Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xuh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N GLU 1.A O no hydrogen 3.265 N/A GLN 7.A N ASP 5.A OD1 no hydrogen 3.005 N/A LEU 8.A N ASP 5.A O no hydrogen 3.043 N/A VAL 10.A N LEU 17.A O no hydrogen 3.116 N/A VAL 12.A N GLY 15.A O no hydrogen 2.702 N/A ARG 13.A N ASN 186.A OD1 no hydrogen 2.737 N/A ARG 13.A NH1 ARG 13.A O no hydrogen 2.895 N/A GLY 15.A N VAL 12.A O no hydrogen 2.863 N/A LEU 17.A N VAL 10.A O no hydrogen 2.699 N/A ARG 18.A N LEU 60.A O no hydrogen 2.926 N/A ARG 18.A NH1 GLU 4.A OE2 no hydrogen 3.120 N/A ARG 18.A NH2 ASP 61.A OD2 no hydrogen 3.405 N/A GLY 19.A N LEU 8.A O no hydrogen 2.953 N/A ILE 20.A N ALA 31.A O no hydrogen 2.908 N/A LEU 22.A N VAL 29.A O no hydrogen 2.850 N/A ALA 24.A N GLY 27.A O no hydrogen 2.962 N/A GLY 27.A N ALA 24.A O no hydrogen 2.897 N/A VAL 29.A N LEU 22.A O no hydrogen 2.947 N/A SER 30.A N THR 103.A O no hydrogen 2.824 N/A SER 30.A OG PRO 104.A O no hydrogen 3.227 N/A ALA 31.A N ILE 20.A O no hydrogen 3.024 N/A PHE 32.A N VAL 101.A O no hydrogen 2.748 N/A LEU 33.A N ALA 62.A O no hydrogen 2.873 N/A GLY 34.A N ASN 100.A OD1 no hydrogen 3.152 N/A ILE 35.A N LEU 99.A O no hydrogen 2.867 N/A PHE 37.A N LEU 97.A O no hydrogen 3.267 N/A GLU 39.A N GLU 51.A O no hydrogen 2.821 N/A ARG 45.A N VAL 42.A O no hydrogen 2.969 N/A ARG 46.A N GLY 43.A O no hydrogen 3.245 N/A ARG 46.A NE GLU 94.A OE1 no hydrogen 3.003 N/A ARG 46.A NE GLU 94.A OE2 no hydrogen 3.330 N/A ARG 46.A NH1 LEU 268.A O no hydrogen 2.855 N/A ARG 46.A NH1 ARG 271.A O no hydrogen 2.630 N/A ARG 46.A NH2 GLU 94.A OE2 no hydrogen 2.766 N/A ARG 46.A NH2 ARG 271.A O no hydrogen 2.902 N/A MET 48.A N ARG 45.A O no hydrogen 2.904 N/A LYS 53.A N PHE 37.A O no hydrogen 3.248 N/A ARG 54.A N GLU 39.A OE2 no hydrogen 2.850 N/A TRP 56.A N GLY 14.A O no hydrogen 2.798 N/A TRP 56.A NE1 GLN 16.A O no hydrogen 3.259 N/A LEU 60.A N GLN 16.A O no hydrogen 2.834 N/A ALA 62.A N ARG 18.A O no hydrogen 2.700 N/A THR 63.A N ASP 61.A OD1 no hydrogen 3.130 N/A THR 63.A OG1 ASP 61.A OD1 no hydrogen 2.584 N/A THR 64.A OG1 PHE 65.A O no hydrogen 3.466 N/A ASN 67.A ND2 ASP 95.A O no hydrogen 3.166 N/A VAL 68.A N GLU 91.A O no hydrogen 2.937 N/A CYS 69.A SG CYS 96.A O no hydrogen 3.749 N/A CYS 69.A SG TYR 151.A O no hydrogen 3.494 N/A TYR 70.A OH GLN 274.A OE1 no hydrogen 2.591 N/A GLN 71.A NE2 CYS 69.A O no hydrogen 2.832 N/A GLN 71.A NE2 GLY 126.A O no hydrogen 2.903 N/A ASP 74.A N ASN 87.A OD1 no hydrogen 2.982 N/A GLY 79.A N GLU 84.A OE2 no hydrogen 2.984 N/A PHE 80.A N TYR 77.A O no hydrogen 3.370 N/A THR 83.A N PHE 80.A O no hydrogen 3.318 N/A THR 83.A OG1 TYR 77.A O no hydrogen 3.178 N/A THR 83.A OG1 PHE 80.A O no hydrogen 3.371 N/A GLU 84.A N PHE 80.A O no hydrogen 3.082 N/A MET 85.A N GLU 81.A O no hydrogen 2.926 N/A TRP 86.A N THR 83.A O no hydrogen 3.007 N/A TRP 86.A NE1 TYR 444.A OH no hydrogen 3.176 N/A ASN 87.A N GLU 84.A O no hydrogen 2.892 N/A ASN 87.A ND2 ASP 74.A O no hydrogen 3.199 N/A ASN 87.A ND2 GLU 84.A OE1 no hydrogen 3.008 N/A ASN 89.A ND2 SER 129.A O no hydrogen 2.759 N/A ARG 90.A NH2 ASN 89.A O no hydrogen 2.760 N/A SER 93.A N VAL 68.A O no hydrogen 3.023 N/A SER 93.A OG ASP 95.A O no hydrogen 3.402 N/A ASP 95.A N SER 93.A OG no hydrogen 3.072 N/A CYS 96.A SG GLU 94.A O no hydrogen 3.389 N/A TYR 98.A N CYS 96.A O no hydrogen 2.971 N/A TYR 98.A OH ASP 95.A OD1 no hydrogen 2.586 N/A TYR 98.A OH ASP 95.A OD2 no hydrogen 3.279 N/A LEU 99.A N ILE 35.A O no hydrogen 2.844 N/A ASN 100.A N SER 148.A O no hydrogen 2.688 N/A ASN 100.A ND2 SER 148.A OG no hydrogen 3.318 N/A VAL 101.A N PHE 32.A O no hydrogen 2.883 N/A TRP 102.A N LEU 146.A O no hydrogen 2.825 N/A THR 103.A N SER 30.A O no hydrogen 2.860 N/A THR 103.A OG1 PRO 104.A O no hydrogen 3.006 N/A TYR 105.A OH ASP 5.A OD1 no hydrogen 3.392 N/A TYR 105.A OH ASP 5.A OD2 no hydrogen 2.429 N/A ARG 107.A N GLN 7.A OE1 no hydrogen 2.796 N/A THR 112.A N GLY 191.A O no hydrogen 2.952 N/A THR 112.A OG1 SER 110.A O no hydrogen 3.026 N/A VAL 114.A N SER 196.A O no hydrogen 2.800 N/A LEU 115.A N VAL 145.A O no hydrogen 2.833 N/A ILE 116.A N THR 198.A O no hydrogen 2.786 N/A TRP 117.A N VAL 147.A O no hydrogen 2.861 N/A ILE 118.A N PHE 200.A O no hydrogen 2.874 N/A TYR 119.A OH TYR 151.A O no hydrogen 2.813 N/A TYR 124.A N GLY 121.A O no hydrogen 3.007 N/A SER 125.A N GLY 121.A O no hydrogen 2.867 N/A SER 125.A OG GLY 121.A O no hydrogen 2.966 N/A GLY 126.A N GLN 71.A OE1 no hydrogen 2.909 N/A ALA 128.A N ASN 150.A OD1 no hydrogen 3.046 N/A SER 129.A OG ASN 89.A OD1 no hydrogen 2.681 N/A TYR 133.A N LEU 130.A O no hydrogen 2.881 N/A ASP 134.A N ASP 131.A O no hydrogen 3.104 N/A ARG 136.A N ASP 134.A OD1 no hydrogen 2.931 N/A ARG 136.A NE ASP 134.A OD1 no hydrogen 3.327 N/A ARG 136.A NE ASP 134.A OD2 no hydrogen 2.705 N/A ARG 136.A NH2 LYS 23.A O no hydrogen 2.794 N/A ALA 139.A N GLY 135.A O no hydrogen 3.048 N/A GLN 140.A N ARG 136.A O no hydrogen 2.787 N/A VAL 141.A N PHE 137.A O no hydrogen 2.762 N/A GLU 142.A N LEU 138.A O no hydrogen 3.002 N/A ALA 144.A N LEU 138.A O no hydrogen 3.311 N/A VAL 145.A N PRO 113.A O no hydrogen 3.383 N/A LEU 146.A N TRP 102.A O no hydrogen 2.927 N/A VAL 147.A N LEU 115.A O no hydrogen 2.811 N/A SER 148.A N ASN 100.A O no hydrogen 2.936 N/A ASN 150.A N TYR 98.A O no hydrogen 2.933 N/A ASN 150.A ND2 CYS 96.A O no hydrogen 3.130 N/A TYR 151.A N TYR 119.A OH no hydrogen 3.049 N/A TYR 151.A OH TYR 119.A O no hydrogen 2.554 N/A ARG 152.A N ASP 175.A OD2 no hydrogen 2.990 N/A ARG 152.A NE ASP 175.A OD2 no hydrogen 2.794 N/A ARG 152.A NH1 MET 48.A O no hydrogen 2.820 N/A ARG 152.A NH2 MET 48.A O no hydrogen 3.047 N/A ARG 152.A NH2 ASP 175.A OD1 no hydrogen 2.589 N/A ARG 152.A NH2 ASP 175.A OD2 no hydrogen 3.436 N/A GLY 154.A N PHE 123.A O no hydrogen 2.609 N/A GLY 157.A N VAL 153.A O no hydrogen 3.089 N/A GLY 157.A N GLY 154.A O no hydrogen 3.137 N/A PHE 158.A N GLY 154.A O no hydrogen 2.822 N/A PHE 158.A N THR 155.A O no hydrogen 3.141 N/A LEU 159.A N THR 155.A O no hydrogen 2.933 N/A LEU 161.A N ALA 167.A O no hydrogen 2.980 N/A SER 164.A N LEU 161.A O no hydrogen 3.026 N/A SER 164.A OG LEU 161.A O no hydrogen 2.769 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.917 N/A ALA 167.A N SER 164.A OG no hydrogen 3.214 N/A ASN 170.A ND2 VAL 297.A O no hydrogen 2.760 N/A ASN 170.A ND2 ASP 299.A OD2 no hydrogen 3.129 N/A GLY 172.A N GLY 157.A O no hydrogen 2.995 N/A LEU 173.A N ASN 170.A O no hydrogen 2.939 N/A LEU 174.A N ASN 170.A O no hydrogen 3.135 N/A ASP 175.A N VAL 171.A O no hydrogen 2.763 N/A GLN 176.A N GLY 172.A O no hydrogen 3.333 N/A GLN 176.A NE2 SER 208.A OG no hydrogen 3.166 N/A ARG 177.A N LEU 173.A O no hydrogen 2.932 N/A ARG 177.A NE.A SER 218.A OG no hydrogen 2.724 N/A ARG 177.A NH2.A SER 215.A OG no hydrogen 2.765 N/A ARG 177.A NH2.A SER 218.A OG no hydrogen 2.960 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 3.075 N/A LEU 180.A N GLN 176.A O no hydrogen 3.034 N/A GLN 181.A N ARG 177.A O no hydrogen 2.898 N/A TRP 182.A N LEU 178.A O no hydrogen 2.874 N/A VAL 183.A N ALA 179.A O no hydrogen 2.862 N/A GLN 184.A N LEU 180.A O no hydrogen 3.070 N/A GLU 185.A N GLN 181.A O no hydrogen 3.008 N/A ASN 186.A N TRP 182.A O no hydrogen 2.878 N/A ASN 186.A ND2 TRP 182.A O no hydrogen 2.951 N/A ILE 187.A N VAL 183.A O no hydrogen 2.938 N/A ALA 189.A N ASN 186.A O no hydrogen 2.868 N/A PHE 190.A N ILE 187.A O no hydrogen 3.064 N/A GLY 191.A N ALA 188.A O no hydrogen 2.946 N/A GLY 192.A N ILE 187.A O no hydrogen 2.871 N/A ASP 193.A N THR 112.A O no hydrogen 2.647 N/A MET 195.A N ASP 193.A OD1 no hydrogen 2.765 N/A SER 196.A N ASP 193.A O no hydrogen 2.978 N/A THR 198.A N VAL 114.A O no hydrogen 2.923 N/A LEU 199.A N ARG 224.A O no hydrogen 2.867 N/A PHE 200.A N ILE 116.A O no hydrogen 2.815 N/A GLY 201.A N VAL 226.A O no hydrogen 3.345 N/A SER 203.A N GLN 228.A O no hydrogen 2.946 N/A SER 203.A OG HIS 442.A NE2 no hydrogen 2.786 N/A GLY 205.A N GLU 202.A O no hydrogen 2.867 N/A ALA 207.A N SER 203.A O no hydrogen 3.025 N/A SER 208.A N ALA 204.A O no hydrogen 2.896 N/A SER 208.A OG ALA 204.A O no hydrogen 2.882 N/A VAL 209.A N GLY 205.A O no hydrogen 2.878 N/A GLY 210.A N ALA 206.A O no hydrogen 2.901 N/A MET 211.A N ALA 207.A O no hydrogen 2.792 N/A HIS 212.A N SER 208.A O no hydrogen 2.974 N/A HIS 212.A ND1 SER 218.A OG no hydrogen 2.824 N/A HIS 212.A NE2 GLN 176.A OE1 no hydrogen 2.909 N/A ILE 213.A N VAL 209.A O no hydrogen 3.046 N/A LEU 214.A N GLY 210.A O no hydrogen 3.011 N/A SER 215.A N HIS 212.A O no hydrogen 3.294 N/A SER 215.A OG PHE 302.A O no hydrogen 2.765 N/A SER 218.A N SER 215.A O no hydrogen 2.889 N/A SER 218.A OG HIS 212.A ND1 no hydrogen 2.824 N/A ARG 219.A N LEU 216.A O no hydrogen 3.051 N/A ARG 219.A NH1 ILE 213.A O no hydrogen 3.137 N/A ARG 219.A NH2 ASP 318.A OD1 no hydrogen 2.588 N/A SER 220.A OG PRO 217.A O no hydrogen 3.377 N/A LEU 221.A N SER 218.A O no hydrogen 2.912 N/A HIS 223.A N VAL 197.A O no hydrogen 2.910 N/A ALA 225.A N GLN 320.A O no hydrogen 3.314 N/A VAL 226.A N LEU 199.A O no hydrogen 2.875 N/A LEU 227.A N LEU 322.A O no hydrogen 2.865 N/A GLN 228.A N GLY 201.A O no hydrogen 2.801 N/A GLN 228.A NE2 GLU 445.A OE2 no hydrogen 3.070 N/A SER 229.A N GLY 324.A O no hydrogen 2.829 N/A SER 229.A OG GLU 329.A OE1 no hydrogen 3.554 N/A SER 229.A OG GLU 329.A OE2 no hydrogen 2.616 N/A THR 231.A OG1 ASN 233.A O no hydrogen 2.669 N/A ASN 233.A ND2 PRO 405.A O no hydrogen 3.048 N/A GLY 234.A N GLU 308.A OE2 no hydrogen 2.855 N/A TRP 236.A NE1 ASN 401.A O no hydrogen 2.824 N/A VAL 239.A N PRO 296.A O no hydrogen 3.049 N/A GLU 243.A N SER 240.A OG no hydrogen 2.956 N/A ALA 244.A N SER 240.A O no hydrogen 3.050 N/A ARG 245.A N ALA 241.A O no hydrogen 2.883 N/A ARG 245.A NH1 ASP 261.A OD1 no hydrogen 3.012 N/A ARG 245.A NH1 ASP 261.A OD2 no hydrogen 3.247 N/A ARG 245.A NH2 PRO 162.A O no hydrogen 2.824 N/A ARG 245.A NH2 ASP 261.A OD2 no hydrogen 3.344 N/A ARG 246.A N GLY 242.A O no hydrogen 2.996 N/A ARG 246.A NE GLU 243.A OE1 no hydrogen 2.985 N/A ARG 246.A NH2 GLU 243.A OE2 no hydrogen 2.982 N/A ARG 246.A NH2 VAL 283.A O no hydrogen 3.079 N/A ARG 247.A N GLU 243.A O no hydrogen 2.866 N/A ARG 247.A NE GLU 243.A OE2 no hydrogen 2.576 N/A ARG 247.A NH1 PHE 292.A O no hydrogen 3.041 N/A ARG 247.A NH1 SER 293.A O no hydrogen 2.734 N/A ARG 247.A NH2 GLU 243.A OE2 no hydrogen 2.997 N/A ALA 248.A N ALA 244.A O no hydrogen 2.989 N/A THR 249.A N ARG 245.A O no hydrogen 2.943 N/A THR 249.A OG1 ARG 245.A O no hydrogen 2.627 N/A LEU 250.A N ARG 246.A O no hydrogen 2.931 N/A LEU 251.A N ARG 247.A O no hydrogen 2.962 N/A ALA 252.A N ALA 248.A O no hydrogen 2.818 N/A ARG 253.A N THR 249.A O no hydrogen 2.885 N/A LEU 254.A N LEU 250.A O no hydrogen 2.813 N/A VAL 255.A N LEU 251.A O no hydrogen 3.057 N/A VAL 255.A N ALA 252.A O no hydrogen 3.326 N/A GLY 256.A N ARG 253.A O no hydrogen 3.033 N/A CYS 257.A N ALA 252.A O no hydrogen 2.799 N/A THR 262.A OG1 GLU 166.A OE2 no hydrogen 2.911 N/A ILE 265.A N ASP 261.A O no hydrogen 2.866 N/A ALA 266.A N THR 262.A O no hydrogen 2.903 N/A CYS 267.A N GLU 263.A O no hydrogen 2.902 N/A LEU 268.A N LEU 264.A O no hydrogen 3.017 N/A ARG 269.A N ALA 266.A O no hydrogen 3.154 N/A THR 270.A OG1 ALA 266.A O no hydrogen 3.503 N/A ARG 271.A N LEU 268.A O no hydrogen 3.214 N/A ARG 271.A NE VAL 255.A O no hydrogen 3.059 N/A ARG 271.A NH2 GLY 256.A O no hydrogen 3.382 N/A GLN 274.A NE2 ASP 278.A OD1 no hydrogen 3.158 N/A LEU 276.A N PRO 272.A O no hydrogen 3.423 N/A VAL 277.A N ALA 273.A O no hydrogen 3.211 N/A ASP 278.A N GLN 274.A O no hydrogen 2.886 N/A HIS 279.A N LEU 276.A O no hydrogen 3.181 N/A HIS 279.A ND1 ASP 275.A O no hydrogen 3.085 N/A GLU 280.A N VAL 277.A O no hydrogen 3.234 N/A HIS 282.A N HIS 279.A O no hydrogen 3.169 N/A LEU 284.A N TRP 281.A O no hydrogen 3.517 N/A SER 288.A OG GLN 286.A O no hydrogen 3.336 N/A ILE 289.A N ILE 360.A O no hydrogen 3.410 N/A ARG 291.A NH1 PHE 290.A O no hydrogen 2.881 N/A ARG 291.A NH1 ASN 401.A OD1 no hydrogen 2.854 N/A ARG 291.A NH2 GLN 364.A OE1 no hydrogen 2.855 N/A ARG 291.A NH2 HIS 400.A NE2 no hydrogen 3.190 N/A SER 293.A OG GLU 280.A O no hydrogen 2.666 N/A VAL 297.A N ASN 170.A OD1 no hydrogen 2.685 N/A VAL 298.A N VAL 239.A O no hydrogen 3.062 N/A ASP 301.A N ASP 299.A OD1 no hydrogen 3.116 N/A ASP 301.A N LEU 303.A O no hydrogen 3.254 N/A PHE 302.A N ASP 299.A OD2 no hydrogen 3.296 N/A LEU 303.A N ASP 299.A OD1 no hydrogen 2.996 N/A THR 306.A N ASP 305.A OD1 no hydrogen 2.564 N/A GLU 308.A N GLU 308.A OE1 no hydrogen 3.161 N/A ALA 309.A N THR 306.A OG1 no hydrogen 3.048 N/A LEU 310.A N THR 306.A O no hydrogen 2.979 N/A ILE 311.A N PRO 307.A O no hydrogen 2.920 N/A ASN 312.A N GLU 308.A O no hydrogen 3.182 N/A THR 313.A N ALA 309.A O no hydrogen 3.189 N/A THR 313.A OG1 ALA 309.A O no hydrogen 3.306 N/A GLY 314.A N LEU 310.A O no hydrogen 2.900 N/A PHE 316.A N GLN 416.A O no hydrogen 3.080 N/A GLN 317.A N ASP 315.A OD2 no hydrogen 3.016 N/A GLN 317.A NE2 ASP 315.A OD1 no hydrogen 3.534 N/A LEU 319.A N PHE 316.A O no hydrogen 3.174 N/A GLN 320.A NE2 THR 481.A O no hydrogen 3.664 N/A VAL 321.A N ARG 419.A O no hydrogen 2.870 N/A LEU 322.A N ALA 225.A O no hydrogen 3.080 N/A VAL 323.A N TYR 421.A O no hydrogen 2.845 N/A GLY 324.A N LEU 227.A O no hydrogen 3.307 N/A VAL 325.A N TYR 423.A O no hydrogen 3.069 N/A VAL 326.A N GLU 329.A OE2 no hydrogen 2.745 N/A LYS 327.A N PHE 425.A O no hydrogen 2.872 N/A LYS 327.A NZ ASP 328.A OD1 no hydrogen 2.869 N/A ASP 328.A N VAL 440.A O no hydrogen 2.942 N/A SER 331.A OG ASP 328.A O no hydrogen 3.562 N/A SER 331.A OG MET 438.A O no hydrogen 2.708 N/A PHE 333.A N GLY 330.A O no hydrogen 2.855 N/A LEU 334.A N SER 331.A O no hydrogen 3.041 N/A TYR 336.A N PHE 333.A O no hydrogen 3.071 N/A TYR 336.A OH ASP 74.A OD1 no hydrogen 3.366 N/A TYR 336.A OH ASP 74.A OD2 no hydrogen 2.975 N/A VAL 338.A N LEU 334.A O no hydrogen 3.061 N/A PHE 341.A N VAL 338.A O no hydrogen 3.286 N/A SER 342.A N SER 347.A OG no hydrogen 2.932 N/A LYS 343.A N TYR 77.A OH no hydrogen 3.207 N/A LYS 343.A NZ ASP 344.A OD1 no hydrogen 2.775 N/A ASP 344.A N SER 342.A OG no hydrogen 3.135 N/A SER 347.A N ASN 345.A OD1 no hydrogen 2.709 N/A SER 347.A OG SER 342.A O no hydrogen 3.008 N/A SER 350.A N GLN 353.A OE1 no hydrogen 3.018 N/A ARG 351.A NH1 THR 378.A OG1 no hydrogen 3.254 N/A ARG 351.A NH1 PRO 383.A O no hydrogen 3.134 N/A ARG 351.A NH2 THR 378.A OG1 no hydrogen 2.856 N/A GLN 353.A N SER 350.A OG no hydrogen 3.083 N/A PHE 354.A N SER 350.A O no hydrogen 2.986 N/A LEU 355.A N ARG 351.A O no hydrogen 3.037 N/A ALA 356.A N ALA 352.A O no hydrogen 3.036 N/A GLY 357.A N GLN 353.A O no hydrogen 2.867 N/A VAL 358.A N PHE 354.A O no hydrogen 2.850 N/A ARG 359.A N LEU 355.A O no hydrogen 3.426 N/A ARG 359.A NH1 ASP 367.A OD1 no hydrogen 3.497 N/A ARG 359.A NH2 ALA 365.A O no hydrogen 3.259 N/A ARG 359.A NH2 ASP 367.A OD1 no hydrogen 3.175 N/A ILE 360.A N GLY 357.A O no hydrogen 3.238 N/A GLY 361.A N GLY 357.A O no hydrogen 2.794 N/A VAL 362.A N VAL 358.A O no hydrogen 2.707 N/A GLN 364.A N GLN 364.A OE1 no hydrogen 2.826 N/A GLN 364.A NE2 HIS 400.A NE2 no hydrogen 3.210 N/A ALA 365.A N VAL 362.A O no hydrogen 3.136 N/A ALA 369.A N SER 366.A OG no hydrogen 3.391 N/A ALA 370.A N SER 366.A O no hydrogen 3.188 N/A GLU 371.A N ASP 367.A O no hydrogen 2.985 N/A ALA 372.A N LEU 368.A O no hydrogen 2.909 N/A VAL 373.A N ALA 369.A O no hydrogen 2.943 N/A VAL 374.A N ALA 370.A O no hydrogen 3.044 N/A LEU 375.A N GLU 371.A O no hydrogen 2.909 N/A HIS 376.A N ALA 372.A O no hydrogen 2.995 N/A TYR 377.A N VAL 373.A O no hydrogen 2.908 N/A TYR 377.A N VAL 374.A O no hydrogen 3.183 N/A TYR 377.A OH ASP 399.A OD2 no hydrogen 2.391 N/A THR 378.A N VAL 374.A O no hydrogen 2.798 N/A THR 378.A OG1 VAL 374.A O no hydrogen 2.571 N/A TRP 380.A NE1 LEU 375.A O no hydrogen 2.951 N/A LEU 381.A N ASP 379.A OD1 no hydrogen 2.895 N/A HIS 382.A N ASP 379.A O no hydrogen 3.103 N/A ASP 385.A N HIS 382.A O no hydrogen 3.197 N/A HIS 388.A N ASP 385.A OD2 no hydrogen 2.761 N/A HIS 388.A NE2.A TYR 377.A O no hydrogen 3.250 N/A LEU 389.A N ASP 385.A O no hydrogen 2.994 N/A ARG 390.A N PRO 386.A O no hydrogen 3.021 N/A ARG 390.A NE GLU 346.A O no hydrogen 3.172 N/A ARG 390.A NH1 ASP 391.A OD1 no hydrogen 2.674 N/A ARG 390.A NH2 GLU 346.A O no hydrogen 3.497 N/A ASP 391.A N THR 387.A O no hydrogen 2.940 N/A ALA 392.A N HIS 388.A O no hydrogen 2.762 N/A ALA 392.A N LEU 389.A O no hydrogen 3.217 N/A MET 393.A N LEU 389.A O no hydrogen 2.950 N/A SER 394.A N ARG 390.A O no hydrogen 3.159 N/A ALA 395.A N ASP 391.A O no hydrogen 3.007 N/A VAL 396.A N ALA 392.A O no hydrogen 2.682 N/A VAL 397.A N MET 393.A O no hydrogen 3.063 N/A GLY 398.A N SER 394.A O no hydrogen 2.855 N/A ASP 399.A N ALA 395.A O no hydrogen 2.665 N/A HIS 400.A N VAL 396.A O no hydrogen 3.067 N/A ASN 401.A N VAL 397.A O no hydrogen 3.200 N/A ASN 401.A ND2 VAL 397.A O no hydrogen 2.787 N/A VAL 402.A N GLY 398.A O no hydrogen 3.176 N/A VAL 403.A N GLY 398.A O no hydrogen 3.045 N/A CYS 404.A N ASP 399.A O no hydrogen 2.958 N/A VAL 406.A N VAL 402.A O no hydrogen 2.798 N/A ALA 407.A N VAL 403.A O no hydrogen 2.840 N/A GLN 408.A N CYS 404.A O no hydrogen 3.186 N/A LEU 409.A N PRO 405.A O no hydrogen 3.030 N/A ALA 410.A N VAL 406.A O no hydrogen 2.861 N/A GLY 411.A N ALA 407.A O no hydrogen 3.136 N/A ARG 412.A N GLN 408.A O no hydrogen 2.648 N/A LEU 413.A N LEU 409.A O no hydrogen 2.890 N/A ALA 414.A N ALA 410.A O no hydrogen 2.911 N/A ALA 415.A N GLY 411.A O no hydrogen 2.932 N/A GLN 416.A N LEU 413.A O no hydrogen 3.110 N/A ALA 418.A N LEU 413.A O no hydrogen 2.944 N/A ARG 419.A N LEU 319.A O no hydrogen 2.923 N/A TYR 421.A N VAL 321.A O no hydrogen 2.885 N/A TYR 423.A N VAL 323.A O no hydrogen 3.107 N/A ILE 424.A N VAL 506.A O no hydrogen 3.010 N/A PHE 425.A N VAL 325.A O no hydrogen 2.753 N/A GLU 426.A N LEU 508.A O no hydrogen 2.869 N/A HIS 427.A NE2 GLU 464.A OE2 no hydrogen 2.775 N/A ARG 428.A NE GLY 439.A O no hydrogen 3.144 N/A SER 430.A N GLU 464.A OE2 no hydrogen 2.816 N/A SER 430.A OG GLU 464.A OE1 no hydrogen 2.813 N/A LEU 432.A N ALA 429.A O no hydrogen 3.327 N/A TRP 434.A NE1 TYR 444.A OH no hydrogen 2.832 N/A TRP 437.A NE1 ASN 345.A O no hydrogen 3.106 N/A MET 438.A N PRO 435.A O no hydrogen 3.275 N/A GLY 439.A N LEU 436.A O no hydrogen 2.893 N/A VAL 440.A N ASP 328.A OD1 no hydrogen 2.958 N/A HIS 442.A ND1 GLU 329.A OE1 no hydrogen 2.461 N/A HIS 442.A NE2 SER 203.A OG no hydrogen 2.786 N/A TYR 444.A N PRO 441.A O no hydrogen 2.970 N/A GLU 445.A N GLU 445.A OE1 no hydrogen 2.623 N/A PHE 448.A N GLU 445.A O no hydrogen 2.859 N/A ILE 449.A N GLU 445.A O no hydrogen 3.098 N/A PHE 450.A N ILE 446.A O no hydrogen 2.880 N/A GLY 451.A N PHE 448.A O no hydrogen 3.073 N/A LEU 452.A N GLU 447.A O no hydrogen 3.077 N/A LEU 454.A N GLY 451.A O no hydrogen 2.960 N/A ASP 455.A N LEU 452.A O no hydrogen 2.860 N/A SER 457.A N ASP 455.A OD1 no hydrogen 3.162 N/A SER 457.A OG ASP 455.A OD1 no hydrogen 2.974 N/A LEU 458.A N ASP 455.A O no hydrogen 2.907 N/A ASN 459.A N PRO 456.A O no hydrogen 3.473 N/A TYR 460.A OH GLU 447.A OE2 no hydrogen 2.476 N/A THR 461.A N GLU 464.A OE1 no hydrogen 2.843 N/A THR 461.A OG1 GLU 463.A OE1 no hydrogen 3.395 N/A GLU 464.A N THR 461.A OG1 no hydrogen 3.088 N/A ARG 465.A N THR 461.A O no hydrogen 3.085 N/A ILE 466.A N THR 462.A O no hydrogen 3.112 N/A PHE 467.A N GLU 463.A O no hydrogen 2.756 N/A ALA 468.A N GLU 464.A O no hydrogen 2.819 N/A GLN 469.A N ARG 465.A O no hydrogen 3.209 N/A ARG 470.A N ILE 466.A O no hydrogen 3.096 N/A ARG 470.A NE TYR 474.A OH no hydrogen 3.397 N/A ARG 470.A NH1 ASN 509.A O no hydrogen 3.079 N/A ARG 470.A NH1 LYS 511.A O no hydrogen 3.424 N/A ARG 470.A NH2 TYR 474.A OH no hydrogen 3.531 N/A ARG 470.A NH2 LYS 511.A O no hydrogen 3.561 N/A LEU 471.A N PHE 467.A O no hydrogen 3.176 N/A MET 472.A N ALA 468.A O no hydrogen 2.882 N/A LYS 473.A N GLN 469.A O no hydrogen 2.898 N/A LYS 473.A NZ GLU 142.A OE1 no hydrogen 3.383 N/A LYS 473.A NZ GLU 142.A OE2 no hydrogen 3.020 N/A TYR 474.A N ARG 470.A O no hydrogen 2.725 N/A TRP 475.A N LEU 471.A O no hydrogen 2.803 N/A TRP 475.A NE1 GLN 228.A OE1 no hydrogen 2.724 N/A THR 476.A N MET 472.A O no hydrogen 2.981 N/A THR 476.A OG1 MET 472.A O no hydrogen 2.795 N/A ASN 477.A N LYS 473.A O no hydrogen 2.763 N/A ASN 477.A ND2 PRO 484.A O no hydrogen 3.406 N/A PHE 478.A N TYR 474.A O no hydrogen 2.924 N/A ALA 479.A N TRP 475.A O no hydrogen 2.911 N/A ARG 480.A N THR 476.A O no hydrogen 2.780 N/A ARG 480.A NH2 GLU 142.A O no hydrogen 3.444 N/A ARG 480.A NH2 GLU 142.A OE1 no hydrogen 3.146 N/A THR 481.A N ASN 477.A O no hydrogen 2.848 N/A THR 481.A OG1 ASN 477.A O no hydrogen 2.882 N/A GLY 482.A N PHE 478.A O no hydrogen 2.710 N/A ASN 485.A N ASP 483.A OD1 no hydrogen 2.983 N/A ASN 485.A ND2 ASP 483.A OD1 no hydrogen 3.040 N/A ASN 485.A ND2 TRP 495.A O no hydrogen 2.871 N/A ASP 489.A N ASP 486.A OD1 no hydrogen 3.011 N/A SER 492.A OG ASP 489.A OD2 no hydrogen 3.298 N/A GLN 494.A NE2 SER 492.A O no hydrogen 2.985 N/A TRP 495.A N ASN 485.A OD1 no hydrogen 2.831 N/A TYR 498.A N VAL 420.A O no hydrogen 2.717 N/A ALA 502.A N THR 499.A OG1 no hydrogen 3.283 N/A GLN 503.A N THR 499.A O no hydrogen 2.777 N/A TYR 505.A N ARG 516.A O no hydrogen 3.077 N/A VAL 506.A N ALA 422.A O no hydrogen 2.990 N/A SER 507.A N GLU 514.A O no hydrogen 3.027 N/A SER 507.A OG GLU 514.A O no hydrogen 3.452 N/A LEU 508.A N ILE 424.A O no hydrogen 2.775 N/A ASN 509.A ND2 GLU 426.A OE1 no hydrogen 2.974 N/A LYS 511.A N ASN 509.A OD1 no hydrogen 3.241 N/A ARG 516.A N TYR 505.A O no hydrogen 2.764 N/A ARG 516.A NE GLU 514.A OE2 no hydrogen 2.655 N/A ARG 516.A NH1 GLU 426.A OE2 no hydrogen 2.815 N/A ARG 516.A NH2 GLU 426.A OE1 no hydrogen 2.775 N/A ARG 516.A NH2 GLU 426.A OE2 no hydrogen 3.469 N/A ARG 516.A NH2 GLU 514.A OE2 no hydrogen 3.363 N/A ARG 517.A NE ALA 502.A O no hydrogen 3.013 N/A GLY 518.A N GLN 503.A O no hydrogen 2.627 N/A CYS 524.A N ARG 520.A O no hydrogen 2.896 N/A CYS 524.A SG LEU 519.A O no hydrogen 3.844 N/A ALA 525.A N ALA 521.A O no hydrogen 3.171 N/A PHE 526.A N THR 523.A O no hydrogen 2.978 N/A TRP 527.A N THR 523.A O no hydrogen 3.408 N/A TRP 527.A NE1 TYR 377.A OH no hydrogen 3.040 N/A ASN 528.A N CYS 524.A O no hydrogen 2.938 N/A ASN 528.A ND2 CYS 404.A O no hydrogen 3.287 N/A ARG 529.A N ALA 525.A O no hydrogen 3.102 N/A PHE 530.A N ALA 525.A O no hydrogen 3.248 N/A PHE 530.A N PHE 526.A O no hydrogen 3.087 N/A LEU 531.A N PHE 526.A O no hydrogen 2.788 N/A LEU 534.A N PHE 530.A O no hydrogen 3.024 N/A LEU 535.A N LEU 531.A O no hydrogen 2.877 N/A SER 536.A N PRO 532.A O no hydrogen 3.083 N/A SER 536.A OG PRO 532.A O no hydrogen 3.429 N/A ALA 537.A N LYS 533.A O no hydrogen 3.476 N/A