Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xug_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ASP 3.A OD1 no hydrogen 2.818 N/A LEU 6.A N ASP 3.A O no hydrogen 3.149 N/A VAL 8.A N LEU 15.A O no hydrogen 3.096 N/A VAL 10.A N GLY 13.A O no hydrogen 2.813 N/A ARG 11.A N ASN 184.A OD1 no hydrogen 2.874 N/A ARG 11.A NH1 ARG 11.A O no hydrogen 2.592 N/A GLY 13.A N VAL 10.A O no hydrogen 2.737 N/A LEU 15.A N VAL 8.A O no hydrogen 2.584 N/A ARG 16.A N LEU 58.A O no hydrogen 2.985 N/A ARG 16.A NH1 GLU 2.A OE2 no hydrogen 3.300 N/A GLY 17.A N LEU 6.A O no hydrogen 2.821 N/A ILE 18.A N ALA 29.A O no hydrogen 2.771 N/A LEU 20.A N VAL 27.A O no hydrogen 2.833 N/A ALA 22.A N GLY 25.A O no hydrogen 2.874 N/A GLY 25.A N ALA 22.A O no hydrogen 2.977 N/A VAL 27.A N LEU 20.A O no hydrogen 2.876 N/A SER 28.A N THR 101.A O no hydrogen 2.823 N/A ALA 29.A N ILE 18.A O no hydrogen 2.841 N/A PHE 30.A N VAL 99.A O no hydrogen 2.838 N/A LEU 31.A N ALA 60.A O no hydrogen 2.819 N/A GLY 32.A N ASN 98.A OD1 no hydrogen 3.141 N/A ILE 33.A N LEU 97.A O no hydrogen 2.904 N/A PHE 35.A N LEU 95.A O no hydrogen 3.264 N/A GLU 37.A N GLU 49.A O no hydrogen 2.909 N/A VAL 40.A N PRO 38.A O no hydrogen 2.855 N/A ARG 43.A N VAL 40.A O no hydrogen 3.181 N/A ARG 44.A N GLY 41.A O no hydrogen 3.217 N/A ARG 44.A NE GLU 92.A OE2 no hydrogen 2.712 N/A ARG 44.A NH1 ARG 270.A O no hydrogen 2.677 N/A ARG 44.A NH2 GLU 92.A OE1 no hydrogen 3.001 N/A ARG 44.A NH2 GLU 92.A OE2 no hydrogen 3.491 N/A ARG 44.A NH2 ARG 270.A O no hydrogen 2.974 N/A MET 46.A N ARG 43.A O no hydrogen 3.029 N/A LYS 51.A N PHE 35.A O no hydrogen 3.198 N/A ARG 52.A N GLU 37.A OE2 no hydrogen 2.991 N/A TRP 54.A N GLY 12.A O no hydrogen 3.250 N/A TRP 54.A NE1 GLN 14.A O no hydrogen 3.253 N/A LEU 58.A N GLN 14.A O no hydrogen 2.932 N/A ALA 60.A N ARG 16.A O no hydrogen 2.787 N/A THR 61.A N ASP 59.A OD1 no hydrogen 2.902 N/A THR 61.A OG1 ASP 59.A OD1 no hydrogen 2.804 N/A THR 61.A OG1 ASP 59.A OD2 no hydrogen 3.382 N/A ASN 65.A N GLN 64.A OE1 no hydrogen 3.198 N/A ASN 65.A ND2 ASP 93.A O no hydrogen 3.189 N/A VAL 66.A N GLU 89.A O no hydrogen 2.915 N/A CYS 67.A SG CYS 94.A O no hydrogen 3.816 N/A TYR 68.A OH GLN 273.A OE1 no hydrogen 2.681 N/A GLN 69.A NE2 CYS 67.A O no hydrogen 2.764 N/A GLN 69.A NE2 GLY 124.A O no hydrogen 2.962 N/A ASP 72.A N ASN 85.A OD1 no hydrogen 3.173 N/A GLY 77.A N GLU 82.A OE2 no hydrogen 3.477 N/A PHE 78.A N TYR 75.A O no hydrogen 3.234 N/A THR 81.A N PHE 78.A O no hydrogen 3.193 N/A THR 81.A OG1 TYR 75.A O no hydrogen 3.193 N/A THR 81.A OG1 PHE 78.A O no hydrogen 3.035 N/A GLU 82.A N PHE 78.A O no hydrogen 2.934 N/A MET 83.A N GLU 79.A O no hydrogen 2.997 N/A TRP 84.A N THR 81.A O no hydrogen 2.948 N/A TRP 84.A NE1 TYR 443.A OH no hydrogen 3.079 N/A ASN 85.A N GLU 82.A O no hydrogen 3.067 N/A ASN 85.A ND2 ASP 72.A O no hydrogen 3.129 N/A ASN 85.A ND2 GLU 82.A OE1 no hydrogen 2.991 N/A ASN 87.A ND2 SER 127.A O no hydrogen 2.751 N/A ARG 88.A NE PHE 63.A O no hydrogen 2.984 N/A ARG 88.A NH1 PHE 63.A O no hydrogen 3.148 N/A SER 91.A N VAL 66.A O no hydrogen 3.028 N/A SER 91.A OG ASP 93.A O no hydrogen 3.495 N/A ASP 93.A N SER 91.A OG no hydrogen 2.919 N/A CYS 94.A SG GLU 92.A O no hydrogen 3.643 N/A TYR 96.A N CYS 94.A O no hydrogen 2.963 N/A TYR 96.A OH ASP 93.A OD1 no hydrogen 2.765 N/A LEU 97.A N ILE 33.A O no hydrogen 2.781 N/A ASN 98.A N SER 146.A O no hydrogen 2.783 N/A ASN 98.A ND2 SER 146.A OG no hydrogen 3.268 N/A VAL 99.A N PHE 30.A O no hydrogen 2.912 N/A TRP 100.A N LEU 144.A O no hydrogen 2.842 N/A THR 101.A N SER 28.A O no hydrogen 2.972 N/A THR 101.A OG1 PRO 102.A O no hydrogen 3.097 N/A TYR 103.A OH ASP 3.A OD2 no hydrogen 2.423 N/A THR 110.A N GLY 189.A O no hydrogen 2.992 N/A THR 110.A OG1 SER 108.A O no hydrogen 3.187 N/A VAL 112.A N SER 194.A O no hydrogen 2.952 N/A LEU 113.A N VAL 143.A O no hydrogen 2.819 N/A ILE 114.A N THR 196.A O no hydrogen 2.890 N/A TRP 115.A N VAL 145.A O no hydrogen 2.702 N/A ILE 116.A N PHE 198.A O no hydrogen 2.902 N/A TYR 117.A OH TYR 149.A O no hydrogen 2.889 N/A TYR 122.A N GLY 119.A O no hydrogen 3.013 N/A SER 123.A N GLY 119.A O no hydrogen 2.894 N/A SER 123.A OG GLY 119.A O no hydrogen 3.029 N/A GLY 124.A N GLN 69.A OE1 no hydrogen 2.899 N/A ALA 126.A N ASN 148.A OD1 no hydrogen 2.992 N/A SER 127.A OG ASN 87.A OD1 no hydrogen 2.667 N/A TYR 131.A N LEU 128.A O no hydrogen 2.888 N/A ASP 132.A N ASP 129.A O no hydrogen 3.342 N/A ARG 134.A N ASP 132.A OD1 no hydrogen 2.971 N/A ARG 134.A NE ASP 132.A OD1 no hydrogen 3.401 N/A ARG 134.A NE ASP 132.A OD2 no hydrogen 2.768 N/A ARG 134.A NH2 LYS 21.A O no hydrogen 2.829 N/A ALA 137.A N GLY 133.A O no hydrogen 3.089 N/A GLN 138.A N ARG 134.A O no hydrogen 2.967 N/A VAL 139.A N PHE 135.A O no hydrogen 2.846 N/A GLU 140.A N LEU 136.A O no hydrogen 2.997 N/A ALA 142.A N LEU 136.A O no hydrogen 3.296 N/A VAL 143.A N PRO 111.A O no hydrogen 3.512 N/A LEU 144.A N TRP 100.A O no hydrogen 2.902 N/A VAL 145.A N LEU 113.A O no hydrogen 2.756 N/A SER 146.A N ASN 98.A O no hydrogen 3.077 N/A ASN 148.A N TYR 96.A O no hydrogen 3.083 N/A ASN 148.A ND2 CYS 94.A O no hydrogen 3.230 N/A TYR 149.A N TYR 117.A OH no hydrogen 3.043 N/A TYR 149.A OH TYR 117.A O no hydrogen 2.683 N/A ARG 150.A N ASP 173.A OD2 no hydrogen 3.016 N/A ARG 150.A NE ASP 173.A OD2 no hydrogen 2.723 N/A ARG 150.A NH1 MET 46.A O no hydrogen 2.922 N/A ARG 150.A NH2 MET 46.A O no hydrogen 3.064 N/A ARG 150.A NH2 ASP 173.A OD1 no hydrogen 2.558 N/A ARG 150.A NH2 ASP 173.A OD2 no hydrogen 3.445 N/A GLY 152.A N PHE 121.A O no hydrogen 2.678 N/A GLY 155.A N VAL 151.A O no hydrogen 3.101 N/A GLY 155.A N GLY 152.A O no hydrogen 3.056 N/A PHE 156.A N GLY 152.A O no hydrogen 2.888 N/A PHE 156.A N THR 153.A O no hydrogen 3.178 N/A LEU 157.A N THR 153.A O no hydrogen 2.885 N/A LEU 159.A N ALA 165.A O no hydrogen 2.853 N/A SER 162.A N LEU 159.A O no hydrogen 3.056 N/A SER 162.A OG LEU 159.A O no hydrogen 2.835 N/A ALA 165.A N SER 162.A OG no hydrogen 3.118 N/A ASN 168.A ND2 VAL 296.A O no hydrogen 3.007 N/A ASN 168.A ND2 ASP 298.A OD2 no hydrogen 3.089 N/A GLY 170.A N GLY 155.A O no hydrogen 2.893 N/A LEU 172.A N ASN 168.A O no hydrogen 3.117 N/A ASP 173.A N VAL 169.A O no hydrogen 2.801 N/A GLN 174.A N GLY 170.A O no hydrogen 3.229 N/A GLN 174.A NE2 SER 206.A OG no hydrogen 3.107 N/A ARG 175.A N LEU 171.A O no hydrogen 2.981 N/A ARG 175.A NE SER 216.A OG no hydrogen 2.708 N/A ARG 175.A NH2 SER 213.A OG no hydrogen 2.837 N/A ARG 175.A NH2 SER 216.A OG no hydrogen 2.943 N/A LEU 176.A N LEU 172.A O no hydrogen 2.888 N/A ALA 177.A N ASP 173.A O no hydrogen 3.101 N/A LEU 178.A N GLN 174.A O no hydrogen 2.937 N/A GLN 179.A N ARG 175.A O no hydrogen 2.805 N/A TRP 180.A N LEU 176.A O no hydrogen 2.895 N/A VAL 181.A N ALA 177.A O no hydrogen 3.126 N/A GLN 182.A N LEU 178.A O no hydrogen 3.114 N/A GLN 182.A NE2 PRO 192.A O no hydrogen 3.557 N/A GLU 183.A N GLN 179.A O no hydrogen 3.069 N/A ASN 184.A N TRP 180.A O no hydrogen 2.961 N/A ASN 184.A ND2 TRP 180.A O no hydrogen 2.976 N/A ILE 185.A N VAL 181.A O no hydrogen 2.986 N/A ALA 187.A N ASN 184.A O no hydrogen 2.906 N/A PHE 188.A N ILE 185.A O no hydrogen 2.921 N/A GLY 189.A N ALA 186.A O no hydrogen 3.072 N/A GLY 190.A N ILE 185.A O no hydrogen 2.914 N/A ASP 191.A N THR 110.A O no hydrogen 2.750 N/A MET 193.A N ASP 191.A OD1 no hydrogen 2.907 N/A SER 194.A N ASP 191.A O no hydrogen 3.059 N/A THR 196.A N VAL 112.A O no hydrogen 2.974 N/A THR 196.A OG1 ALA 478.A O no hydrogen 3.553 N/A LEU 197.A N ARG 222.A O no hydrogen 3.060 N/A PHE 198.A N ILE 114.A O no hydrogen 2.891 N/A GLY 199.A N VAL 224.A O no hydrogen 3.377 N/A SER 201.A N GLN 226.A O no hydrogen 2.855 N/A SER 201.A OG HIS 441.A NE2 no hydrogen 2.610 N/A GLY 203.A N GLU 200.A O no hydrogen 2.861 N/A ALA 205.A N SER 201.A O no hydrogen 2.863 N/A SER 206.A N ALA 202.A O no hydrogen 2.861 N/A SER 206.A OG ALA 202.A O no hydrogen 2.766 N/A VAL 207.A N GLY 203.A O no hydrogen 2.926 N/A GLY 208.A N ALA 204.A O no hydrogen 3.009 N/A MET 209.A N ALA 205.A O no hydrogen 2.895 N/A HIS 210.A N SER 206.A O no hydrogen 2.953 N/A HIS 210.A ND1 SER 216.A OG no hydrogen 2.953 N/A HIS 210.A NE2 GLN 174.A OE1 no hydrogen 2.809 N/A ILE 211.A N VAL 207.A O no hydrogen 3.001 N/A LEU 212.A N GLY 208.A O no hydrogen 3.112 N/A LEU 212.A N MET 209.A O no hydrogen 3.126 N/A SER 213.A N HIS 210.A O no hydrogen 3.443 N/A SER 213.A OG PHE 301.A O no hydrogen 2.641 N/A SER 216.A N SER 213.A O no hydrogen 2.960 N/A SER 216.A OG HIS 210.A ND1 no hydrogen 2.953 N/A ARG 217.A N LEU 214.A O no hydrogen 2.947 N/A ARG 217.A NH1 ILE 211.A O no hydrogen 3.154 N/A ARG 217.A NH2 ASP 317.A OD1.A no hydrogen 3.210 N/A LEU 219.A N SER 216.A O no hydrogen 3.001 N/A HIS 221.A N VAL 195.A O no hydrogen 2.775 N/A HIS 221.A NE2 PRO 192.A O no hydrogen 3.315 N/A ARG 222.A N VAL 195.A O no hydrogen 3.446 N/A ARG 222.A NE ALA 478.A O no hydrogen 3.037 N/A ARG 222.A NH1 GLN 319.A OE1 no hydrogen 3.565 N/A ALA 223.A N GLN 319.A O no hydrogen 3.131 N/A VAL 224.A N LEU 197.A O no hydrogen 2.782 N/A LEU 225.A N LEU 321.A O no hydrogen 2.911 N/A GLN 226.A N GLY 199.A O no hydrogen 2.962 N/A GLN 226.A NE2 GLU 444.A OE2 no hydrogen 3.037 N/A SER 227.A N GLY 323.A O no hydrogen 2.892 N/A SER 227.A OG GLU 328.A OE2 no hydrogen 2.704 N/A THR 229.A OG1 ASN 231.A O no hydrogen 2.661 N/A THR 229.A OG1 ASN 231.A OD1 no hydrogen 3.386 N/A ASN 231.A ND2 PRO 404.A O no hydrogen 2.977 N/A TRP 234.A NE1 ASN 400.A O no hydrogen 2.878 N/A VAL 237.A N PRO 295.A O no hydrogen 2.992 N/A GLU 241.A N SER 238.A OG no hydrogen 3.102 N/A ALA 242.A N SER 238.A O no hydrogen 3.055 N/A ARG 243.A N ALA 239.A O no hydrogen 2.971 N/A ARG 243.A NH1 ASP 260.A OD1 no hydrogen 3.116 N/A ARG 243.A NH1 ASP 260.A OD2 no hydrogen 3.213 N/A ARG 243.A NH2 PRO 160.A O no hydrogen 2.796 N/A ARG 243.A NH2 ASP 260.A OD2 no hydrogen 3.152 N/A ARG 244.A N GLY 240.A O no hydrogen 3.049 N/A ARG 244.A NE GLU 241.A OE1 no hydrogen 2.847 N/A ARG 244.A NH2 GLU 241.A OE2 no hydrogen 2.811 N/A ARG 244.A NH2 VAL 282.A O no hydrogen 3.264 N/A ARG 245.A N GLU 241.A O no hydrogen 2.993 N/A ARG 245.A NE GLU 241.A OE2 no hydrogen 2.818 N/A ARG 245.A NH1 PHE 291.A O no hydrogen 3.106 N/A ARG 245.A NH1 SER 292.A O no hydrogen 2.848 N/A ARG 245.A NH2 GLU 241.A OE2 no hydrogen 3.092 N/A ALA 246.A N ALA 242.A O no hydrogen 2.965 N/A THR 247.A N ARG 243.A O no hydrogen 2.989 N/A THR 247.A OG1 ARG 243.A O no hydrogen 2.845 N/A LEU 248.A N ARG 244.A O no hydrogen 2.953 N/A LEU 249.A N ARG 245.A O no hydrogen 2.841 N/A ALA 250.A N ALA 246.A O no hydrogen 2.962 N/A ARG 251.A N THR 247.A O no hydrogen 3.010 N/A LEU 252.A N LEU 248.A O no hydrogen 2.908 N/A VAL 253.A N LEU 249.A O no hydrogen 3.157 N/A VAL 253.A N ALA 250.A O no hydrogen 3.176 N/A GLY 254.A N ARG 251.A O no hydrogen 2.696 N/A THR 261.A OG1 GLU 164.A OE2 no hydrogen 2.769 N/A ILE 264.A N ASP 260.A O no hydrogen 3.045 N/A ALA 265.A N THR 261.A O no hydrogen 2.904 N/A CYS 266.A N GLU 262.A O no hydrogen 3.178 N/A LEU 267.A N LEU 263.A O no hydrogen 2.883 N/A ARG 268.A N.A ILE 264.A O no hydrogen 2.791 N/A ARG 268.A N.A ALA 265.A O no hydrogen 3.196 N/A ARG 268.A N.B ILE 264.A O no hydrogen 2.802 N/A ARG 268.A N.B ALA 265.A O no hydrogen 3.186 N/A ARG 268.A NH1.B ARG 44.A O no hydrogen 2.617 N/A THR 269.A N CYS 266.A O no hydrogen 2.950 N/A THR 269.A OG1 CYS 266.A O no hydrogen 2.666 N/A ARG 270.A N LEU 267.A O no hydrogen 3.145 N/A ARG 270.A NE VAL 253.A O no hydrogen 3.225 N/A GLN 273.A NE2 ASP 277.A OD1 no hydrogen 3.263 N/A ASP 274.A N PRO 271.A O no hydrogen 3.074 N/A LEU 275.A N ALA 272.A O no hydrogen 3.038 N/A VAL 276.A N ALA 272.A O no hydrogen 3.282 N/A ASP 277.A N GLN 273.A O no hydrogen 2.843 N/A HIS 278.A N LEU 275.A O no hydrogen 3.264 N/A HIS 278.A ND1 ASP 274.A O no hydrogen 3.171 N/A GLU 279.A N LEU 275.A O no hydrogen 3.053 N/A GLU 279.A N VAL 276.A O no hydrogen 3.283 N/A HIS 281.A N HIS 278.A O no hydrogen 3.018 N/A SER 287.A OG GLN 285.A O no hydrogen 3.416 N/A ILE 288.A N ILE 359.A O no hydrogen 3.346 N/A ARG 290.A NE GLN 363.A OE1.A no hydrogen 3.070 N/A ARG 290.A NH1 PHE 289.A O no hydrogen 2.877 N/A ARG 290.A NH1 ASN 400.A OD1 no hydrogen 2.874 N/A ARG 290.A NH2 GLN 363.A OE1.A no hydrogen 3.511 N/A ARG 290.A NH2 HIS 399.A NE2 no hydrogen 3.134 N/A SER 292.A OG GLU 279.A O no hydrogen 2.670 N/A VAL 296.A N ASN 168.A OD1 no hydrogen 2.817 N/A VAL 297.A N VAL 237.A O no hydrogen 2.954 N/A GLY 299.A N LEU 302.A O no hydrogen 2.931 N/A ASP 300.A N ASP 298.A OD1 no hydrogen 3.116 N/A PHE 301.A N ASP 298.A OD2 no hydrogen 3.162 N/A LEU 302.A N ASP 298.A OD1 no hydrogen 2.909 N/A THR 305.A N ASP 304.A OD1 no hydrogen 2.831 N/A ALA 308.A N THR 305.A OG1 no hydrogen 2.975 N/A LEU 309.A N THR 305.A O no hydrogen 3.002 N/A ILE 310.A N PRO 306.A O no hydrogen 2.864 N/A ASN 311.A N GLU 307.A O no hydrogen 3.060 N/A THR 312.A N ALA 308.A O no hydrogen 3.252 N/A THR 312.A OG1 ALA 308.A O no hydrogen 3.053 N/A GLY 313.A N LEU 309.A O no hydrogen 2.810 N/A PHE 315.A N GLN 415.A O no hydrogen 2.948 N/A LEU 318.A N PHE 315.A O no hydrogen 3.186 N/A VAL 320.A N ARG 418.A O no hydrogen 2.949 N/A LEU 321.A N ALA 223.A O no hydrogen 3.064 N/A VAL 322.A N TYR 420.A O no hydrogen 2.751 N/A GLY 323.A N LEU 225.A O no hydrogen 3.283 N/A VAL 324.A N TYR 422.A O no hydrogen 3.124 N/A VAL 325.A N GLU 328.A OE2 no hydrogen 2.799 N/A LYS 326.A N PHE 424.A O no hydrogen 2.929 N/A LYS 326.A NZ ASP 327.A OD1 no hydrogen 2.857 N/A ASP 327.A N VAL 439.A O no hydrogen 3.051 N/A SER 330.A OG ASP 327.A O no hydrogen 3.421 N/A SER 330.A OG MET 437.A O no hydrogen 2.631 N/A PHE 332.A N GLY 329.A O no hydrogen 2.899 N/A LEU 333.A N SER 330.A O no hydrogen 3.213 N/A TYR 335.A N PHE 332.A O no hydrogen 3.232 N/A TYR 335.A OH ASP 72.A OD1 no hydrogen 3.392 N/A TYR 335.A OH ASP 72.A OD2 no hydrogen 3.105 N/A VAL 337.A N LEU 333.A O no hydrogen 3.172 N/A PHE 340.A N VAL 337.A O no hydrogen 3.328 N/A SER 341.A N SER 346.A OG no hydrogen 2.930 N/A LYS 342.A N TYR 75.A OH no hydrogen 3.149 N/A LYS 342.A NZ ASP 343.A OD1 no hydrogen 2.883 N/A ASP 343.A N SER 341.A OG no hydrogen 3.103 N/A SER 346.A N ASN 344.A OD1 no hydrogen 2.850 N/A SER 346.A OG SER 341.A O no hydrogen 2.959 N/A SER 346.A OG ASN 344.A OD1 no hydrogen 3.480 N/A ILE 348.A N PRO 385.A O no hydrogen 3.471 N/A SER 349.A N GLN 352.A OE1 no hydrogen 3.112 N/A ARG 350.A NH1 THR 377.A OG1 no hydrogen 3.147 N/A ARG 350.A NH1 PRO 382.A O no hydrogen 3.230 N/A ARG 350.A NH2 THR 377.A OG1 no hydrogen 2.867 N/A GLN 352.A N SER 349.A OG no hydrogen 3.039 N/A PHE 353.A N SER 349.A O no hydrogen 2.881 N/A LEU 354.A N ARG 350.A O no hydrogen 2.957 N/A ALA 355.A N ALA 351.A O no hydrogen 2.988 N/A GLY 356.A N GLN 352.A O no hydrogen 2.852 N/A VAL 357.A N PHE 353.A O no hydrogen 3.006 N/A ARG 358.A N LEU 354.A O no hydrogen 3.387 N/A ILE 359.A N GLY 356.A O no hydrogen 3.097 N/A GLY 360.A N GLY 356.A O no hydrogen 2.770 N/A VAL 361.A N VAL 357.A O no hydrogen 2.808 N/A ALA 364.A N VAL 361.A O no hydrogen 3.135 N/A SER 365.A OG LEU 534.A O no hydrogen 3.290 N/A ALA 368.A N SER 365.A OG no hydrogen 3.260 N/A ALA 369.A N SER 365.A O no hydrogen 3.025 N/A GLU 370.A N ASP 366.A O no hydrogen 3.083 N/A ALA 371.A N LEU 367.A O no hydrogen 3.031 N/A VAL 372.A N ALA 368.A O no hydrogen 2.922 N/A VAL 373.A N ALA 369.A O no hydrogen 2.968 N/A LEU 374.A N GLU 370.A O no hydrogen 2.885 N/A HIS 375.A N ALA 371.A O no hydrogen 2.911 N/A HIS 375.A NE2 THR 522.A OG1 no hydrogen 3.227 N/A TYR 376.A N VAL 372.A O no hydrogen 2.950 N/A TYR 376.A OH ASP 398.A OD2 no hydrogen 2.516 N/A THR 377.A N VAL 373.A O no hydrogen 2.971 N/A THR 377.A OG1 VAL 373.A O no hydrogen 2.493 N/A TRP 379.A NE1 LEU 374.A O no hydrogen 3.012 N/A LEU 380.A N ASP 378.A OD1 no hydrogen 3.064 N/A HIS 381.A N ASP 378.A O no hydrogen 3.008 N/A HIS 381.A ND1 ASP 378.A OD2 no hydrogen 3.295 N/A ASP 384.A N HIS 381.A O no hydrogen 3.246 N/A HIS 387.A N ASP 384.A OD2 no hydrogen 2.785 N/A HIS 387.A NE2 TYR 376.A O no hydrogen 3.211 N/A LEU 388.A N ASP 384.A O no hydrogen 3.002 N/A ARG 389.A N PRO 385.A O no hydrogen 3.101 N/A ARG 389.A NE GLU 345.A O no hydrogen 3.124 N/A ARG 389.A NH1 ASP 390.A OD1 no hydrogen 3.045 N/A ARG 389.A NH2 GLU 345.A O no hydrogen 3.238 N/A ASP 390.A N THR 386.A O no hydrogen 3.150 N/A ALA 391.A N HIS 387.A O no hydrogen 2.734 N/A MET 392.A N LEU 388.A O no hydrogen 2.950 N/A SER 393.A N ARG 389.A O no hydrogen 3.187 N/A ALA 394.A N ASP 390.A O no hydrogen 3.022 N/A VAL 395.A N ALA 391.A O no hydrogen 2.780 N/A VAL 396.A N MET 392.A O no hydrogen 3.240 N/A GLY 397.A N SER 393.A O no hydrogen 2.904 N/A ASP 398.A N ALA 394.A O no hydrogen 2.680 N/A HIS 399.A N VAL 395.A O no hydrogen 3.196 N/A HIS 399.A NE2 GLN 363.A OE1.B no hydrogen 3.048 N/A ASN 400.A N VAL 396.A O no hydrogen 3.194 N/A ASN 400.A ND2 VAL 396.A O no hydrogen 3.066 N/A VAL 401.A N GLY 397.A O no hydrogen 2.987 N/A VAL 402.A N GLY 397.A O no hydrogen 3.045 N/A CYS 403.A N ASP 398.A O no hydrogen 3.019 N/A VAL 405.A N VAL 401.A O no hydrogen 2.889 N/A ALA 406.A N VAL 402.A O no hydrogen 2.873 N/A GLN 407.A N CYS 403.A O no hydrogen 2.906 N/A LEU 408.A N PRO 404.A O no hydrogen 2.919 N/A ALA 409.A N VAL 405.A O no hydrogen 2.788 N/A GLY 410.A N ALA 406.A O no hydrogen 2.930 N/A ARG 411.A N GLN 407.A O no hydrogen 2.922 N/A ARG 411.A NH1 GLN 415.A OE1 no hydrogen 2.727 N/A LEU 412.A N LEU 408.A O no hydrogen 2.947 N/A ALA 413.A N ALA 409.A O no hydrogen 2.851 N/A ALA 414.A N GLY 410.A O no hydrogen 3.054 N/A GLN 415.A N LEU 412.A O no hydrogen 3.114 N/A GLN 415.A NE2 ILE 310.A O no hydrogen 2.698 N/A GLN 415.A NE2 GLY 313.A O no hydrogen 3.166 N/A ALA 417.A N LEU 412.A O no hydrogen 3.060 N/A ARG 418.A N LEU 318.A O no hydrogen 3.007 N/A ARG 418.A NH1 GLY 481.A O no hydrogen 3.239 N/A TYR 420.A N VAL 320.A O no hydrogen 2.829 N/A TYR 422.A N VAL 322.A O no hydrogen 3.022 N/A ILE 423.A N VAL 505.A O no hydrogen 2.884 N/A PHE 424.A N VAL 324.A O no hydrogen 2.723 N/A GLU 425.A N LEU 507.A O no hydrogen 2.843 N/A HIS 426.A NE2 GLU 463.A OE2 no hydrogen 2.945 N/A ARG 427.A NH1 PRO 434.A O no hydrogen 3.138 N/A ARG 427.A NH1 GLY 438.A O no hydrogen 2.883 N/A ARG 427.A NH2 TRP 433.A O no hydrogen 2.802 N/A SER 429.A N GLU 463.A OE2 no hydrogen 2.798 N/A SER 429.A OG GLU 463.A OE1 no hydrogen 2.936 N/A SER 429.A OG GLU 463.A OE2 no hydrogen 3.459 N/A LEU 431.A N ALA 428.A O no hydrogen 3.238 N/A TRP 433.A NE1 TYR 443.A OH no hydrogen 2.863 N/A MET 437.A N PRO 434.A O no hydrogen 3.213 N/A GLY 438.A N LEU 435.A O no hydrogen 3.236 N/A VAL 439.A N ASP 327.A OD1 no hydrogen 2.943 N/A HIS 441.A ND1 GLU 328.A OE1 no hydrogen 2.586 N/A HIS 441.A NE2 SER 201.A OG no hydrogen 2.610 N/A TYR 443.A N PRO 440.A O no hydrogen 3.199 N/A GLU 444.A N GLU 444.A OE1 no hydrogen 2.573 N/A ILE 445.A N GLY 442.A O no hydrogen 3.449 N/A PHE 447.A N GLU 444.A O no hydrogen 2.863 N/A ILE 448.A N GLU 444.A O no hydrogen 3.137 N/A PHE 449.A N ILE 445.A O no hydrogen 2.847 N/A GLY 450.A N PHE 447.A O no hydrogen 3.160 N/A LEU 451.A N GLU 446.A O no hydrogen 3.067 N/A LEU 453.A N GLY 450.A O no hydrogen 3.029 N/A ASP 454.A N LEU 451.A O no hydrogen 2.946 N/A SER 456.A N ASP 454.A OD1 no hydrogen 3.240 N/A SER 456.A OG ASP 454.A OD1 no hydrogen 2.722 N/A LEU 457.A N ASP 454.A O no hydrogen 2.901 N/A ASN 458.A N PRO 455.A O no hydrogen 3.390 N/A TYR 459.A OH GLU 446.A OE2 no hydrogen 2.796 N/A THR 460.A N GLU 463.A OE1 no hydrogen 2.796 N/A THR 460.A OG1 GLU 463.A OE1 no hydrogen 3.347 N/A GLU 463.A N THR 460.A OG1 no hydrogen 3.000 N/A ARG 464.A N THR 460.A O no hydrogen 3.098 N/A ARG 464.A NH2 GLN 468.A OE1 no hydrogen 3.297 N/A ILE 465.A N THR 461.A O no hydrogen 3.070 N/A PHE 466.A N GLU 462.A O no hydrogen 2.878 N/A ALA 467.A N GLU 463.A O no hydrogen 2.961 N/A GLN 468.A N ARG 464.A O no hydrogen 3.036 N/A ARG 469.A N ILE 465.A O no hydrogen 2.882 N/A ARG 469.A NE TYR 473.A OH no hydrogen 3.132 N/A ARG 469.A NH1 ASN 508.A O no hydrogen 3.279 N/A ARG 469.A NH2 LYS 510.A O no hydrogen 3.512 N/A LEU 470.A N PHE 466.A O no hydrogen 3.016 N/A MET 471.A N ALA 467.A O no hydrogen 2.953 N/A LYS 472.A N GLN 468.A O no hydrogen 3.193 N/A LYS 472.A NZ GLU 140.A OE2 no hydrogen 3.122 N/A TYR 473.A N ARG 469.A O no hydrogen 3.014 N/A TRP 474.A N LEU 470.A O no hydrogen 3.007 N/A TRP 474.A NE1 GLN 226.A OE1 no hydrogen 2.843 N/A THR 475.A N MET 471.A O no hydrogen 3.020 N/A THR 475.A OG1 MET 471.A O no hydrogen 2.686 N/A ASN 476.A N LYS 472.A O no hydrogen 2.918 N/A ASN 476.A ND2 PRO 483.A O no hydrogen 3.128 N/A PHE 477.A N TYR 473.A O no hydrogen 2.914 N/A ALA 478.A N TRP 474.A O no hydrogen 2.956 N/A ARG 479.A N THR 475.A O no hydrogen 3.022 N/A THR 480.A N ASN 476.A O no hydrogen 2.840 N/A THR 480.A OG1 ASN 476.A O no hydrogen 3.070 N/A GLY 481.A N PHE 477.A O no hydrogen 2.794 N/A ASN 484.A N ASP 482.A OD1 no hydrogen 3.014 N/A ASN 484.A ND2 ASP 482.A OD1 no hydrogen 2.973 N/A ASN 484.A ND2 TRP 494.A O no hydrogen 2.870 N/A ASP 488.A N ASP 485.A OD1 no hydrogen 3.266 N/A SER 491.A OG ASP 488.A OD2 no hydrogen 2.713 N/A TRP 494.A N ASN 484.A OD1 no hydrogen 2.800 N/A TYR 497.A N VAL 419.A O no hydrogen 2.629 N/A ALA 501.A N THR 498.A OG1 no hydrogen 2.964 N/A GLN 502.A N THR 498.A O no hydrogen 2.729 N/A TYR 504.A N ARG 515.A O no hydrogen 3.017 N/A VAL 505.A N ALA 421.A O no hydrogen 2.955 N/A SER 506.A N GLU 513.A O no hydrogen 2.957 N/A SER 506.A OG GLU 513.A O no hydrogen 3.461 N/A LEU 507.A N ILE 423.A O no hydrogen 2.846 N/A ASN 508.A ND2 GLU 425.A OE1 no hydrogen 3.164 N/A LYS 510.A N ASN 508.A OD1 no hydrogen 3.021 N/A GLU 513.A N SER 506.A OG no hydrogen 3.290 N/A ARG 515.A N TYR 504.A O no hydrogen 2.845 N/A ARG 515.A NE GLU 513.A OE2 no hydrogen 3.006 N/A ARG 515.A NH1 GLU 425.A OE2 no hydrogen 2.778 N/A ARG 515.A NH2 GLU 425.A OE1 no hydrogen 2.890 N/A ARG 515.A NH2 GLU 513.A OE2 no hydrogen 3.369 N/A ARG 516.A NH1 GLN 503.A OE1 no hydrogen 2.891 N/A GLY 517.A N GLN 502.A O no hydrogen 2.737 N/A THR 522.A OG1 HIS 375.A NE2 no hydrogen 3.227 N/A CYS 523.A N ARG 519.A O no hydrogen 3.267 N/A CYS 523.A SG LEU 518.A O no hydrogen 3.831 N/A CYS 523.A SG ARG 519.A O no hydrogen 3.811 N/A ALA 524.A N ALA 520.A O no hydrogen 2.981 N/A PHE 525.A N GLN 521.A O no hydrogen 3.424 N/A TRP 526.A N THR 522.A O no hydrogen 3.244 N/A TRP 526.A NE1 TYR 376.A OH no hydrogen 2.861 N/A ASN 527.A N CYS 523.A O no hydrogen 2.698 N/A ASN 527.A ND2 CYS 403.A O no hydrogen 2.980 N/A ARG 528.A N ALA 524.A O no hydrogen 3.014 N/A PHE 529.A N ALA 524.A O no hydrogen 3.066 N/A LEU 530.A N PHE 525.A O no hydrogen 2.791 N/A LEU 533.A N LEU 530.A O no hydrogen 2.922 N/A