Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2whr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A N ASP 5.A OD1 no hydrogen 2.684 N/A LEU 8.A N ASP 5.A O no hydrogen 3.157 N/A VAL 10.A N LEU 17.A O no hydrogen 3.057 N/A VAL 12.A N GLY 15.A O no hydrogen 2.788 N/A ARG 13.A N ASN 186.A OD1 no hydrogen 2.832 N/A ARG 13.A NE ARG 13.A O no hydrogen 2.804 N/A GLY 15.A N VAL 12.A O no hydrogen 2.855 N/A LEU 17.A N VAL 10.A O no hydrogen 2.677 N/A ARG 18.A N LEU 60.A O no hydrogen 2.955 N/A ARG 18.A NH1 GLU 4.A OE1 no hydrogen 3.286 N/A GLY 19.A N LEU 8.A O no hydrogen 2.879 N/A ILE 20.A N ALA 31.A O no hydrogen 2.759 N/A LEU 22.A N VAL 29.A O no hydrogen 2.830 N/A ALA 24.A N GLY 27.A O no hydrogen 2.827 N/A GLY 27.A N ALA 24.A O no hydrogen 2.887 N/A VAL 29.A N LEU 22.A O no hydrogen 2.818 N/A SER 30.A N THR 103.A O no hydrogen 2.781 N/A SER 30.A OG PRO 104.A O no hydrogen 2.883 N/A ALA 31.A N ILE 20.A O no hydrogen 2.810 N/A PHE 32.A N VAL 101.A O no hydrogen 2.711 N/A LEU 33.A N ALA 62.A O no hydrogen 2.845 N/A GLY 34.A N ASN 100.A OD1 no hydrogen 2.962 N/A ILE 35.A N LEU 99.A O no hydrogen 2.961 N/A PHE 37.A N LEU 97.A O no hydrogen 3.355 N/A GLU 39.A N GLU 51.A O no hydrogen 2.744 N/A VAL 42.A N PRO 40.A O no hydrogen 2.818 N/A ARG 45.A N VAL 42.A O no hydrogen 2.986 N/A ARG 46.A N GLY 43.A O no hydrogen 3.085 N/A ARG 46.A NE GLU 94.A OE1 no hydrogen 2.649 N/A ARG 46.A NH1 ARG 269.A O no hydrogen 2.777 N/A ARG 46.A NH2 GLU 94.A OE1 no hydrogen 3.289 N/A ARG 46.A NH2 GLU 94.A OE2 no hydrogen 2.808 N/A ARG 46.A NH2 ARG 269.A O no hydrogen 3.149 N/A MET 48.A N ARG 45.A O no hydrogen 2.953 N/A LYS 53.A N PHE 37.A O no hydrogen 3.423 N/A ARG 54.A N GLU 39.A OE2 no hydrogen 2.664 N/A ARG 54.A NH1 GLU 39.A OE1 no hydrogen 3.366 N/A TRP 56.A N GLY 14.A O no hydrogen 2.850 N/A TRP 56.A NE1 GLN 16.A O no hydrogen 3.101 N/A LEU 60.A N GLN 16.A O no hydrogen 2.745 N/A ALA 62.A N ARG 18.A O no hydrogen 2.819 N/A THR 63.A N ASP 61.A OD1 no hydrogen 3.064 N/A THR 63.A OG1 ASP 61.A OD1 no hydrogen 2.789 N/A THR 63.A OG1 ASP 61.A OD2 no hydrogen 2.967 N/A ASN 67.A N GLN 66.A OE1 no hydrogen 2.973 N/A ASN 67.A ND2 ASP 95.A O no hydrogen 3.046 N/A VAL 68.A N GLU 91.A O no hydrogen 2.902 N/A CYS 69.A SG CYS 96.A O no hydrogen 3.816 N/A TYR 70.A N SER 93.A O no hydrogen 3.087 N/A TYR 70.A OH GLN 272.A OE1 no hydrogen 3.044 N/A GLN 71.A NE2 CYS 69.A O no hydrogen 2.874 N/A GLN 71.A NE2 GLY 126.A O no hydrogen 2.955 N/A ASP 74.A N ASN 87.A OD1 no hydrogen 3.275 N/A LEU 76.A N ASP 74.A OD2 no hydrogen 3.324 N/A GLY 79.A N GLU 84.A OE2 no hydrogen 2.751 N/A PHE 80.A N TYR 77.A O no hydrogen 3.100 N/A THR 83.A N PHE 80.A O no hydrogen 3.127 N/A THR 83.A OG1 TYR 77.A O no hydrogen 3.092 N/A THR 83.A OG1 PHE 80.A O no hydrogen 3.026 N/A GLU 84.A N PHE 80.A O no hydrogen 2.948 N/A MET 85.A N GLU 81.A O no hydrogen 3.210 N/A TRP 86.A N THR 83.A O no hydrogen 3.321 N/A TRP 86.A NE1 TYR 442.A OH no hydrogen 3.298 N/A ASN 87.A N GLU 84.A O no hydrogen 2.989 N/A ASN 87.A ND2 ASP 74.A O no hydrogen 3.667 N/A ASN 87.A ND2 GLU 84.A OE1 no hydrogen 3.047 N/A ASN 89.A ND2 SER 129.A O no hydrogen 2.733 N/A ARG 90.A NH1.A ASN 89.A O no hydrogen 2.533 N/A ARG 90.A NH1.B PHE 65.A O no hydrogen 2.826 N/A SER 93.A N VAL 68.A O no hydrogen 2.949 N/A SER 93.A OG ASP 95.A O no hydrogen 3.370 N/A ASP 95.A N SER 93.A OG no hydrogen 2.841 N/A CYS 96.A SG GLU 94.A O no hydrogen 3.561 N/A TYR 98.A N CYS 96.A O no hydrogen 2.918 N/A TYR 98.A OH ASP 95.A OD1 no hydrogen 2.800 N/A TYR 98.A OH ASP 95.A OD2 no hydrogen 3.354 N/A LEU 99.A N ILE 35.A O no hydrogen 2.737 N/A ASN 100.A N SER 148.A O no hydrogen 2.747 N/A ASN 100.A ND2 SER 148.A OG no hydrogen 3.337 N/A VAL 101.A N PHE 32.A O no hydrogen 2.784 N/A TRP 102.A N LEU 146.A O no hydrogen 2.867 N/A THR 103.A N SER 30.A O no hydrogen 2.954 N/A THR 103.A OG1 PRO 104.A O no hydrogen 3.004 N/A TYR 105.A OH ASP 5.A OD1 no hydrogen 3.406 N/A TYR 105.A OH ASP 5.A OD2 no hydrogen 2.490 N/A THR 112.A N GLY 191.A O no hydrogen 2.800 N/A THR 112.A OG1 SER 110.A O no hydrogen 3.189 N/A THR 112.A OG1 GLY 191.A O no hydrogen 3.408 N/A VAL 114.A N SER 196.A O no hydrogen 2.665 N/A LEU 115.A N VAL 145.A O no hydrogen 2.837 N/A ILE 116.A N THR 198.A O no hydrogen 2.853 N/A TRP 117.A N VAL 147.A O no hydrogen 2.733 N/A ILE 118.A N PHE 200.A O no hydrogen 2.825 N/A TYR 119.A OH TYR 151.A O no hydrogen 2.887 N/A TYR 124.A N GLY 121.A O no hydrogen 2.977 N/A SER 125.A N GLY 121.A O no hydrogen 2.891 N/A SER 125.A OG GLY 121.A O no hydrogen 2.922 N/A GLY 126.A N GLN 71.A OE1 no hydrogen 3.004 N/A ALA 128.A N ASN 150.A OD1 no hydrogen 3.003 N/A SER 129.A OG ASN 89.A OD1 no hydrogen 2.645 N/A TYR 133.A N LEU 130.A O no hydrogen 3.012 N/A ASP 134.A N ASP 131.A O no hydrogen 3.188 N/A ARG 136.A N ASP 134.A OD1 no hydrogen 2.894 N/A ARG 136.A NE ASP 134.A OD1 no hydrogen 3.387 N/A ARG 136.A NE ASP 134.A OD2 no hydrogen 2.775 N/A ARG 136.A NH2 LYS 23.A O no hydrogen 2.848 N/A ALA 139.A N GLY 135.A O no hydrogen 3.172 N/A GLN 140.A N ARG 136.A O no hydrogen 2.890 N/A VAL 141.A N PHE 137.A O no hydrogen 2.853 N/A GLU 142.A N LEU 138.A O no hydrogen 3.081 N/A ALA 144.A N LEU 138.A O no hydrogen 3.202 N/A LEU 146.A N TRP 102.A O no hydrogen 2.930 N/A VAL 147.A N LEU 115.A O no hydrogen 2.776 N/A SER 148.A N ASN 100.A O no hydrogen 3.063 N/A ASN 150.A N TYR 98.A O no hydrogen 2.905 N/A ASN 150.A ND2 CYS 96.A O no hydrogen 3.453 N/A TYR 151.A N TYR 119.A OH no hydrogen 2.959 N/A TYR 151.A OH TYR 119.A O no hydrogen 2.736 N/A ARG 152.A N ASP 175.A OD2 no hydrogen 3.011 N/A ARG 152.A NE ASP 175.A OD1 no hydrogen 3.381 N/A ARG 152.A NE ASP 175.A OD2 no hydrogen 2.772 N/A ARG 152.A NH1 MET 48.A O no hydrogen 2.819 N/A ARG 152.A NH2 MET 48.A O no hydrogen 2.892 N/A ARG 152.A NH2 ASP 175.A OD1 no hydrogen 2.750 N/A GLY 154.A N PHE 123.A O no hydrogen 2.591 N/A GLY 157.A N VAL 153.A O no hydrogen 3.177 N/A GLY 157.A N GLY 154.A O no hydrogen 3.275 N/A PHE 158.A N GLY 154.A O no hydrogen 2.849 N/A PHE 158.A N THR 155.A O no hydrogen 3.197 N/A LEU 159.A N THR 155.A O no hydrogen 2.875 N/A LEU 161.A N ALA 167.A O no hydrogen 2.905 N/A SER 164.A N LEU 161.A O no hydrogen 2.884 N/A SER 164.A OG LEU 161.A O no hydrogen 2.956 N/A ARG 165.A N GLU 166.A OE1 no hydrogen 3.219 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.631 N/A ALA 167.A N SER 164.A OG no hydrogen 2.992 N/A ASN 170.A ND2 VAL 295.A O no hydrogen 2.892 N/A GLY 172.A N GLY 157.A O no hydrogen 2.741 N/A LEU 174.A N ASN 170.A O no hydrogen 3.038 N/A ASP 175.A N VAL 171.A O no hydrogen 2.795 N/A GLN 176.A N GLY 172.A O no hydrogen 3.284 N/A GLN 176.A NE2 SER 208.A OG no hydrogen 3.180 N/A ARG 177.A N LEU 173.A O no hydrogen 2.920 N/A ARG 177.A NE SER 218.A OG no hydrogen 2.957 N/A ARG 177.A NH2 SER 215.A OG no hydrogen 2.795 N/A ARG 177.A NH2 SER 218.A OG no hydrogen 2.963 N/A LEU 178.A N LEU 174.A O no hydrogen 2.876 N/A ALA 179.A N ASP 175.A O no hydrogen 3.115 N/A LEU 180.A N GLN 176.A O no hydrogen 3.029 N/A GLN 181.A N ARG 177.A O no hydrogen 2.967 N/A TRP 182.A N LEU 178.A O no hydrogen 2.908 N/A VAL 183.A N ALA 179.A O no hydrogen 2.890 N/A GLN 184.A N LEU 180.A O no hydrogen 3.036 N/A GLN 184.A NE2 PRO 194.A O no hydrogen 2.797 N/A GLU 185.A N GLN 181.A O no hydrogen 2.876 N/A ASN 186.A N TRP 182.A O no hydrogen 2.888 N/A ASN 186.A ND2 TRP 182.A O no hydrogen 2.865 N/A ILE 187.A N VAL 183.A O no hydrogen 2.892 N/A ALA 189.A N ASN 186.A O no hydrogen 2.923 N/A PHE 190.A N ILE 187.A O no hydrogen 2.995 N/A GLY 191.A N ALA 188.A O no hydrogen 2.957 N/A GLY 192.A N ILE 187.A O no hydrogen 2.924 N/A ASP 193.A N THR 112.A O no hydrogen 2.672 N/A MET 195.A N ASP 193.A OD1 no hydrogen 2.871 N/A SER 196.A N ASP 193.A O no hydrogen 2.920 N/A THR 198.A N VAL 114.A O no hydrogen 2.799 N/A THR 198.A OG1 ALA 477.A O no hydrogen 3.496 N/A LEU 199.A N ARG 224.A O no hydrogen 2.923 N/A PHE 200.A N ILE 116.A O no hydrogen 2.811 N/A GLY 201.A N VAL 226.A O no hydrogen 3.416 N/A SER 203.A N GLN 228.A O no hydrogen 2.915 N/A SER 203.A OG HIS 440.A NE2 no hydrogen 2.638 N/A GLY 205.A N GLU 202.A O no hydrogen 2.837 N/A ALA 207.A N SER 203.A O no hydrogen 3.006 N/A SER 208.A N ALA 204.A O no hydrogen 2.870 N/A SER 208.A OG ALA 204.A O no hydrogen 2.767 N/A VAL 209.A N GLY 205.A O no hydrogen 2.866 N/A GLY 210.A N ALA 206.A O no hydrogen 2.844 N/A MET 211.A N ALA 207.A O no hydrogen 2.912 N/A MET 211.A N SER 208.A O no hydrogen 2.959 N/A HIS 212.A N SER 208.A O no hydrogen 3.105 N/A HIS 212.A ND1 SER 218.A OG no hydrogen 3.004 N/A HIS 212.A NE2 GLN 176.A OE1 no hydrogen 2.977 N/A ILE 213.A N VAL 209.A O no hydrogen 3.135 N/A LEU 214.A N GLY 210.A O no hydrogen 3.146 N/A SER 215.A N HIS 212.A O no hydrogen 3.202 N/A SER 215.A OG PHE 300.A O no hydrogen 2.747 N/A SER 218.A N SER 215.A O no hydrogen 2.959 N/A SER 218.A OG HIS 212.A ND1 no hydrogen 3.004 N/A ARG 219.A N LEU 216.A O no hydrogen 2.848 N/A LEU 221.A N SER 218.A O no hydrogen 2.792 N/A HIS 223.A N VAL 197.A O no hydrogen 2.829 N/A HIS 223.A NE2 PRO 194.A O no hydrogen 3.125 N/A ARG 224.A N VAL 197.A O no hydrogen 3.363 N/A ARG 224.A NE ALA 477.A O no hydrogen 2.918 N/A ARG 224.A NH1 GLN 318.A OE1 no hydrogen 3.559 N/A ARG 224.A NH2 ALA 477.A O no hydrogen 2.773 N/A ALA 225.A N GLN 318.A O no hydrogen 3.154 N/A VAL 226.A N LEU 199.A O no hydrogen 2.782 N/A LEU 227.A N LEU 320.A O no hydrogen 2.765 N/A GLN 228.A N GLY 201.A O no hydrogen 3.047 N/A GLN 228.A NE2 GLU 443.A OE2 no hydrogen 2.965 N/A SER 229.A N GLY 322.A O no hydrogen 2.930 N/A SER 229.A OG GLU 327.A OE2 no hydrogen 2.743 N/A THR 231.A OG1 ASN 233.A O no hydrogen 2.669 N/A ASN 233.A ND2 PRO 403.A O no hydrogen 2.982 N/A TRP 236.A NE1 ASN 399.A O no hydrogen 3.059 N/A VAL 239.A N PRO 294.A O no hydrogen 3.037 N/A GLU 243.A N SER 240.A OG no hydrogen 2.938 N/A ALA 244.A N SER 240.A O no hydrogen 3.054 N/A ARG 245.A N ALA 241.A O no hydrogen 2.911 N/A ARG 245.A NH1 ASP 259.A OD1 no hydrogen 2.881 N/A ARG 245.A NH1 ASP 259.A OD2 no hydrogen 3.553 N/A ARG 245.A NH2 PRO 162.A O no hydrogen 3.042 N/A ARG 245.A NH2 ASP 259.A OD2 no hydrogen 2.829 N/A ARG 246.A N GLY 242.A O no hydrogen 2.944 N/A ARG 246.A NH1 GLU 243.A OE2 no hydrogen 3.284 N/A ARG 246.A NH1 VAL 281.A O no hydrogen 3.366 N/A ARG 246.A NH2 VAL 281.A O no hydrogen 3.162 N/A ARG 247.A N GLU 243.A O no hydrogen 2.918 N/A ARG 247.A NE GLU 243.A OE1 no hydrogen 2.597 N/A ARG 247.A NH1 PHE 290.A O no hydrogen 2.948 N/A ARG 247.A NH1 SER 291.A O no hydrogen 2.852 N/A ARG 247.A NH2 GLU 243.A OE1 no hydrogen 3.064 N/A ALA 248.A N ALA 244.A O no hydrogen 2.860 N/A THR 249.A N ARG 245.A O no hydrogen 3.049 N/A THR 249.A OG1 ARG 245.A O no hydrogen 3.463 N/A THR 249.A OG1 ARG 246.A O no hydrogen 3.135 N/A LEU 250.A N ARG 246.A O no hydrogen 3.082 N/A LEU 251.A N ARG 247.A O no hydrogen 2.945 N/A ALA 252.A N ALA 248.A O no hydrogen 2.880 N/A ARG 253.A N THR 249.A O no hydrogen 2.879 N/A LEU 254.A N LEU 250.A O no hydrogen 2.962 N/A VAL 255.A N LEU 251.A O no hydrogen 3.204 N/A VAL 255.A N ALA 252.A O no hydrogen 2.984 N/A GLY 256.A N ARG 253.A O no hydrogen 2.879 N/A CYS 257.A N ALA 252.A O no hydrogen 2.886 N/A THR 260.A OG1 GLU 166.A OE2 no hydrogen 2.509 N/A GLU 261.A N ASN 258.A O no hydrogen 3.201 N/A GLU 261.A N ASN 258.A OD1 no hydrogen 2.956 N/A LEU 262.A N ASN 258.A O no hydrogen 3.243 N/A ILE 263.A N ASP 259.A O no hydrogen 2.917 N/A ALA 264.A N THR 260.A O no hydrogen 2.986 N/A CYS 265.A N GLU 261.A O no hydrogen 3.035 N/A CYS 265.A SG GLY 256.A O no hydrogen 3.736 N/A LEU 266.A N LEU 262.A O no hydrogen 2.967 N/A ARG 267.A N ILE 263.A O no hydrogen 2.898 N/A THR 268.A N CYS 265.A O no hydrogen 2.973 N/A THR 268.A OG1 CYS 265.A O no hydrogen 2.603 N/A ARG 269.A N LEU 266.A O no hydrogen 3.105 N/A ARG 269.A NE VAL 255.A O no hydrogen 2.804 N/A ARG 269.A NH2 VAL 255.A O no hydrogen 3.253 N/A ARG 269.A NH2 GLY 256.A O no hydrogen 3.138 N/A GLN 272.A NE2 ASP 276.A OD1 no hydrogen 2.810 N/A ASP 273.A N PRO 270.A O no hydrogen 3.045 N/A LEU 274.A N ALA 271.A O no hydrogen 2.942 N/A VAL 275.A N ALA 271.A O no hydrogen 3.122 N/A ASP 276.A N GLN 272.A O no hydrogen 2.856 N/A HIS 277.A N LEU 274.A O no hydrogen 3.197 N/A HIS 277.A ND1 ASP 273.A O no hydrogen 2.908 N/A GLU 278.A N LEU 274.A O no hydrogen 3.001 N/A HIS 280.A N HIS 277.A O no hydrogen 2.954 N/A VAL 281.A N GLU 278.A O no hydrogen 3.444 N/A SER 286.A OG GLN 284.A O no hydrogen 3.542 N/A ILE 287.A N ILE 358.A O no hydrogen 3.397 N/A ARG 289.A NH1 PHE 288.A O no hydrogen 2.744 N/A ARG 289.A NH1 ASN 399.A OD1 no hydrogen 2.975 N/A ARG 289.A NH2 HIS 398.A NE2 no hydrogen 3.060 N/A SER 291.A OG GLU 278.A O no hydrogen 2.775 N/A VAL 295.A N ASN 170.A OD1 no hydrogen 2.805 N/A VAL 296.A N VAL 239.A O no hydrogen 2.997 N/A ASP 299.A N ASP 297.A OD1 no hydrogen 2.882 N/A PHE 300.A N ASP 297.A OD2 no hydrogen 3.038 N/A LEU 301.A N ASP 297.A OD1 no hydrogen 2.916 N/A THR 304.A N ASP 303.A OD1 no hydrogen 2.655 N/A ALA 307.A N THR 304.A OG1 no hydrogen 3.021 N/A LEU 308.A N THR 304.A O no hydrogen 3.004 N/A ILE 309.A N PRO 305.A O no hydrogen 2.882 N/A ASN 310.A N GLU 306.A O no hydrogen 3.200 N/A THR 311.A N ALA 307.A O no hydrogen 3.176 N/A THR 311.A OG1 ALA 307.A O no hydrogen 3.211 N/A PHE 314.A N GLN 414.A O no hydrogen 2.739 N/A GLN 315.A N ASP 313.A OD2 no hydrogen 3.396 N/A LEU 317.A N GLN 315.A O no hydrogen 2.674 N/A VAL 319.A N ARG 417.A O no hydrogen 2.763 N/A LEU 320.A N ALA 225.A O no hydrogen 2.879 N/A VAL 321.A N TYR 419.A O no hydrogen 2.777 N/A GLY 322.A N LEU 227.A O no hydrogen 3.321 N/A VAL 323.A N TYR 421.A O no hydrogen 3.224 N/A VAL 324.A N GLU 327.A OE2 no hydrogen 2.705 N/A LYS 325.A N PHE 423.A O no hydrogen 3.003 N/A LYS 325.A NZ ASP 326.A OD1 no hydrogen 2.708 N/A ASP 326.A N VAL 438.A O no hydrogen 2.985 N/A SER 329.A OG MET 436.A O no hydrogen 2.858 N/A PHE 331.A N GLY 328.A O no hydrogen 3.079 N/A LEU 332.A N SER 329.A O no hydrogen 3.159 N/A TYR 334.A N PHE 331.A O no hydrogen 3.098 N/A TYR 334.A OH ASP 74.A OD1 no hydrogen 2.976 N/A TYR 334.A OH ASP 74.A OD2 no hydrogen 2.687 N/A GLY 335.A N LEU 332.A O no hydrogen 3.407 N/A VAL 336.A N LEU 332.A O no hydrogen 2.930 N/A PHE 339.A N VAL 336.A O no hydrogen 3.080 N/A SER 340.A N SER 345.A OG no hydrogen 3.020 N/A LYS 341.A N TYR 77.A OH no hydrogen 3.190 N/A LYS 341.A NZ ASP 342.A OD1 no hydrogen 3.006 N/A ASP 342.A N SER 340.A OG no hydrogen 3.216 N/A SER 345.A N ASN 343.A OD1 no hydrogen 2.869 N/A SER 345.A OG ASN 343.A O no hydrogen 3.458 N/A SER 348.A N GLN 351.A OE1 no hydrogen 3.127 N/A SER 348.A OG GLN 351.A OE1 no hydrogen 3.551 N/A ARG 349.A NH1 THR 376.A OG1 no hydrogen 2.942 N/A ARG 349.A NH1 PRO 381.A O no hydrogen 3.005 N/A ARG 349.A NH2 THR 376.A OG1 no hydrogen 2.805 N/A GLN 351.A N SER 348.A OG no hydrogen 3.214 N/A PHE 352.A N SER 348.A O no hydrogen 2.948 N/A LEU 353.A N ARG 349.A O no hydrogen 3.036 N/A ALA 354.A N ALA 350.A O no hydrogen 3.056 N/A GLY 355.A N GLN 351.A O no hydrogen 2.824 N/A VAL 356.A N PHE 352.A O no hydrogen 2.931 N/A ARG 357.A N LEU 353.A O no hydrogen 3.309 N/A ARG 357.A NH1 ASP 365.A OD1 no hydrogen 2.819 N/A ARG 357.A NH2 ALA 363.A O no hydrogen 2.994 N/A ARG 357.A NH2 ASP 365.A OD1 no hydrogen 3.112 N/A ILE 358.A N ALA 354.A O no hydrogen 3.288 N/A GLY 359.A N GLY 355.A O no hydrogen 2.697 N/A VAL 360.A N VAL 356.A O no hydrogen 2.796 N/A GLN 362.A NE2 HIS 398.A NE2 no hydrogen 3.469 N/A ALA 363.A N VAL 360.A O no hydrogen 2.912 N/A ALA 368.A N SER 364.A O no hydrogen 3.045 N/A GLU 369.A N ASP 365.A O no hydrogen 2.938 N/A ALA 370.A N LEU 366.A O no hydrogen 2.833 N/A VAL 371.A N ALA 367.A O no hydrogen 2.997 N/A VAL 372.A N ALA 368.A O no hydrogen 2.909 N/A LEU 373.A N GLU 369.A O no hydrogen 2.813 N/A HIS 374.A N ALA 370.A O no hydrogen 2.933 N/A HIS 374.A NE2 THR 521.A OG1 no hydrogen 3.199 N/A TYR 375.A N VAL 371.A O no hydrogen 2.994 N/A TYR 375.A OH ASP 397.A OD2 no hydrogen 2.540 N/A THR 376.A N VAL 372.A O no hydrogen 2.951 N/A THR 376.A OG1 VAL 372.A O no hydrogen 2.698 N/A TRP 378.A NE1 LEU 373.A O no hydrogen 3.034 N/A LEU 379.A N ASP 377.A OD1 no hydrogen 3.091 N/A HIS 380.A N ASP 377.A O no hydrogen 2.738 N/A ASP 383.A N HIS 380.A O no hydrogen 3.165 N/A HIS 386.A N ASP 383.A OD2 no hydrogen 3.034 N/A HIS 386.A NE2 TYR 375.A O no hydrogen 3.002 N/A LEU 387.A N ASP 383.A O no hydrogen 2.960 N/A ARG 388.A N PRO 384.A O no hydrogen 2.999 N/A ARG 388.A NE GLU 344.A O no hydrogen 2.830 N/A ARG 388.A NH1 ASP 389.A OD1 no hydrogen 2.820 N/A ARG 388.A NH2 GLU 344.A O no hydrogen 3.094 N/A ASP 389.A N THR 385.A O no hydrogen 3.087 N/A ALA 390.A N HIS 386.A O no hydrogen 2.717 N/A MET 391.A N LEU 387.A O no hydrogen 2.904 N/A SER 392.A N ARG 388.A O no hydrogen 3.199 N/A ALA 393.A N ASP 389.A O no hydrogen 3.061 N/A VAL 394.A N ALA 390.A O no hydrogen 2.830 N/A VAL 395.A N MET 391.A O no hydrogen 3.284 N/A GLY 396.A N SER 392.A O no hydrogen 2.807 N/A ASP 397.A N ALA 393.A O no hydrogen 2.655 N/A HIS 398.A N VAL 394.A O no hydrogen 3.008 N/A ASN 399.A N VAL 395.A O no hydrogen 3.141 N/A ASN 399.A ND2 VAL 395.A O no hydrogen 2.811 N/A VAL 400.A N GLY 396.A O no hydrogen 3.028 N/A VAL 401.A N GLY 396.A O no hydrogen 3.050 N/A CYS 402.A N ASP 397.A O no hydrogen 3.033 N/A VAL 404.A N VAL 400.A O no hydrogen 2.850 N/A ALA 405.A N VAL 401.A O no hydrogen 2.949 N/A GLN 406.A N CYS 402.A O no hydrogen 2.850 N/A LEU 407.A N PRO 403.A O no hydrogen 2.933 N/A ALA 408.A N VAL 404.A O no hydrogen 2.810 N/A GLY 409.A N ALA 405.A O no hydrogen 3.023 N/A ARG 410.A N GLN 406.A O no hydrogen 3.152 N/A ARG 410.A NE GLN 414.A OE1 no hydrogen 3.083 N/A ARG 410.A NH2 GLN 414.A OE1 no hydrogen 2.895 N/A LEU 411.A N LEU 407.A O no hydrogen 2.946 N/A ALA 412.A N ALA 408.A O no hydrogen 2.872 N/A ALA 413.A N GLY 409.A O no hydrogen 2.913 N/A GLN 414.A N LEU 411.A O no hydrogen 3.073 N/A GLN 414.A NE2 ILE 309.A O no hydrogen 2.954 N/A GLN 414.A NE2 GLY 312.A O no hydrogen 2.644 N/A GLY 415.A N ALA 412.A O no hydrogen 3.411 N/A ALA 416.A N LEU 411.A O no hydrogen 3.077 N/A ARG 417.A N LEU 317.A O no hydrogen 2.872 N/A ARG 417.A NE TYR 419.A OH no hydrogen 3.434 N/A TYR 419.A N VAL 319.A O no hydrogen 2.821 N/A TYR 421.A N VAL 321.A O no hydrogen 2.972 N/A ILE 422.A N VAL 504.A O no hydrogen 2.880 N/A PHE 423.A N VAL 323.A O no hydrogen 2.689 N/A GLU 424.A N LEU 506.A O no hydrogen 2.986 N/A HIS 425.A NE2 GLU 462.A OE2 no hydrogen 2.797 N/A ARG 426.A NE GLY 437.A O no hydrogen 2.931 N/A ARG 426.A NH1 TRP 432.A O no hydrogen 3.428 N/A ARG 426.A NH2 TRP 432.A O no hydrogen 3.238 N/A ARG 426.A NH2 GLY 437.A O no hydrogen 3.408 N/A SER 428.A N GLU 462.A OE2 no hydrogen 2.714 N/A SER 428.A OG GLU 462.A OE1 no hydrogen 2.630 N/A SER 428.A OG GLU 462.A OE2 no hydrogen 3.256 N/A LEU 430.A N ALA 427.A O no hydrogen 3.021 N/A TRP 432.A NE1 TYR 442.A OH no hydrogen 2.762 N/A TRP 435.A NE1 SER 340.A O no hydrogen 3.148 N/A MET 436.A N PRO 433.A O no hydrogen 3.157 N/A GLY 437.A N LEU 434.A O no hydrogen 2.862 N/A VAL 438.A N ASP 326.A OD1 no hydrogen 2.519 N/A HIS 440.A ND1 GLU 327.A OE1 no hydrogen 2.646 N/A HIS 440.A NE2 SER 203.A OG no hydrogen 2.638 N/A TYR 442.A N PRO 439.A O no hydrogen 3.068 N/A GLU 443.A N GLU 443.A OE1 no hydrogen 2.607 N/A PHE 446.A N GLU 443.A O no hydrogen 2.981 N/A ILE 447.A N GLU 443.A O no hydrogen 3.163 N/A PHE 448.A N ILE 444.A O no hydrogen 3.027 N/A GLY 449.A N PHE 446.A O no hydrogen 2.983 N/A LEU 450.A N GLU 445.A O no hydrogen 2.954 N/A LEU 452.A N GLY 449.A O no hydrogen 2.916 N/A ASP 453.A N LEU 450.A O no hydrogen 2.819 N/A SER 455.A N ASP 453.A OD1 no hydrogen 3.017 N/A SER 455.A OG ASP 453.A OD1 no hydrogen 2.744 N/A LEU 456.A N ASP 453.A O no hydrogen 2.885 N/A TYR 458.A OH GLU 445.A OE1 no hydrogen 2.586 N/A THR 459.A N GLU 462.A OE1 no hydrogen 2.825 N/A THR 459.A OG1 GLU 462.A OE1 no hydrogen 3.395 N/A GLU 461.A N GLU 461.A OE1 no hydrogen 2.543 N/A GLU 462.A N THR 459.A OG1 no hydrogen 2.963 N/A ARG 463.A N THR 459.A O no hydrogen 2.967 N/A ILE 464.A N THR 460.A O no hydrogen 2.952 N/A PHE 465.A N GLU 461.A O no hydrogen 2.822 N/A ALA 466.A N GLU 462.A O no hydrogen 2.868 N/A GLN 467.A N ARG 463.A O no hydrogen 3.092 N/A ARG 468.A N ILE 464.A O no hydrogen 3.072 N/A ARG 468.A NH1 ASN 507.A O no hydrogen 3.072 N/A ARG 468.A NH1 LYS 509.A O no hydrogen 3.448 N/A ARG 468.A NH2 TYR 472.A OH no hydrogen 2.875 N/A LEU 469.A N PHE 465.A O no hydrogen 3.011 N/A MET 470.A N ALA 466.A O no hydrogen 2.831 N/A LYS 471.A N GLN 467.A O no hydrogen 3.037 N/A LYS 471.A NZ GLU 142.A OE2 no hydrogen 3.155 N/A TYR 472.A N ARG 468.A O no hydrogen 2.912 N/A TRP 473.A N LEU 469.A O no hydrogen 2.950 N/A TRP 473.A NE1 GLN 228.A OE1 no hydrogen 2.967 N/A THR 474.A N MET 470.A O no hydrogen 2.915 N/A THR 474.A OG1 MET 470.A O no hydrogen 2.690 N/A THR 474.A OG1 LYS 471.A O no hydrogen 3.224 N/A ASN 475.A N LYS 471.A O no hydrogen 2.720 N/A ASN 475.A ND2 PRO 482.A O no hydrogen 3.403 N/A PHE 476.A N TYR 472.A O no hydrogen 3.015 N/A ALA 477.A N TRP 473.A O no hydrogen 2.929 N/A ARG 478.A N THR 474.A O no hydrogen 2.894 N/A ARG 478.A NH2 GLU 142.A OE1 no hydrogen 3.179 N/A ARG 478.A NH2 ASN 475.A OD1 no hydrogen 2.990 N/A THR 479.A N ASN 475.A O no hydrogen 2.912 N/A THR 479.A OG1 ASN 475.A O no hydrogen 2.869 N/A GLY 480.A N PHE 476.A O no hydrogen 2.700 N/A ASN 483.A N ASP 481.A OD1 no hydrogen 2.901 N/A ASN 483.A ND2 ASP 481.A OD1 no hydrogen 2.861 N/A ASN 483.A ND2 TRP 493.A O no hydrogen 2.971 N/A ARG 486.A N ASP 484.A OD2 no hydrogen 3.080 N/A ASP 487.A N ASP 484.A OD2 no hydrogen 3.400 N/A SER 488.A OG ARG 486.A O no hydrogen 3.561 N/A SER 490.A N ASP 487.A OD2 no hydrogen 2.899 N/A SER 490.A OG ASP 487.A OD1 no hydrogen 2.578 N/A SER 490.A OG ASP 487.A OD2 no hydrogen 3.301 N/A GLN 492.A NE2 SER 490.A O no hydrogen 3.253 N/A TRP 493.A N ASN 483.A OD1 no hydrogen 2.753 N/A TYR 496.A N VAL 418.A O no hydrogen 2.591 N/A ALA 500.A N THR 497.A OG1 no hydrogen 3.073 N/A GLN 501.A N THR 497.A O no hydrogen 2.699 N/A GLN 501.A NE2 THR 498.A O no hydrogen 3.604 N/A TYR 503.A N ARG 514.A O no hydrogen 2.880 N/A VAL 504.A N ALA 420.A O no hydrogen 3.039 N/A SER 505.A N GLU 512.A O no hydrogen 2.971 N/A SER 505.A OG GLU 512.A O no hydrogen 3.180 N/A LEU 506.A N ILE 422.A O no hydrogen 2.846 N/A ASN 507.A ND2 GLU 424.A OE1 no hydrogen 3.067 N/A LYS 509.A N ASN 507.A OD1 no hydrogen 2.911 N/A ARG 514.A N TYR 503.A O no hydrogen 2.698 N/A ARG 514.A NE GLU 512.A OE2 no hydrogen 3.104 N/A ARG 514.A NH1 GLU 424.A OE2 no hydrogen 2.658 N/A ARG 514.A NH2 GLU 424.A OE1 no hydrogen 2.920 N/A ARG 514.A NH2 GLU 424.A OE2 no hydrogen 3.468 N/A ARG 515.A NE ALA 500.A O no hydrogen 2.987 N/A GLY 516.A N GLN 501.A O no hydrogen 2.666 N/A THR 521.A OG1 HIS 374.A NE2 no hydrogen 3.199 N/A CYS 522.A N ARG 518.A O no hydrogen 2.693 N/A CYS 522.A SG LEU 517.A O no hydrogen 3.941 N/A ALA 523.A N ALA 519.A O no hydrogen 2.961 N/A TRP 525.A N THR 521.A O no hydrogen 3.239 N/A TRP 525.A NE1 TYR 375.A OH no hydrogen 2.703 N/A ASN 526.A N CYS 522.A O no hydrogen 2.714 N/A ASN 526.A ND2 CYS 402.A O no hydrogen 3.093 N/A ARG 527.A N ALA 523.A O no hydrogen 2.968 N/A PHE 528.A N ALA 523.A O no hydrogen 3.202 N/A LEU 529.A N PHE 524.A O no hydrogen 2.859 N/A LEU 532.A N PHE 528.A O no hydrogen 3.012 N/A LEU 533.A N LEU 529.A O no hydrogen 2.952 N/A SER 534.A N PRO 530.A O no hydrogen 3.137 N/A SER 534.A OG PRO 530.A O no hydrogen 3.337 N/A SER 534.A OG LYS 531.A O no hydrogen 3.484 N/A ALA 535.A N LEU 533.A O no hydrogen 2.798 N/A