Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bca_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A NH1 GLY 147.A O no hydrogen 2.978 N/A ARG 7.A NH2 GLY 147.A O no hydrogen 2.769 N/A ARG 7.A NH2 ASP 170.A OD2 no hydrogen 2.671 N/A GLU 9.A N LYS 6.A O no hydrogen 3.289 N/A LEU 10.A N ARG 7.A O no hydrogen 2.790 N/A MET 11.A N ARG 7.A O no hydrogen 2.782 N/A LYS 12.A N GLY 17.A O no hydrogen 2.894 N/A LYS 12.A NZ TRP 16.A O no hydrogen 3.315 N/A LYS 12.A NZ TYR 18.A O no hydrogen 3.299 N/A LYS 12.A NZ SER 21.A O no hydrogen 2.635 N/A TYR 18.A N TYR 410.A OH no hydrogen 3.337 N/A ASN 19.A N LEU 10.A O no hydrogen 2.906 N/A ASN 19.A ND2 GLN 8.A O no hydrogen 3.210 N/A ASN 19.A ND2 MET 11.A O no hydrogen 3.655 N/A SER 21.A N TYR 18.A O no hydrogen 3.240 N/A SER 21.A OG ASP 20.A OD1 no hydrogen 2.869 N/A LYS 22.A N THR 34.A OG1 no hydrogen 2.962 N/A PHE 24.A N GLU 32.A O no hydrogen 2.800 N/A ASN 26.A N GLN 30.A O no hydrogen 2.728 N/A ASN 26.A ND2 GLU 32.A OE1 no hydrogen 3.203 N/A LYS 28.A N ASN 26.A OD1 no hydrogen 2.760 N/A GLY 29.A N ASN 26.A O no hydrogen 2.673 N/A GLN 30.A N ASN 26.A OD1 no hydrogen 3.067 N/A GLU 32.A N PHE 24.A O no hydrogen 2.894 N/A THR 34.A N LYS 22.A O no hydrogen 2.790 N/A THR 34.A OG1 ASP 20.A O no hydrogen 2.664 N/A THR 34.A OG1 LYS 22.A O no hydrogen 3.279 N/A ARG 37.A NE ASP 20.A OD1 no hydrogen 2.892 N/A ARG 37.A NE ASP 20.A OD2 no hydrogen 2.829 N/A ARG 37.A NH2 ASP 20.A OD2 no hydrogen 2.980 N/A TYR 38.A N SER 41.A OG no hydrogen 2.950 N/A TYR 38.A OH GLU 217.A OE1 no hydrogen 3.366 N/A TYR 38.A OH GLU 217.A OE2 no hydrogen 2.377 N/A TYR 38.A OH TYR 410.A OH no hydrogen 2.745 N/A SER 41.A N TYR 38.A O no hydrogen 2.989 N/A GLY 42.A N LEU 33.A O no hydrogen 3.014 N/A VAL 43.A N LEU 40.A O no hydrogen 3.030 N/A LEU 45.A N LEU 31.A O no hydrogen 2.886 N/A PHE 48.A N LEU 45.A O no hydrogen 3.232 N/A LYS 49.A NZ GLY 29.A O no hydrogen 3.176 N/A TRP 51.A N THR 47.A O no hydrogen 3.201 N/A ILE 52.A N PHE 48.A O no hydrogen 3.035 N/A GLN 53.A N LYS 49.A O no hydrogen 3.009 N/A GLN 53.A NE2 ASN 59.A O no hydrogen 2.482 N/A ASN 54.A N ASP 50.A O no hydrogen 2.730 N/A THR 55.A N TRP 51.A O no hydrogen 2.838 N/A THR 55.A OG1 TRP 51.A O no hydrogen 2.779 N/A PHE 56.A N ILE 52.A O no hydrogen 2.869 N/A GLY 57.A N GLN 53.A O no hydrogen 3.041 N/A SER 69.A OG GLN 88.A OE1 no hydrogen 2.944 N/A SER 69.A OG ASP 118.A O no hydrogen 2.654 N/A ILE 70.A N ASP 118.A OD1 no hydrogen 3.309 N/A ASP 74.A N ASN 72.A OD1 no hydrogen 2.578 N/A PHE 75.A N ASN 72.A OD1 no hydrogen 3.118 N/A LEU 76.A N ASN 72.A O no hydrogen 3.059 N/A HIS 77.A N GLU 73.A O no hydrogen 3.052 N/A GLU 78.A N ASP 74.A O no hydrogen 3.080 N/A LEU 79.A N PHE 75.A O no hydrogen 2.845 N/A LYS 80.A N LEU 76.A O no hydrogen 2.950 N/A LYS 81.A N HIS 77.A O no hydrogen 3.419 N/A THR 82.A N LEU 79.A O no hydrogen 3.225 N/A THR 82.A OG1 LEU 79.A O no hydrogen 2.773 N/A ASN 83.A N LYS 80.A O no hydrogen 2.927 N/A ILE 84.A N THR 82.A OG1 no hydrogen 3.187 N/A SER 87.A N VAL 120.A O no hydrogen 2.925 N/A SER 87.A OG ASP 92.A OD2 no hydrogen 2.592 N/A GLU 89.A N SER 87.A OG no hydrogen 3.082 N/A ARG 93.A N GLU 89.A O no hydrogen 3.157 N/A ARG 93.A NE PRO 117.A O no hydrogen 2.819 N/A ARG 93.A NH1 GLN 88.A O no hydrogen 3.100 N/A ARG 93.A NH2 PRO 67.A O no hydrogen 2.887 N/A VAL 94.A N ALA 90.A O no hydrogen 2.836 N/A PHE 95.A N ASP 91.A O no hydrogen 3.146 N/A ARG 96.A N ARG 93.A O no hydrogen 3.213 N/A ARG 96.A NE ASP 170.A OD2 no hydrogen 2.723 N/A ARG 96.A NH1 ASP 92.A O no hydrogen 3.184 N/A ARG 96.A NH2 LYS 5.A O no hydrogen 2.830 N/A ARG 96.A NH2 ASP 170.A OD2 no hydrogen 3.056 N/A ALA 97.A N VAL 94.A O no hydrogen 3.070 N/A GLY 99.A N GLU 104.A OE2 no hydrogen 3.110 N/A HIS 100.A N SER 151.A O no hydrogen 2.628 N/A CYS 101.A N GLU 104.A OE1 no hydrogen 3.054 N/A LEU 102.A N GLU 423.A OE1 no hydrogen 3.198 N/A LEU 102.A N GLU 423.A OE2 no hydrogen 3.505 N/A ILE 105.A N CYS 101.A O no hydrogen 2.962 N/A PHE 106.A N LEU 102.A O no hydrogen 2.849 N/A LEU 107.A N HIS 103.A O no hydrogen 3.343 N/A LEU 108.A N GLU 104.A O no hydrogen 3.122 N/A ARG 109.A N ILE 105.A O no hydrogen 3.048 N/A ARG 109.A NH1 GLU 417.A OE2 no hydrogen 3.486 N/A GLU 110.A N LEU 107.A O no hydrogen 2.749 N/A GLY 111.A N LEU 107.A O no hydrogen 2.638 N/A ARG 115.A NE GLU 162.A O no hydrogen 2.944 N/A ARG 115.A NH1 ASP 118.A OD1 no hydrogen 3.568 N/A ARG 115.A NH1 ASP 118.A OD2 no hydrogen 2.984 N/A ARG 115.A NH2 ASP 118.A OD2 no hydrogen 3.116 N/A ARG 115.A NH2 GLU 162.A O no hydrogen 3.221 N/A ASP 118.A N ILE 166.A O no hydrogen 2.930 N/A ILE 119.A N ILE 166.A O no hydrogen 3.267 N/A VAL 120.A N SER 87.A O no hydrogen 2.974 N/A LEU 121.A N SER 168.A O no hydrogen 2.980 N/A TRP 122.A N SER 85.A O no hydrogen 2.860 N/A THR 124.A N ASP 128.A OD2 no hydrogen 3.034 N/A THR 124.A OG1 ASP 128.A OD2 no hydrogen 3.402 N/A VAL 129.A N CYS 125.A O no hydrogen 3.202 N/A VAL 130.A N HIS 126.A O no hydrogen 3.046 N/A LYS 131.A N ASP 127.A O no hydrogen 2.910 N/A ILE 132.A N ASP 128.A O no hydrogen 2.950 N/A VAL 133.A N VAL 129.A O no hydrogen 2.973 N/A ASN 134.A N VAL 130.A O no hydrogen 3.050 N/A LEU 135.A N LYS 131.A O no hydrogen 2.897 N/A ALA 136.A N ILE 132.A O no hydrogen 2.880 N/A CYS 137.A N VAL 133.A O no hydrogen 3.025 N/A CYS 137.A SG VAL 133.A O no hydrogen 3.592 N/A LYS 138.A N ASN 134.A O no hydrogen 3.097 N/A LYS 138.A NZ GLU 78.A OE2 no hydrogen 2.512 N/A TYR 139.A N LEU 135.A O no hydrogen 2.871 N/A TYR 139.A OH GLU 78.A OE2 no hydrogen 2.840 N/A ASN 140.A N CYS 137.A O no hydrogen 3.480 N/A LEU 141.A N ALA 136.A O no hydrogen 3.021 N/A CYS 142.A N THR 165.A O no hydrogen 2.812 N/A CYS 142.A SG ILE 548.A O no hydrogen 3.514 N/A ILE 143.A N ILE 548.A O no hydrogen 2.702 N/A ILE 144.A N ILE 167.A O no hydrogen 2.791 N/A ILE 146.A N LEU 169.A O no hydrogen 2.910 N/A SER 151.A OG SER 153.A OG no hydrogen 3.314 N/A SER 153.A N SER 151.A OG no hydrogen 3.311 N/A SER 153.A OG SER 151.A OG no hydrogen 3.314 N/A GLY 155.A N SER 151.A OG no hydrogen 3.168 N/A MET 157.A N TYR 154.A O no hydrogen 3.169 N/A CYS 158.A SG ARG 115.A O no hydrogen 4.031 N/A GLU 162.A N PRO 159.A O no hydrogen 3.152 N/A ARG 164.A N GLU 162.A OE2 no hydrogen 3.077 N/A ARG 164.A NE GLU 162.A OE2 no hydrogen 2.637 N/A ARG 164.A NH1 THR 546.A O no hydrogen 2.982 N/A ARG 164.A NH1 ASN 547.A O no hydrogen 3.019 N/A ARG 164.A NH2 GLU 162.A OE1 no hydrogen 2.894 N/A ARG 164.A NH2 GLU 162.A OE2 no hydrogen 3.386 N/A ARG 164.A NH2 ASN 547.A O no hydrogen 2.907 N/A THR 165.A OG1 ILE 70.A O no hydrogen 2.866 N/A ILE 166.A N ASP 118.A OD2 no hydrogen 3.164 N/A ILE 167.A N CYS 142.A O no hydrogen 2.690 N/A SER 168.A N ILE 119.A O no hydrogen 2.804 N/A LEU 169.A N ILE 144.A O no hydrogen 3.064 N/A ASP 170.A N LEU 121.A O no hydrogen 3.154 N/A THR 171.A N ILE 146.A O no hydrogen 3.101 N/A THR 171.A OG1 ILE 146.A O no hydrogen 3.518 N/A SER 172.A N ASP 170.A OD1 no hydrogen 2.698 N/A SER 172.A OG ILE 3.A O no hydrogen 3.491 N/A SER 172.A OG ASP 170.A OD1 no hydrogen 2.954 N/A SER 172.A OG GLN 173.A OE1 no hydrogen 3.040 N/A MET 174.A N THR 171.A O no hydrogen 2.851 N/A ARG 176.A N GLU 190.A OE1 no hydrogen 3.036 N/A LEU 178.A N HIS 188.A O no hydrogen 2.722 N/A TRP 179.A N HIS 188.A O no hydrogen 3.379 N/A ASP 181.A N THR 186.A O no hydrogen 2.722 N/A ASN 184.A N ASP 181.A OD1 no hydrogen 2.984 N/A THR 186.A N ASP 181.A O no hydrogen 3.097 N/A ALA 187.A N ILE 290.A O no hydrogen 2.875 N/A HIS 188.A N TRP 179.A O no hydrogen 2.820 N/A VAL 189.A N ALA 288.A O no hydrogen 2.798 N/A GLU 190.A N ARG 176.A O no hydrogen 2.877 N/A ALA 191.A N THR 286.A O no hydrogen 3.027 N/A GLY 192.A N MET 174.A O no hydrogen 2.815 N/A ILE 193.A N GLU 190.A O no hydrogen 3.437 N/A THR 194.A OG1 GLY 1.A O no hydrogen 3.415 N/A GLY 195.A N SER 219.A O no hydrogen 3.261 N/A GLN 196.A N LEU 216.A O no hydrogen 2.891 N/A GLU 197.A N THR 194.A O no hydrogen 3.260 N/A GLU 197.A N THR 194.A OG1 no hydrogen 3.059 N/A LEU 198.A N THR 194.A O no hydrogen 3.035 N/A GLU 199.A N GLY 195.A O no hydrogen 3.084 N/A ARG 200.A N GLN 196.A O no hydrogen 2.984 N/A ARG 200.A NE GLU 197.A OE1 no hydrogen 2.902 N/A ARG 200.A NE GLU 197.A OE2 no hydrogen 3.096 N/A ARG 200.A NH2 GLU 197.A OE2 no hydrogen 2.364 N/A GLN 201.A N GLU 197.A O no hydrogen 2.758 N/A LEU 202.A N LEU 198.A O no hydrogen 2.884 N/A LYS 203.A N GLU 199.A O no hydrogen 3.001 N/A SER 205.A N LEU 202.A O no hydrogen 2.808 N/A GLY 206.A N LEU 202.A O no hydrogen 3.171 N/A GLY 206.A N LYS 203.A O no hydrogen 2.951 N/A TYR 207.A N LEU 202.A O no hydrogen 3.137 N/A TYR 207.A OH GLU 182.A OE1 no hydrogen 2.314 N/A CYS 208.A N ARG 293.A O no hydrogen 2.902 N/A CYS 208.A SG ARG 293.A O no hydrogen 3.541 N/A THR 209.A N GLU 199.A OE2 no hydrogen 2.879 N/A THR 209.A OG1 GLU 199.A OE2 no hydrogen 2.521 N/A GLY 210.A N GLU 199.A OE1 no hydrogen 3.117 N/A HIS 211.A N THR 209.A OG1 no hydrogen 3.247 N/A SER 215.A OG SER 219.A OG no hydrogen 2.800 N/A LEU 216.A N PRO 213.A O no hydrogen 3.148 N/A PHE 218.A N SER 215.A O no hydrogen 2.976 N/A SER 219.A N SER 215.A O no hydrogen 2.784 N/A SER 219.A OG SER 215.A O no hydrogen 2.798 N/A SER 219.A OG SER 215.A OG no hydrogen 2.800 N/A VAL 221.A N ILE 193.A O no hydrogen 3.318 N/A GLY 222.A N ALA 191.A O no hydrogen 2.717 N/A GLY 223.A N THR 220.A OG1 no hydrogen 3.321 N/A TRP 224.A N THR 220.A O no hydrogen 2.746 N/A TRP 224.A NE1 SER 219.A OG no hydrogen 3.033 N/A ILE 225.A N VAL 221.A O no hydrogen 3.054 N/A SER 226.A N GLY 222.A O no hydrogen 2.910 N/A SER 226.A OG GLY 222.A O no hydrogen 2.850 N/A THR 227.A N GLY 223.A O no hydrogen 2.916 N/A THR 227.A OG1 GLY 223.A O no hydrogen 3.268 N/A ALA 229.A N TRP 224.A O no hydrogen 3.035 N/A MET 232.A N GLU 212.A O no hydrogen 2.848 N/A LYS 233.A NZ GLU 212.A OE1 no hydrogen 3.203 N/A LYS 233.A NZ GLU 212.A OE2 no hydrogen 2.770 N/A LYS 233.A NZ GLU 368.A OE1 no hydrogen 2.967 N/A LYS 233.A NZ GLU 368.A OE2 no hydrogen 3.062 N/A LYS 234.A N GLY 231.A O no hydrogen 3.261 N/A LYS 234.A NZ ASN 235.A OD1 no hydrogen 3.122 N/A LYS 234.A NZ THR 467.A O no hydrogen 2.783 N/A ASN 235.A ND2 PRO 326.A O no hydrogen 2.807 N/A ILE 236.A N LYS 233.A O no hydrogen 3.070 N/A TYR 237.A N LYS 233.A O no hydrogen 2.955 N/A TYR 237.A OH GLU 368.A OE2 no hydrogen 2.586 N/A GLY 238.A N LYS 234.A O no hydrogen 2.606 N/A ASN 239.A N ASP 242.A OD2 no hydrogen 2.925 N/A ILE 240.A N ALA 229.A O no hydrogen 3.301 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.760 N/A ASP 242.A N ASN 239.A O no hydrogen 2.728 N/A LEU 243.A N ASN 239.A O no hydrogen 3.153 N/A LEU 243.A N ILE 240.A O no hydrogen 3.090 N/A VAL 244.A N ILE 240.A O no hydrogen 3.153 N/A VAL 245.A N THR 289.A O no hydrogen 2.895 N/A HIS 246.A NE2 LYS 258.A O no hydrogen 2.993 N/A LYS 248.A N GLU 287.A O no hydrogen 3.173 N/A VAL 249.A N ILE 256.A O no hydrogen 2.796 N/A VAL 250.A N VAL 284.A O no hydrogen 2.898 N/A THR 251.A N GLY 254.A O no hydrogen 2.820 N/A THR 251.A OG1 GLY 254.A O no hydrogen 2.723 N/A ARG 253.A NE TYR 542.A O no hydrogen 2.748 N/A ARG 253.A NH2 TYR 542.A O no hydrogen 3.103 N/A GLY 254.A N THR 251.A O no hydrogen 3.003 N/A ILE 256.A N VAL 249.A O no hydrogen 2.772 N/A LYS 258.A NZ ASP 270.A OD1 no hydrogen 2.820 N/A GLN 261.A NE2 THR 289.A OG1 no hydrogen 2.782 N/A HIS 272.A N ASP 270.A OD1 no hydrogen 3.055 N/A HIS 273.A N ASP 270.A O no hydrogen 2.714 N/A PHE 274.A N ILE 271.A O no hydrogen 2.919 N/A ILE 275.A N HIS 272.A O no hydrogen 3.271 N/A MET 276.A N HIS 272.A O no hydrogen 2.905 N/A GLY 277.A N ILE 225.A O no hydrogen 3.135 N/A SER 278.A N ILE 275.A O no hydrogen 2.972 N/A SER 278.A OG ILE 275.A O no hydrogen 2.713 N/A GLU 279.A N SER 226.A O no hydrogen 3.055 N/A THR 281.A N SER 278.A O no hydrogen 3.056 N/A THR 281.A OG1 SER 278.A O no hydrogen 2.639 N/A VAL 284.A N VAL 250.A O no hydrogen 3.018 N/A THR 286.A N LYS 248.A O no hydrogen 2.983 N/A THR 286.A OG1 LYS 248.A O no hydrogen 3.356 N/A ALA 288.A N VAL 189.A O no hydrogen 2.742 N/A THR 289.A N HIS 246.A O no hydrogen 2.883 N/A ILE 290.A N ALA 187.A O no hydrogen 2.778 N/A LYS 291.A N LEU 243.A O no hydrogen 2.830 N/A LYS 291.A NZ ASP 242.A O no hydrogen 3.228 N/A ILE 292.A N LEU 185.A O no hydrogen 3.069 N/A ARG 293.A N CYS 208.A O no hydrogen 2.894 N/A THR 295.A N GLY 206.A O no hydrogen 3.043 N/A TYR 298.A N GLY 369.A O no hydrogen 2.967 N/A LYS 300.A N PHE 367.A O no hydrogen 2.896 N/A LYS 300.A NZ GLU 378.A OE1 no hydrogen 3.567 N/A LYS 300.A NZ GLU 378.A OE2 no hydrogen 2.929 N/A LYS 300.A NZ GLU 395.A OE1 no hydrogen 3.366 N/A GLY 302.A N LEU 365.A O no hydrogen 3.203 N/A SER 303.A N TYR 382.A OH no hydrogen 3.297 N/A SER 303.A OG GLY 394.A O no hydrogen 2.864 N/A VAL 304.A N ALA 363.A O no hydrogen 3.009 N/A ALA 305.A N LEU 391.A O no hydrogen 2.817 N/A PHE 306.A N SER 361.A O no hydrogen 2.708 N/A GLU 310.A N GLU 310.A OE1 no hydrogen 2.595 N/A GLN 311.A N ASN 308.A OD1 no hydrogen 2.771 N/A GLY 312.A N ASN 308.A O no hydrogen 3.272 N/A VAL 313.A N PHE 309.A O no hydrogen 2.876 N/A ALA 314.A N GLU 310.A O no hydrogen 2.984 N/A CYS 315.A N GLN 311.A O no hydrogen 3.024 N/A LEU 316.A N GLY 312.A O no hydrogen 3.003 N/A ARG 317.A N VAL 313.A O no hydrogen 2.764 N/A ARG 317.A NH1 ARG 317.A O no hydrogen 2.979 N/A GLU 318.A N ALA 314.A O no hydrogen 2.991 N/A ILE 319.A N CYS 315.A O no hydrogen 2.837 N/A ALA 320.A N LEU 316.A O no hydrogen 2.930 N/A LYS 321.A N ARG 317.A O no hydrogen 2.902 N/A GLN 322.A N GLU 318.A O no hydrogen 3.049 N/A GLN 322.A NE2 GLU 318.A OE2 no hydrogen 2.959 N/A ARG 323.A N ALA 320.A O no hydrogen 3.057 N/A ARG 323.A NE ASP 469.A OD1 no hydrogen 3.040 N/A ARG 323.A NH2 ASP 469.A OD1 no hydrogen 3.363 N/A ARG 323.A NH2 ASP 469.A OD2 no hydrogen 2.842 N/A CYS 324.A N ILE 319.A O no hydrogen 3.175 N/A CYS 324.A SG ILE 319.A O no hydrogen 3.778 N/A SER 328.A N LEU 366.A O no hydrogen 3.177 N/A SER 328.A OG TYR 402.A OH no hydrogen 2.683 N/A ARG 330.A N THR 364.A O no hydrogen 3.056 N/A LEU 331.A N VAL 464.A O no hydrogen 2.927 N/A MET 332.A N VAL 362.A O no hydrogen 2.776 N/A ASP 333.A N CYS 462.A O no hydrogen 3.270 N/A GLN 335.A NE2 SER 460.A O no hydrogen 3.126 N/A GLN 336.A N ASP 333.A OD1 no hydrogen 3.033 N/A GLN 336.A NE2 THR 461.A OG1 no hydrogen 3.063 N/A PHE 337.A N ASP 333.A O no hydrogen 3.031 N/A GLN 338.A N ASN 334.A O no hydrogen 2.933 N/A GLN 338.A NE2 PRO 357.A O no hydrogen 3.275 N/A PHE 339.A N GLN 335.A O no hydrogen 2.947 N/A GLY 340.A N GLN 336.A O no hydrogen 2.990 N/A HIS 341.A N PHE 337.A O no hydrogen 3.016 N/A ALA 342.A N GLN 338.A O no hydrogen 3.132 N/A ALA 342.A N PHE 339.A O no hydrogen 2.991 N/A LEU 343.A N GLY 340.A O no hydrogen 3.029 N/A GLN 346.A N GLN 346.A OE1 no hydrogen 2.733 N/A THR 352.A N SER 349.A O no hydrogen 3.395 N/A ASN 358.A N ASP 356.A OD1 no hydrogen 2.971 N/A GLN 359.A N ASP 356.A O no hydrogen 3.419 N/A LEU 360.A N ASP 356.A O no hydrogen 3.173 N/A SER 361.A N PHE 306.A O no hydrogen 3.115 N/A SER 361.A OG ASN 308.A O no hydrogen 2.739 N/A VAL 362.A N MET 332.A O no hydrogen 3.219 N/A ALA 363.A N VAL 304.A O no hydrogen 2.662 N/A THR 364.A N ARG 330.A O no hydrogen 2.662 N/A THR 364.A OG1 TYR 402.A OH no hydrogen 3.391 N/A LEU 365.A N GLY 302.A O no hydrogen 3.154 N/A LEU 366.A N SER 328.A O no hydrogen 2.932 N/A PHE 367.A N LYS 300.A O no hydrogen 2.875 N/A GLY 369.A N TYR 298.A O no hydrogen 3.067 N/A VAL 374.A N ASP 370.A O no hydrogen 2.924 N/A LEU 375.A N ARG 371.A O no hydrogen 2.892 N/A GLN 376.A N GLU 372.A O no hydrogen 3.149 N/A HIS 377.A N LYS 373.A O no hydrogen 2.902 N/A HIS 377.A NE2 CYS 324.A O no hydrogen 3.022 N/A GLU 378.A N VAL 374.A O no hydrogen 2.629 N/A LYS 379.A N LEU 375.A O no hydrogen 3.185 N/A LYS 379.A NZ ASP 383.A OD2 no hydrogen 2.644 N/A GLN 380.A N GLN 376.A O no hydrogen 3.148 N/A VAL 381.A N HIS 377.A O no hydrogen 3.080 N/A TYR 382.A N GLU 378.A O no hydrogen 3.216 N/A ASP 383.A N LYS 379.A O no hydrogen 2.789 N/A ILE 384.A N GLN 380.A O no hydrogen 3.178 N/A ALA 385.A N VAL 381.A O no hydrogen 2.933 N/A ALA 386.A N TYR 382.A O no hydrogen 2.781 N/A LYS 387.A N ILE 384.A O no hydrogen 2.936 N/A PHE 388.A N ALA 385.A O no hydrogen 2.804 N/A GLY 390.A N ALA 385.A O no hydrogen 3.056 N/A LEU 391.A N ALA 305.A O no hydrogen 3.004 N/A ALA 393.A N SER 303.A O no hydrogen 2.901 N/A ASN 397.A ND2 ALA 393.A O no hydrogen 3.584 N/A GLY 398.A N GLU 395.A O no hydrogen 3.257 N/A GLN 399.A N GLU 395.A O no hydrogen 2.958 N/A ARG 400.A N ASP 396.A O no hydrogen 2.861 N/A GLY 401.A N ASN 397.A O no hydrogen 3.302 N/A TYR 402.A N GLY 398.A O no hydrogen 3.249 N/A TYR 402.A OH SER 328.A OG no hydrogen 2.683 N/A LEU 403.A N GLN 399.A O no hydrogen 2.974 N/A LEU 404.A N ARG 400.A O no hydrogen 2.780 N/A THR 405.A N TYR 402.A O no hydrogen 3.332 N/A THR 405.A OG1 GLY 401.A O no hydrogen 3.506 N/A THR 405.A OG1 TYR 402.A O no hydrogen 2.398 N/A VAL 407.A N LEU 404.A O no hydrogen 3.336 N/A TYR 410.A N VAL 407.A O no hydrogen 2.818 N/A TYR 410.A OH TYR 38.A OH no hydrogen 2.745 N/A MET 411.A N ILE 408.A O no hydrogen 3.069 N/A ARG 412.A NH1 GLY 422.A O no hydrogen 2.907 N/A ARG 412.A NH1 GLU 423.A OE1 no hydrogen 3.422 N/A ARG 412.A NH2 HIS 100.A O no hydrogen 2.726 N/A GLY 415.A N MET 411.A O no hydrogen 2.820 N/A LEU 416.A N ARG 412.A O no hydrogen 3.071 N/A GLU 417.A N ASP 413.A O no hydrogen 3.422 N/A GLU 417.A N LEU 414.A O no hydrogen 3.112 N/A TYR 418.A N GLY 415.A O no hydrogen 3.036 N/A ILE 420.A N GLY 415.A O no hydrogen 2.823 N/A ILE 421.A N PHE 480.A O no hydrogen 2.997 N/A GLU 423.A N PHE 478.A O no hydrogen 2.924 N/A PHE 425.A N PHE 476.A O no hydrogen 3.019 N/A THR 427.A N ILE 474.A O no hydrogen 2.901 N/A THR 427.A OG1 SER 428.A O no hydrogen 3.509 N/A THR 427.A OG1 SER 509.A O no hydrogen 2.697 N/A SER 428.A N SER 509.A OG no hydrogen 3.273 N/A SER 428.A OG SER 509.A OG no hydrogen 2.855 N/A ALA 429.A N ALA 472.A O no hydrogen 2.994 N/A TRP 431.A NE1 TYR 468.A O no hydrogen 2.959 N/A ARG 433.A N PRO 430.A O no hydrogen 3.275 N/A VAL 434.A N TRP 431.A O no hydrogen 3.235 N/A LEU 437.A N ARG 433.A O no hydrogen 2.837 N/A CYS 438.A N VAL 434.A O no hydrogen 3.017 N/A CYS 438.A SG VAL 434.A O no hydrogen 3.095 N/A ARG 439.A N VAL 435.A O no hydrogen 3.092 N/A ARG 439.A NH1 ASP 436.A OD1 no hydrogen 2.902 N/A ARG 439.A NH2 ASP 436.A OD1 no hydrogen 3.280 N/A ARG 439.A NH2 ASN 440.A OD1 no hydrogen 3.509 N/A ASN 440.A N ASP 436.A O no hydrogen 2.928 N/A ASN 440.A ND2 ASN 506.A OD1 no hydrogen 2.898 N/A VAL 441.A N LEU 437.A O no hydrogen 2.843 N/A LYS 442.A N CYS 438.A O no hydrogen 3.299 N/A LYS 442.A NZ ASP 333.A OD2 no hydrogen 2.764 N/A GLU 443.A N ARG 439.A O no hydrogen 3.200 N/A ARG 444.A N ASN 440.A O no hydrogen 2.943 N/A ARG 444.A NE GLU 448.A OE2 no hydrogen 3.199 N/A ARG 444.A NH1 GLU 502.A OE1 no hydrogen 2.856 N/A ILE 445.A N VAL 441.A O no hydrogen 2.965 N/A ARG 446.A N LYS 442.A O no hydrogen 3.190 N/A ARG 447.A N GLU 443.A O no hydrogen 3.225 N/A ARG 447.A N ARG 444.A O no hydrogen 3.042 N/A GLU 448.A N ARG 444.A O no hydrogen 2.856 N/A CYS 449.A N ILE 445.A O no hydrogen 3.168 N/A CYS 449.A SG ILE 445.A O no hydrogen 3.421 N/A LYS 450.A N ARG 446.A O no hydrogen 3.478 N/A GLU 451.A N ARG 447.A O no hydrogen 3.000 N/A LYS 452.A N GLU 448.A O no hydrogen 2.727 N/A LYS 452.A NZ GLU 448.A OE1 no hydrogen 3.568 N/A GLY 453.A N LYS 450.A O no hydrogen 3.089 N/A VAL 454.A N CYS 449.A O no hydrogen 2.927 N/A LEU 459.A N ALA 479.A O no hydrogen 2.798 N/A THR 461.A N TYR 477.A O no hydrogen 3.075 N/A THR 461.A OG1 ASP 333.A OD1 no hydrogen 2.869 N/A THR 461.A OG1 ASP 333.A OD2 no hydrogen 3.242 N/A CYS 462.A N ASP 333.A OD2 no hydrogen 2.906 N/A CYS 462.A SG ASP 333.A OD2 no hydrogen 3.915 N/A ARG 463.A N PHE 475.A O no hydrogen 2.842 N/A VAL 464.A N LEU 331.A O no hydrogen 2.849 N/A THR 465.A N CYS 473.A O no hydrogen 2.870 N/A GLN 466.A NE2 GLY 231.A O no hydrogen 3.006 N/A TYR 468.A N GLY 471.A O no hydrogen 2.730 N/A TYR 468.A OH ASN 239.A OD1 no hydrogen 3.214 N/A GLY 471.A N TYR 468.A O no hydrogen 3.438 N/A ALA 472.A N ALA 429.A O no hydrogen 2.926 N/A CYS 473.A N GLN 466.A O no hydrogen 3.124 N/A CYS 473.A SG THR 427.A O no hydrogen 3.705 N/A ILE 474.A N THR 427.A O no hydrogen 2.652 N/A PHE 475.A N ARG 463.A O no hydrogen 2.780 N/A PHE 476.A N PHE 425.A O no hydrogen 2.625 N/A TYR 477.A N THR 461.A O no hydrogen 2.950 N/A PHE 478.A N GLU 423.A O no hydrogen 3.083 N/A ALA 479.A N LEU 459.A O no hydrogen 3.031 N/A PHE 480.A N ILE 421.A O no hydrogen 3.006 N/A ASN 481.A ND2 PHE 56.A O no hydrogen 3.420 N/A TYR 482.A N TYR 419.A O no hydrogen 2.828 N/A ARG 483.A N ASN 481.A OD1 no hydrogen 2.873 N/A ILE 485.A N TYR 482.A O no hydrogen 2.696 N/A ALA 490.A N ASP 487.A O no hydrogen 3.138 N/A ALA 490.A N ASP 487.A OD1 no hydrogen 3.190 N/A VAL 491.A N ASP 487.A O no hydrogen 3.242 N/A PHE 492.A N PRO 488.A O no hydrogen 2.978 N/A GLU 493.A N LEU 489.A O no hydrogen 2.890 N/A GLN 494.A N ALA 490.A O no hydrogen 2.889 N/A THR 495.A N VAL 491.A O no hydrogen 3.141 N/A THR 495.A OG1 VAL 491.A O no hydrogen 2.741 N/A GLU 496.A N PHE 492.A O no hydrogen 3.024 N/A ALA 497.A N GLU 493.A O no hydrogen 3.031 N/A ALA 498.A N GLN 494.A O no hydrogen 2.961 N/A ALA 499.A N THR 495.A O no hydrogen 2.890 N/A ARG 500.A N GLU 496.A O no hydrogen 2.952 N/A ARG 500.A NH1 GLU 426.A O no hydrogen 3.090 N/A ARG 500.A NH1 SER 509.A O no hydrogen 3.015 N/A ARG 500.A NH2 GLU 426.A O no hydrogen 2.942 N/A GLU 501.A N ALA 497.A O no hydrogen 2.898 N/A GLU 502.A N ALA 498.A O no hydrogen 2.942 N/A ILE 503.A N ALA 499.A O no hydrogen 2.926 N/A ILE 503.A N ARG 500.A O no hydrogen 3.002 N/A LEU 504.A N ARG 500.A O no hydrogen 3.063 N/A ALA 505.A N GLU 501.A O no hydrogen 3.177 N/A ASN 506.A N GLU 502.A O no hydrogen 3.126 N/A ASN 506.A N ILE 503.A O no hydrogen 2.922 N/A ASN 506.A ND2 GLU 502.A O no hydrogen 2.803 N/A ASN 506.A ND2 GLU 502.A OE2 no hydrogen 2.778 N/A GLY 507.A N LEU 504.A O no hydrogen 3.262 N/A GLY 508.A N ILE 503.A O no hydrogen 3.100 N/A SER 509.A N SER 428.A O no hydrogen 2.928 N/A SER 509.A OG SER 428.A O no hydrogen 3.479 N/A SER 509.A OG SER 428.A OG no hydrogen 2.855 N/A SER 509.A OG SER 511.A O no hydrogen 3.243 N/A SER 511.A OG GLU 426.A OE2 no hydrogen 2.894 N/A HIS 512.A N GLU 426.A OE1 no hydrogen 2.768 N/A HIS 513.A N GLU 426.A OE1 no hydrogen 3.330 N/A HIS 514.A N GLU 426.A OE2 no hydrogen 2.758 N/A GLY 515.A N SER 511.A OG no hydrogen 3.031 N/A VAL 516.A N GLU 279.A OE2 no hydrogen 2.803 N/A GLY 517.A N GLU 279.A OE1 no hydrogen 2.718 N/A LYS 518.A N SER 153.A O no hydrogen 2.763 N/A LYS 518.A NZ TYR 154.A O no hydrogen 2.862 N/A LYS 518.A NZ MET 157.A O no hydrogen 2.780 N/A LYS 518.A NZ ASN 551.A O no hydrogen 2.775 N/A LYS 518.A NZ ASN 553.A OD1 no hydrogen 3.163 N/A LEU 519.A N SER 153.A O no hydrogen 2.989 N/A ARG 520.A N VAL 516.A O no hydrogen 3.072 N/A ARG 520.A NH1 GLY 515.A O no hydrogen 2.692 N/A LYS 521.A NZ ARG 552.A O no hydrogen 2.564 N/A TRP 523.A N ARG 520.A O no hydrogen 3.121 N/A TRP 523.A NE1 GLU 501.A OE2 no hydrogen 3.075 N/A LEU 524.A N LYS 521.A O no hydrogen 3.217 N/A SER 527.A N TRP 523.A O no hydrogen 3.155 N/A SER 527.A OG TRP 523.A O no hydrogen 3.127 N/A ILE 528.A N LEU 524.A O no hydrogen 2.857 N/A SER 529.A OG ILE 528.A O no hydrogen 2.481 N/A GLY 532.A N SER 529.A OG no hydrogen 3.157 N/A PHE 533.A N SER 529.A O no hydrogen 2.981 N/A GLY 534.A N ASP 530.A O no hydrogen 2.795 N/A MET 535.A N VAL 531.A O no hydrogen 2.905 N/A MET 535.A N GLY 532.A O no hydrogen 2.944 N/A LEU 536.A N GLY 532.A O no hydrogen 3.184 N/A LYS 537.A N PHE 533.A O no hydrogen 3.071 N/A LYS 537.A NZ ASP 541.A OD2 no hydrogen 3.030 N/A SER 538.A N GLY 534.A O no hydrogen 3.118 N/A SER 538.A OG MET 535.A O no hydrogen 2.752 N/A VAL 539.A N MET 535.A O no hydrogen 3.083 N/A LYS 540.A N LEU 536.A O no hydrogen 3.030 N/A LYS 540.A NZ THR 281.A O no hydrogen 2.686 N/A LYS 540.A NZ ASP 544.A OD2 no hydrogen 2.934 N/A LYS 540.A NZ PHE 549.A O no hydrogen 2.741 N/A ASP 541.A N LYS 537.A O no hydrogen 2.656 N/A TYR 542.A N SER 538.A O no hydrogen 3.129 N/A VAL 543.A N VAL 539.A O no hydrogen 2.978 N/A ASP 544.A N LYS 540.A O no hydrogen 2.989 N/A ASN 547.A N ASP 544.A O no hydrogen 2.881 N/A ILE 548.A N ASP 544.A OD1 no hydrogen 2.830 N/A PHE 549.A N ASP 544.A OD2 no hydrogen 2.755 N/A ASN 551.A ND2 GLU 279.A O no hydrogen 2.783 N/A ARG 552.A NH1 ASP 161.A OD1 no hydrogen 2.748 N/A ARG 552.A NH2 ASP 161.A OD1 no hydrogen 3.166 N/A ARG 552.A NH2 GLU 162.A OE1 no hydrogen 3.474 N/A ASN 553.A N ASN 551.A OD1 no hydrogen 2.994 N/A ASN 553.A ND2 GLY 155.A O no hydrogen 2.944 N/A ASN 553.A ND2 GLU 279.A O no hydrogen 2.893 N/A LEU 554.A N GLY 517.A O no hydrogen 2.946 N/A LEU 555.A N ASN 553.A O no hydrogen 2.686 N/A