLU 376.A OE2 no hydrogen 3.256 N/A ARG 380.A NH1 ALA 501.A O no hydrogen 2.730 N/A ARG 380.A NH1 ALA 503.A O no hydrogen 2.910 N/A LEU 381.A N TYR 377.A O no hydrogen 3.214 N/A ARG 382.A N ARG 379.A O no hydrogen 3.138 N/A TYR 385.A OH TYR 506.A OH no hydrogen 2.845 N/A LYS 391.A N ILE 540.A O no hydrogen 2.995 N/A LYS 391.A NZ GLU 392.A O no hydrogen 2.783 N/A LYS 391.A NZ GLU 394.A OE2 no hydrogen 3.165 N/A GLU 394.A N LEU 538.A O no hydrogen 2.977 N/A LYS 395.A NZ VAL 590.A O no hydrogen 3.345 N/A TRP 398.A N GLY 587.A O no hydrogen 2.919 N/A ASP 400.A N LYS 585.A O no hydrogen 2.795 N/A ILE 401.A N TYR 584.A O no hydrogen 2.713 N/A VAL 402.A N ALA 547.A O no hydrogen 2.801 N/A TYR 403.A N GLY 582.A O no hydrogen 3.051 N/A LEU 404.A N LEU 545.A O no hydrogen 2.955 N/A ASP 405.A N GLU 579.A O no hydrogen 3.314 N/A PHE 406.A N ASP 543.A O no hydrogen 2.844 N/A ILE 407.A N GLU 577.A O no hydrogen 3.055 N/A SER 412.A N ALA 408.A O no hydrogen 2.841 N/A SER 412.A OG ALA 408.A O no hydrogen 3.152 N/A SER 412.A OG LEU 409.A O no hydrogen 2.563 N/A ILE 413.A N LEU 409.A O no hydrogen 2.936 N/A ILE 414.A N TYR 410.A O no hydrogen 3.035 N/A ILE 415.A N PRO 411.A O no hydrogen 3.222 N/A THR 416.A N SER 412.A O no hydrogen 3.034 N/A THR 416.A OG1 SER 412.A O no hydrogen 3.017 N/A THR 416.A OG1 ILE 413.A O no hydrogen 3.126 N/A HIS 417.A N ILE 413.A O no hydrogen 3.161 N/A HIS 417.A ND1 ASP 433.A OD2 no hydrogen 3.112 N/A HIS 417.A NE2 TYR 521.A OH no hydrogen 2.624 N/A ASN 418.A ND2 CYS 443.A O no hydrogen 2.763 N/A ASN 418.A ND2 ILE 446.A O no hydrogen 2.756 N/A VAL 419.A N ILE 414.A O no hydrogen 3.051 N/A SER 420.A OG ASP 422.A OD1 no hydrogen 2.679 N/A SER 420.A OG THR 423.A OG1 no hydrogen 3.209 N/A THR 423.A N SER 420.A O no hydrogen 2.946 N/A THR 423.A OG1 ASN 418.A O no hydrogen 2.727 N/A THR 423.A OG1 SER 420.A O no hydrogen 3.010 N/A THR 423.A OG1 SER 420.A OG no hydrogen 3.209 N/A LEU 424.A N PRO 421.A O no hydrogen 3.257 N/A ASN 425.A N LYS 441.A O no hydrogen 2.768 N/A CYS 429.A SG ASN 431.A O no hydrogen 3.420 N/A LYS 430.A N ASP 445.A OD2 no hydrogen 3.203 N/A ASN 431.A N ASP 445.A OD1 no hydrogen 3.146 N/A ASP 433.A N PHE 442.A O no hydrogen 2.986 N/A ALA 435.A N HIS 440.A O no hydrogen 2.856 N/A GLY 439.A N ALA 435.A O no hydrogen 2.951 N/A LYS 441.A N ASN 425.A OD1 no hydrogen 3.197 N/A PHE 442.A N ASP 433.A O no hydrogen 2.879 N/A CYS 443.A N THR 423.A O no hydrogen 2.960 N/A CYS 443.A SG ASN 431.A O no hydrogen 4.031 N/A LYS 444.A N ASN 431.A O no hydrogen 2.986 N/A LYS 444.A NZ THR 416.A O no hydrogen 2.737 N/A GLY 448.A N ASN 418.A OD1 no hydrogen 2.838 N/A PHE 449.A N ASP 422.A OD2 no hydrogen 3.010 N/A SER 452.A N GLY 448.A O no hydrogen 3.381 N/A LEU 453.A N PHE 449.A O no hydrogen 3.306 N/A LEU 454.A N ILE 450.A O no hydrogen 2.983 N/A GLY 455.A N PRO 451.A O no hydrogen 3.068 N/A HIS 456.A N SER 452.A O no hydrogen 3.107 N/A LEU 457.A N LEU 453.A O no hydrogen 2.961 N/A LEU 458.A N LEU 454.A O no hydrogen 2.999 N/A GLU 459.A N GLY 455.A O no hydrogen 3.186 N/A GLU 460.A N HIS 456.A O no hydrogen 3.002 N/A ARG 461.A N LEU 457.A O no hydrogen 3.111 N/A ARG 461.A NE GLN 484.A O no hydrogen 3.370 N/A ARG 461.A NH2 GLN 484.A OE1 no hydrogen 2.501 N/A GLN 462.A N LEU 458.A O no hydrogen 3.270 N/A LYS 463.A N GLU 459.A O no hydrogen 3.195 N/A ILE 464.A N GLU 460.A O no hydrogen 3.163 N/A LYS 465.A N ARG 461.A O no hydrogen 2.878 N/A THR 466.A N GLN 462.A O no hydrogen 2.841 N/A THR 466.A OG1 GLN 462.A O no hydrogen 2.909 N/A LYS 467.A N LYS 463.A O no hydrogen 2.911 N/A LYS 467.A NZ GLU 470.A OE1 no hydrogen 3.073 N/A MET 468.A N ILE 464.A O no hydrogen 2.965 N/A LYS 469.A N THR 466.A O no hydrogen 3.228 N/A GLU 470.A N LYS 467.A O no hydrogen 3.125 N/A THR 471.A N LYS 467.A O no hydrogen 2.907 N/A THR 471.A OG1 ASP 473.A O no hydrogen 3.564 N/A ILE 475.A N ASP 473.A OD1 no hydrogen 2.828 N/A GLU 476.A N ASP 473.A OD1 no hydrogen 3.267 N/A LYS 477.A N ASP 473.A O no hydrogen 2.898 N/A ILE 478.A N PRO 474.A O no hydrogen 3.179 N/A LEU 479.A N ILE 475.A O no hydrogen 3.070 N/A LEU 480.A N GLU 476.A O no hydrogen 2.793 N/A ASP 481.A N LYS 477.A O no hydrogen 3.133 N/A TYR 482.A N ILE 478.A O no hydrogen 3.355 N/A TYR 482.A OH GLU 325.A O no hydrogen 3.328 N/A TYR 482.A OH GLU 325.A OE2 no hydrogen 2.698 N/A ARG 483.A N LEU 479.A O no hydrogen 3.149 N/A ARG 483.A NH2 GLU 460.A OE2 no hydrogen 3.271 N/A GLN 484.A N LEU 480.A O no hydrogen 2.924 N/A LYS 485.A N ASP 481.A O no hydrogen 2.945 N/A ALA 486.A N TYR 482.A O no hydrogen 2.791 N/A ILE 487.A N ARG 483.A O no hydrogen 3.197 N/A LYS 488.A N GLN 484.A O no hydrogen 3.220 N/A LEU 489.A N LYS 485.A O no hydrogen 3.053 N/A LEU 490.A N ALA 486.A O no hydrogen 3.094 N/A ALA 491.A N ILE 487.A O no hydrogen 2.874 N/A ASN 492.A N LYS 488.A O no hydrogen 2.970 N/A SER 493.A OG LEU 489.A O no hydrogen 2.782 N/A PHE 494.A N ALA 491.A O no hydrogen 3.508 N/A TYR 495.A OH THR 515.A OG1 no hydrogen 2.591 N/A TYR 497.A N SER 493.A O no hydrogen 3.014 N/A TYR 497.A OH GLU 354.A OE1 no hydrogen 2.528 N/A TYR 498.A N PHE 494.A O no hydrogen 3.238 N/A TYR 498.A N TYR 495.A O no hydrogen 3.249 N/A TYR 498.A OH VAL 419.A O no hydrogen 2.654 N/A GLY 499.A N GLY 496.A O no hydrogen 3.229 N/A TYR 500.A N TYR 497.A O no hydrogen 3.134 N/A ALA 503.A N TYR 500.A O no hydrogen 2.809 N/A ARG 504.A N GLU 354.A OE2 no hydrogen 2.908 N/A ARG 504.A NH1 PRO 369.A O no hydrogen 3.033 N/A ARG 504.A NH2 ASP 113.A OD1 no hydrogen 3.043 N/A TRP 505.A N TYR 497.A OH no hydrogen 3.219 N/A TYR 506.A OH GLU 383.A OE1 no hydrogen 3.369 N/A TYR 506.A OH TYR 385.A OH no hydrogen 2.845 N/A CYS 507.A N TYR 498.A O no hydrogen 3.077 N/A GLU 509.A N GLU 509.A OE1 no hydrogen 2.791 N/A ALA 511.A N CYS 507.A O no hydrogen 3.124 N/A GLU 512.A N LYS 508.A O no hydrogen 2.716 N/A SER 513.A N GLU 509.A O no hydrogen 2.985 N/A SER 513.A OG GLU 509.A O no hydrogen 2.686 N/A VAL 514.A N CYS 510.A O no hydrogen 2.993 N/A THR 515.A N ALA 511.A O no hydrogen 3.217 N/A THR 515.A OG1 TYR 495.A OH no hydrogen 2.591 N/A THR 515.A OG1 ALA 511.A O no hydrogen 3.064 N/A ALA 516.A N GLU 512.A O no hydrogen 2.858 N/A TRP 517.A N SER 513.A O no hydrogen 2.717 N/A GLY 518.A N VAL 514.A O no hydrogen 3.049 N/A ARG 519.A N THR 515.A O no hydrogen 3.062 N/A ARG 519.A NH1 GLY 387.A O no hydrogen 3.494 N/A ARG 519.A NH2 GLN 437.A OE1 no hydrogen 2.702 N/A LYS 520.A N ALA 516.A O no hydrogen 3.214 N/A TYR 521.A N TRP 517.A O no hydrogen 3.129 N/A TYR 521.A OH HIS 417.A NE2 no hydrogen 2.624 N/A ILE 522.A N GLY 518.A O no hydrogen 3.181 N/A GLU 523.A N ARG 519.A O no hydrogen 3.263 N/A LEU 524.A N LYS 520.A O no hydrogen 2.896 N/A VAL 525.A N TYR 521.A O no hydrogen 3.056 N/A TRP 526.A N ILE 522.A O no hydrogen 3.001 N/A LYS 527.A N GLU 523.A O no hydrogen 2.945 N/A GLU 528.A N LEU 524.A O no hydrogen 2.883 N/A LEU 529.A N VAL 525.A O no hydrogen 2.915 N/A GLU 530.A N TRP 526.A O no hydrogen 3.366 N/A GLU 531.A N LYS 527.A O no hydrogen 3.106 N/A LYS 532.A NZ GLU 528.A OE1 no hydrogen 3.142 N/A LYS 532.A NZ GLU 528.A OE2 no hydrogen 2.760 N/A PHE 535.A N LEU 529.A O no hydrogen 3.042 N/A LYS 536.A N THR 548.A O no hydrogen 2.710 N/A VAL 537.A N GLU 530.A OE2 no hydrogen 2.807 N/A LEU 538.A N HIS 546.A O no hydrogen 2.730 N/A TYR 539.A N HIS 546.A O no hydrogen 3.336 N/A ASP 541.A N GLY 544.A O no hydrogen 3.051 N/A THR 542.A N PHE 389.A O no hydrogen 2.838 N/A THR 542.A OG1 ASP 541.A OD1 no hydrogen 2.526 N/A ASP 543.A N ASP 541.A O no hydrogen 2.706 N/A GLY 544.A N ASP 541.A O no hydrogen 3.321 N/A LEU 545.A N LEU 404.A O no hydrogen 2.732 N/A HIS 546.A N TYR 539.A O no hydrogen 2.784 N/A ALA 547.A N VAL 402.A O no hydrogen 2.932 N/A THR 548.A N LYS 536.A O no hydrogen 3.339 N/A THR 548.A OG1 ASP 399.A O no hydrogen 3.401 N/A THR 548.A OG1 ASP 400.A O no hydrogen 2.768 N/A GLY 552.A N ILE 549.A O no hydrogen 2.637 N/A SER 554.A OG ASP 400.A OD1 no hydrogen 3.379 N/A GLU 555.A N GLU 555.A OE1 no hydrogen 2.712 N/A ILE 557.A N GLU 553.A O no hydrogen 3.150 N/A LYS 558.A N SER 554.A O no hydrogen 3.455 N/A LYS 558.A NZ GLU 600.A OE2 no hydrogen 2.772 N/A LYS 559.A N GLU 555.A O no hydrogen 3.304 N/A LYS 560.A N GLU 556.A O no hydrogen 2.848 N/A ALA 561.A N ILE 557.A O no hydrogen 2.944 N/A ALA 561.A N LYS 558.A O no hydrogen 3.148 N/A LEU 562.A N LYS 558.A O no hydrogen 2.911 N/A GLU 563.A N LYS 559.A O no hydrogen 3.068 N/A PHE 564.A N LYS 560.A O no hydrogen 3.140 N/A VAL 565.A N ALA 561.A O no hydrogen 3.194 N/A TYR 567.A N GLU 563.A O no hydrogen 3.101 N/A TYR 567.A OH GLU 528.A OE1 no hydrogen 3.142 N/A ILE 568.A N PHE 564.A O no hydrogen 2.755 N/A ASN 569.A N VAL 565.A O no hydrogen 3.144 N/A ASN 569.A ND2 LEU 578.A O no hydrogen 3.424 N/A SER 570.A N TYR 567.A O no hydrogen 2.952 N/A SER 570.A OG TYR 567.A O no hydrogen 2.513 N/A LYS 571.A N ILE 568.A O no hydrogen 3.107 N/A LYS 571.A NZ GLU 528.A OE1 no hydrogen 2.766 N/A LEU 572.A N ILE 568.A O no hydrogen 3.029 N/A LEU 576.A N PRO 573.A O no hydrogen 3.027 N/A LEU 578.A N ASN 569.A OD1 no hydrogen 3.021 N/A GLU 579.A N ASP 405.A O no hydrogen 2.903 N/A GLU 581.A N TYR 403.A O no hydrogen 3.218 N/A TYR 584.A N ILE 401.A O no hydrogen 2.776 N/A LYS 585.A N ILE 598.A O no hydrogen 2.943 N/A GLY 587.A N TRP 398.A O no hydrogen 3.075 N/A PHE 588.A N ALA 596.A O no hydrogen 3.153 N/A VAL 590.A N ARG 594.A O no hydrogen 3.016 N/A THR 591.A N ARG 594.A O no hydrogen 3.301 N/A LYS 593.A N TYR 539.A OH no hydrogen 2.836 N/A ARG 594.A N THR 591.A O no hydrogen 3.059 N/A ARG 594.A NH1 GLY 608.A O no hydrogen 3.529 N/A TYR 595.A N ARG 607.A O no hydrogen 2.843 N/A ALA 596.A N PHE 588.A O no hydrogen 3.252 N/A VAL 597.A N ILE 605.A O no hydrogen 2.967 N/A ILE 598.A N ARG 586.A O no hydrogen 3.181 N/A ASP 599.A N LYS 603.A O no hydrogen 3.138 N/A GLY 602.A N ASP 599.A O no hydrogen 3.240 N/A ARG 607.A N TYR 595.A O no hydrogen 3.018 N/A THR 616.A N ILE 612.A O no hydrogen 2.964 N/A THR 616.A OG1 ILE 612.A O no hydrogen 2.849 N/A GLN 617.A N ALA 613.A O no hydrogen 3.279 N/A ALA 618.A N LYS 614.A O no hydrogen 3.339 N/A ARG 619.A N GLU 615.A O no hydrogen 2.920 N/A VAL 620.A N THR 616.A O no hydrogen 2.724 N/A LEU 621.A N GLN 617.A O no hydrogen 3.361 N/A GLU 622.A N ALA 618.A O no hydrogen 3.257 N/A THR 623.A N ARG 619.A O no hydrogen 3.300 N/A ILE 624.A N VAL 620.A O no hydrogen 3.259 N/A LEU 625.A N LEU 621.A O no hydrogen 2.819 N/A LYS 626.A N GLU 622.A O no hydrogen 2.797 N/A LYS 626.A NZ GLY 602.A O no hydrogen 3.287 N/A GLY 628.A N ILE 624.A O no hydrogen 2.987 N/A ASP 629.A N THR 623.A O no hydrogen 3.337 N/A GLU 632.A N ASP 629.A OD1 no hydrogen 2.964 N/A VAL 634.A N VAL 630.A O no hydrogen 3.290 N/A VAL 634.A N GLU 631.A O no hydrogen 3.178 N/A ARG 635.A N GLU 631.A O no hydrogen 3.315 N/A ARG 635.A NE GLU 631.A OE1 no hydrogen 2.712 N/A ARG 635.A NH2 GLU 631.A OE1 no hydrogen 2.898 N/A ILE 636.A N GLU 632.A O no hydrogen 3.373 N/A VAL 637.A N ALA 633.A O no hydrogen 3.410 N/A LYS 638.A N VAL 634.A O no hydrogen 3.106 N/A GLU 639.A N ARG 635.A O no hydrogen 2.874 N/A VAL 640.A N ILE 636.A O no hydrogen 3.043 N/A ILE 641.A N VAL 637.A O no hydrogen 3.266 N/A LYS 643.A N GLU 639.A O no hydrogen 3.205 N/A LEU 644.A N VAL 640.A O no hydrogen 3.240 N/A ALA 645.A N ILE 641.A O no hydrogen 3.455 N/A ASN 646.A N GLN 642.A O no hydrogen 3.189 N/A ASN 646.A ND2 GLU 648.A OE2 no hydrogen 3.364 N/A TYR 647.A OH TYR 675.A O no hydrogen 2.924 N/A GLU 648.A N LYS 643.A O no hydrogen 2.991 N/A LYS 653.A N PRO 651.A O no hydrogen 2.730 N/A LYS 653.A NZ GLU 615.A OE1 no hydrogen 3.292 N/A ALA 655.A N GLU 652.A O no hydrogen 3.215 N/A LYS 668.A N VAL 665.A O no hydrogen 3.351 N/A LEU 669.A N LYS 667.A O no hydrogen 2.881 N/A ILE 681.A N ALA 677.A O no hydrogen 3.197 N/A GLU 682.A N GLU 678.A O no hydrogen 3.018 N/A ASN 683.A N TYR 679.A O no hydrogen 2.898 N/A ASN 683.A ND2 ASN 683.A O no hydrogen 2.699 N/A VAL 685.A N TYR 680.A O no hydrogen 2.937 N/A LEU 686.A N ILE 681.A O no hydrogen 3.051 N/A VAL 689.A N VAL 685.A O no hydrogen 3.087 N/A LEU 690.A N LEU 686.A O no hydrogen 2.724 N/A ILE 692.A N VAL 689.A O no hydrogen 3.086 N/A LEU 693.A N VAL 689.A O no hydrogen 3.064 N/A GLU 694.A N LEU 690.A O no hydrogen 2.874 N/A GLY 695.A N ILE 692.A O no hydrogen 3.383 N/A PHE 696.A N LEU 693.A O no hydrogen 3.127 N/A GLY 697.A N GLU 694.A O no hydrogen 3.166 N/A TYR 698.A N LEU 693.A O no hydrogen 3.253 N/A ARG 699.A N ASP 702.A OD2 no hydrogen 3.138 N/A GLU 701.A N GLU 701.A OE1 no hydrogen 2.618 N/A ARG 704.A N LYS 700.A O no hydrogen 2.903 N/A