Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wok_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N PRO 1.A O no hydrogen 3.318 N/A THR 4.A OG1 PRO 1.A O no hydrogen 3.281 N/A THR 5.A N ALA 2.A O no hydrogen 3.488 N/A THR 5.A OG1 PRO 1.A O no hydrogen 3.437 N/A GLY 7.A N SER 287.A OG no hydrogen 2.555 N/A GLY 9.A N SER 287.A O no hydrogen 2.958 N/A ASP 11.A N THR 289.A O no hydrogen 2.983 N/A ALA 12.A N GLY 9.A O no hydrogen 3.040 N/A GLY 13.A N ASP 290.A OD1 no hydrogen 2.900 N/A VAL 14.A N ASP 11.A O no hydrogen 2.952 N/A VAL 18.A N VAL 535.A O no hydrogen 2.822 N/A SER 21.A N ASN 534.A OD1 no hydrogen 2.953 N/A ARG 23.A N SER 21.A OG no hydrogen 3.019 N/A ARG 23.A NE GLU 553.A OE1 no hydrogen 3.162 N/A ARG 23.A NH1 LEU 551.A O no hydrogen 3.039 N/A GLY 25.A N LEU 238.A O no hydrogen 2.734 N/A LEU 28.A N ARG 241.A O no hydrogen 2.822 N/A ARG 29.A N ASP 263.A OD2 no hydrogen 2.855 N/A LEU 30.A N GLU 243.A O no hydrogen 2.705 N/A VAL 31.A N ILE 264.A O no hydrogen 3.146 N/A SER 32.A N THR 245.A O no hydrogen 2.968 N/A SER 32.A OG ALA 34.A O no hydrogen 2.642 N/A SER 33.A N GLU 267.A OE1 no hydrogen 2.941 N/A SER 33.A OG GLU 267.A OE1 no hydrogen 2.605 N/A SER 33.A OG GLU 267.A OE2 no hydrogen 3.296 N/A ALA 34.A N SER 32.A OG no hydrogen 3.095 N/A VAL 36.A N ASP 35.A OD1 no hydrogen 2.827 N/A ASP 40.A N SER 38.A OG no hydrogen 2.937 N/A ALA 42.A N ASP 40.A OD1 no hydrogen 2.930 N/A ARG 43.A N ASP 40.A O no hydrogen 2.905 N/A ARG 43.A NE PRO 127.A O no hydrogen 2.961 N/A THR 44.A OG1 ASP 37.A OD1 no hydrogen 2.788 N/A THR 44.A OG1 ASP 37.A OD2 no hydrogen 3.436 N/A TYR 45.A N ASP 37.A OD2 no hydrogen 2.760 N/A TYR 45.A OH ASP 449.A OD2 no hydrogen 2.679 N/A TYR 46.A N ASP 37.A OD2 no hydrogen 3.097 N/A TRP 50.A N TYR 46.A O no hydrogen 3.035 N/A TRP 50.A NE1 THR 44.A O no hydrogen 2.949 N/A LEU 51.A N VAL 47.A O no hydrogen 2.999 N/A LEU 52.A N TRP 48.A O no hydrogen 2.920 N/A GLN 53.A N VAL 49.A O no hydrogen 2.720 N/A ARG 54.A N LEU 51.A O no hydrogen 3.074 N/A ARG 54.A NE ASP 545.A OD1 no hydrogen 2.861 N/A ARG 54.A NH1 TYR 63.A O no hydrogen 2.789 N/A ARG 54.A NH2 TYR 63.A O no hydrogen 3.166 N/A ARG 54.A NH2 ASP 545.A OD1 no hydrogen 3.506 N/A ARG 54.A NH2 ASP 545.A OD2 no hydrogen 2.862 N/A LEU 55.A N LEU 52.A O no hydrogen 2.890 N/A LEU 56.A N GLN 53.A O no hydrogen 3.127 N/A ASN 57.A N GLN 53.A O no hydrogen 2.943 N/A ASN 57.A ND2 ARG 203.A O no hydrogen 3.301 N/A ARG 58.A N SER 205.A OG no hydrogen 2.722 N/A ARG 58.A NE ASP 77.A OD1 no hydrogen 2.908 N/A ARG 58.A NH1 THR 231.A OG1 no hydrogen 3.038 N/A ARG 58.A NH2 ASP 77.A O no hydrogen 3.042 N/A ARG 58.A NH2 ASP 77.A OD1 no hydrogen 3.098 N/A ARG 58.A NH2 THR 231.A O no hydrogen 2.826 N/A THR 59.A N ASP 77.A OD2 no hydrogen 3.002 N/A THR 59.A OG1 MET 61.A O no hydrogen 2.511 N/A ALA 62.A N ALA 75.A O no hydrogen 2.807 N/A TYR 63.A OH HIS 178.A ND1 no hydrogen 2.654 N/A THR 65.A OG1 ILE 234.A O no hydrogen 2.658 N/A GLY 68.A N ASP 66.A OD1 no hydrogen 2.905 N/A GLY 71.A N GLY 68.A O no hydrogen 2.914 N/A LEU 72.A N PRO 69.A O no hydrogen 3.015 N/A VAL 73.A N ALA 70.A O no hydrogen 3.079 N/A ALA 75.A N ALA 62.A O no hydrogen 2.782 N/A ASP 77.A N LEU 60.A O no hydrogen 2.961 N/A LEU 78.A N THR 59.A O no hydrogen 2.894 N/A ALA 79.A N LEU 60.A O no hydrogen 3.151 N/A GLU 80.A N ARG 95.A O no hydrogen 2.750 N/A GLY 83.A N ASP 177.A OD1 no hydrogen 3.155 N/A GLU 84.A N THR 93.A O no hydrogen 2.905 N/A SER 86.A N THR 91.A O no hydrogen 2.738 N/A GLY 89.A N SER 86.A O no hydrogen 3.272 N/A ARG 90.A N ASP 87.A O no hydrogen 2.946 N/A THR 91.A N SER 86.A O no hydrogen 2.954 N/A THR 91.A OG1 ASP 87.A OD2 no hydrogen 2.659 N/A TRP 92.A N PHE 167.A O no hydrogen 2.898 N/A TRP 92.A NE1 GLY 89.A O no hydrogen 3.091 N/A THR 93.A N GLU 84.A O no hydrogen 2.896 N/A TYR 94.A N ILE 165.A O no hydrogen 2.913 N/A TYR 94.A OH ASP 177.A OD1 no hydrogen 2.669 N/A ARG 95.A NE GLU 84.A OE2 no hydrogen 2.635 N/A ARG 95.A NH2 GLU 84.A OE1 no hydrogen 2.771 N/A ARG 95.A NH2 GLU 84.A OE2 no hydrogen 3.368 N/A LEU 96.A N HIS 163.A O no hydrogen 2.810 N/A ARG 97.A N LEU 78.A O no hydrogen 2.806 N/A ARG 97.A NE ASP 77.A O no hydrogen 3.080 N/A TYR 102.A N THR 106.A O no hydrogen 2.864 N/A TYR 102.A OH ASP 112.A OD2 no hydrogen 2.623 N/A ASP 103.A N SER 204.A O no hydrogen 2.897 N/A GLY 105.A N TYR 102.A O no hydrogen 2.883 N/A THR 106.A N ASP 104.A OD1 no hydrogen 3.045 N/A THR 106.A OG1 ASP 104.A OD1 no hydrogen 2.653 N/A THR 106.A OG1 ASP 104.A OD2 no hydrogen 3.504 N/A ILE 108.A N LEU 100.A O no hydrogen 2.944 N/A THR 109.A N ASP 112.A OD2 no hydrogen 3.237 N/A THR 109.A OG1 ASP 112.A OD1 no hydrogen 3.545 N/A SER 110.A N GLU 162.A O no hydrogen 2.778 N/A SER 110.A OG ASP 161.A O no hydrogen 2.682 N/A SER 110.A OG THR 164.A O no hydrogen 3.275 N/A ASP 112.A N THR 109.A O no hydrogen 2.943 N/A ARG 114.A N SER 110.A O no hydrogen 3.042 N/A ARG 114.A NH1 VAL 157.A O no hydrogen 2.882 N/A HIS 115.A N ASP 111.A O no hydrogen 2.780 N/A HIS 115.A NE2 ASP 193.A OD2 no hydrogen 2.761 N/A ALA 116.A N ASP 112.A O no hydrogen 3.008 N/A VAL 117.A N VAL 113.A O no hydrogen 3.087 N/A GLN 118.A N ARG 114.A O no hydrogen 2.848 N/A ARG 119.A N HIS 115.A O no hydrogen 2.868 N/A ARG 119.A NE TYR 148.A OH no hydrogen 3.520 N/A ARG 119.A NE ASP 193.A OD1 no hydrogen 3.390 N/A ARG 119.A NE ASP 193.A OD2 no hydrogen 2.936 N/A ARG 119.A NH1 ASP 40.A OD1 no hydrogen 2.995 N/A ARG 119.A NH1 ASP 40.A OD2 no hydrogen 3.541 N/A ARG 119.A NH2 ASP 40.A OD2 no hydrogen 2.830 N/A ARG 119.A NH2 ASP 193.A OD1 no hydrogen 3.216 N/A PHE 121.A N GLN 118.A O no hydrogen 2.916 N/A ALA 122.A N ARG 119.A O no hydrogen 2.854 N/A GLN 123.A NE2 VAL 120.A O no hydrogen 2.773 N/A VAL 125.A N ALA 122.A O no hydrogen 3.007 N/A LEU 126.A N ALA 122.A O no hydrogen 2.775 N/A TYR 132.A OH ASP 449.A OD2 no hydrogen 2.506 N/A ILE 134.A N THR 131.A O no hydrogen 2.980 N/A LEU 137.A N LEU 133.A O no hydrogen 3.053 N/A LEU 137.A N ILE 134.A O no hydrogen 3.270 N/A ASP 138.A N ILE 134.A O no hydrogen 2.821 N/A GLU 141.A N ASP 139.A OD1 no hydrogen 2.910 N/A ARG 142.A N ASP 139.A O no hydrogen 2.802 N/A ARG 142.A NH1 GLU 152.A OE1 no hydrogen 3.351 N/A ARG 142.A NH2 GLU 152.A OE1 no hydrogen 2.708 N/A ARG 142.A NH2 GLU 152.A OE2 no hydrogen 3.203 N/A TYR 144.A N ASP 138.A OD1 no hydrogen 2.793 N/A TYR 148.A OH ASP 193.A OD1 no hydrogen 3.172 N/A TYR 148.A OH ASP 193.A OD2 no hydrogen 2.679 N/A ARG 149.A N GLY 146.A O no hydrogen 3.249 N/A ARG 149.A NE ASP 124.A OD2 no hydrogen 3.231 N/A ARG 149.A NH2 ASP 124.A OD2 no hydrogen 2.807 N/A THR 150.A N GLY 146.A O no hydrogen 3.376 N/A GLU 152.A N THR 150.A OG1 no hydrogen 3.315 N/A ARG 155.A NE GLU 152.A OE2 no hydrogen 2.700 N/A ARG 155.A NH2 GLU 152.A OE2 no hydrogen 2.735 N/A SER 156.A OG LEU 137.A O no hydrogen 2.716 N/A VAL 157.A N LEU 154.A O no hydrogen 3.246 N/A LEU 158.A N VAL 166.A O no hydrogen 2.771 N/A THR 159.A OG1 ASP 111.A OD1 no hydrogen 3.015 N/A HIS 163.A N ASP 161.A OD1 no hydrogen 2.870 N/A THR 164.A N ASP 161.A O no hydrogen 3.279 N/A THR 164.A OG1 ASP 161.A OD1 no hydrogen 2.829 N/A THR 164.A OG1 ASP 161.A OD2 no hydrogen 3.479 N/A ILE 165.A N TYR 94.A O no hydrogen 2.989 N/A VAL 166.A N LEU 158.A O no hydrogen 2.860 N/A PHE 167.A N TRP 92.A O no hydrogen 2.816 N/A ARG 168.A N SER 156.A O no hydrogen 2.753 N/A LEU 169.A N ARG 90.A O no hydrogen 2.613 N/A THR 170.A N LEU 136.A O no hydrogen 2.822 N/A THR 170.A OG1 PRO 135.A O no hydrogen 2.771 N/A THR 170.A OG1 LEU 136.A O no hydrogen 3.338 N/A PHE 173.A N GLY 89.A O no hydrogen 3.266 N/A SER 174.A OG ASP 175.A OD1 no hydrogen 2.965 N/A PHE 176.A N PHE 173.A O no hydrogen 3.239 N/A HIS 178.A N ASP 175.A O no hydrogen 2.940 N/A HIS 178.A ND1 TYR 63.A OH no hydrogen 2.654 N/A MET 180.A N PHE 176.A O no hydrogen 3.141 N/A ALA 181.A N HIS 178.A O no hydrogen 3.147 N/A GLN 182.A N LEU 179.A O no hydrogen 3.368 N/A GLN 182.A NE2 ASP 449.A O no hydrogen 3.013 N/A CYS 184.A SG PRO 130.A O no hydrogen 4.028 N/A ALA 185.A N GLN 182.A O no hydrogen 2.981 N/A ALA 186.A N PRO 183.A O no hydrogen 3.001 N/A VAL 188.A N ASP 112.A O no hydrogen 3.041 N/A ARG 191.A NH2 THR 106.A OG1 no hydrogen 2.857 N/A ARG 191.A NH2 PRO 107.A O no hydrogen 3.023 N/A SER 192.A N PRO 189.A O no hydrogen 3.011 N/A ASP 193.A N ARG 190.A O no hydrogen 3.009 N/A GLY 195.A N ASP 193.A OD1 no hydrogen 2.786 N/A ASP 197.A N THR 194.A O no hydrogen 3.126 N/A TYR 198.A N GLY 195.A O no hydrogen 2.950 N/A ARG 200.A N ASP 197.A O no hydrogen 2.952 N/A ASP 201.A N TYR 198.A O no hydrogen 3.064 N/A ARG 203.A N TYR 198.A OH no hydrogen 2.973 N/A ARG 203.A NE ASP 103.A OD1 no hydrogen 2.874 N/A ARG 203.A NH2 ASP 103.A OD2 no hydrogen 2.826 N/A SER 204.A N ASP 103.A OD1 no hydrogen 2.796 N/A SER 204.A OG.A LEU 56.A O no hydrogen 2.690 N/A SER 204.A OG.A GLY 206.A O no hydrogen 3.365 N/A SER 204.A OG.A TYR 208.A O no hydrogen 2.505 N/A SER 204.A OG.B LEU 56.A O no hydrogen 3.301 N/A SER 204.A OG.B TYR 208.A O no hydrogen 3.205 N/A GLY 206.A N LEU 56.A O no hydrogen 3.050 N/A GLY 206.A N SER 204.A OG.A no hydrogen 3.215 N/A TYR 208.A N LEU 55.A O no hydrogen 3.010 N/A TYR 208.A OH PRO 239.A O no hydrogen 2.658 N/A ARG 209.A N GLU 222.A O no hydrogen 2.871 N/A ARG 209.A NE GLU 222.A OE2 no hydrogen 2.914 N/A ALA 211.A N HIS 220.A O no hydrogen 2.734 N/A ARG 212.A N HIS 220.A O no hydrogen 3.177 N/A GLU 214.A N LEU 218.A O no hydrogen 2.850 N/A ASP 216.A N ASP 35.A OD2 no hydrogen 2.847 N/A THR 217.A N GLU 214.A O no hydrogen 2.822 N/A THR 217.A OG1 PRO 215.A O no hydrogen 3.021 N/A LEU 218.A N GLU 214.A O no hydrogen 3.020 N/A LEU 219.A N LEU 244.A O no hydrogen 2.911 N/A HIS 220.A N ARG 212.A O no hydrogen 2.783 N/A LEU 221.A N VAL 242.A O no hydrogen 2.731 N/A GLU 222.A N ARG 209.A O no hydrogen 3.040 N/A ARG 223.A NE ASP 240.A OD2 no hydrogen 3.050 N/A ARG 223.A NH1 ALA 237.A O no hydrogen 2.769 N/A ARG 223.A NH2 ALA 237.A O no hydrogen 3.266 N/A ARG 223.A NH2 ASP 240.A OD2 no hydrogen 3.098 N/A ASN 224.A N PRO 207.A O no hydrogen 2.857 N/A ASN 224.A ND2 GLY 206.A O no hydrogen 2.913 N/A HIS 226.A N ASN 224.A OD1 no hydrogen 2.819 N/A TRP 227.A N ASN 224.A O no hydrogen 3.234 N/A TRP 227.A NE1 ASP 232.A OD2 no hydrogen 2.827 N/A ARG 229.A NH1 PRO 236.A O no hydrogen 2.626 N/A ARG 229.A NH2 PRO 236.A O no hydrogen 3.260 N/A ARG 229.A NH2 ALA 237.A O no hydrogen 2.950 N/A ALA 230.A N ASP 228.A OD1 no hydrogen 3.057 N/A THR 231.A N ASP 228.A O no hydrogen 2.812 N/A THR 231.A OG1 ASP 228.A O no hydrogen 2.534 N/A ASP 232.A N ARG 229.A O no hydrogen 3.169 N/A ILE 234.A N ASP 232.A OD1 no hydrogen 2.765 N/A ARG 235.A N ASP 232.A OD1 no hydrogen 2.923 N/A ARG 235.A NE ARG 54.A O no hydrogen 2.730 N/A ARG 235.A NH1 ASP 77.A OD1 no hydrogen 2.943 N/A ARG 235.A NH1 ASP 77.A OD2 no hydrogen 3.335 N/A ARG 235.A NH1 ASP 232.A OD1 no hydrogen 3.286 N/A ARG 235.A NH1 ASP 232.A OD2 no hydrogen 2.897 N/A ARG 235.A NH2 ASP 77.A OD2 no hydrogen 2.821 N/A ASP 240.A N GLY 26.A O no hydrogen 2.789 N/A ARG 241.A N GLY 26.A O no hydrogen 3.298 N/A ARG 241.A NE GLU 243.A OE2 no hydrogen 3.329 N/A ARG 241.A NH2 GLU 243.A OE2 no hydrogen 3.094 N/A VAL 242.A N LEU 221.A O no hydrogen 3.079 N/A GLU 243.A N LEU 28.A O no hydrogen 2.845 N/A LEU 244.A N LEU 219.A O no hydrogen 2.728 N/A THR 245.A N LEU 30.A O no hydrogen 2.901 N/A ILE 246.A N THR 217.A O no hydrogen 3.048 N/A GLY 247.A N SER 32.A O no hydrogen 2.966 N/A ASP 251.A N ASP 249.A OD2 no hydrogen 2.982 N/A VAL 252.A N ASP 249.A OD2 no hydrogen 3.040 N/A LEU 253.A N ASP 249.A O no hydrogen 2.828 N/A ASP 254.A N VAL 250.A O no hydrogen 3.161 N/A ALA 255.A N ASP 251.A O no hydrogen 3.046 N/A ARG 256.A N VAL 252.A O no hydrogen 3.065 N/A ARG 256.A NE GLU 261.A OE1 no hydrogen 2.544 N/A ARG 256.A NH2 GLU 261.A OE1 no hydrogen 2.926 N/A LEU 257.A N LEU 253.A O no hydrogen 2.758 N/A ILE 258.A N ASP 254.A O no hydrogen 2.843 N/A ALA 259.A N ALA 255.A O no hydrogen 3.020 N/A GLY 260.A N LEU 257.A O no hydrogen 2.979 N/A GLU 261.A N ARG 256.A O no hydrogen 2.902 N/A ASP 263.A N ARG 29.A O no hydrogen 2.744 N/A ILE 264.A N ARG 29.A O no hydrogen 3.462 N/A LEU 266.A N VAL 31.A O no hydrogen 2.830 N/A GLY 268.A N ASN 265.A OD1 no hydrogen 3.047 N/A ARG 269.A NE GLU 267.A OE2 no hydrogen 3.115 N/A ARG 269.A NH2 SER 33.A OG no hydrogen 3.214 N/A LEU 271.A N LEU 525.A O no hydrogen 2.777 N/A GLN 272.A N ASP 254.A OD2 no hydrogen 2.812 N/A GLN 276.A N GLN 272.A O no hydrogen 2.809 N/A GLN 276.A NE2 LEU 271.A O no hydrogen 2.930 N/A ARG 277.A N HIS 273.A O no hydrogen 3.005 N/A ARG 278.A N ALA 274.A O no hydrogen 3.124 N/A ALA 279.A N ALA 275.A O no hydrogen 2.799 N/A THR 280.A N GLN 276.A O no hydrogen 3.036 N/A THR 280.A OG1 GLN 276.A O no hydrogen 2.621 N/A THR 280.A OG1 ARG 277.A O no hydrogen 3.449 N/A LEU 285.A N ASP 282.A OD1 no hydrogen 2.776 N/A ARG 286.A N ASP 282.A O no hydrogen 2.865 N/A ARG 286.A NH1 THR 280.A O no hydrogen 2.823 N/A SER 287.A N VAL 284.A O no hydrogen 3.055 N/A SER 287.A OG VAL 284.A O no hydrogen 2.562 N/A HIS 288.A N LEU 285.A O no hydrogen 3.034 N/A HIS 288.A NE2 THR 5.A O no hydrogen 2.615 N/A THR 289.A N ARG 286.A O no hydrogen 3.194 N/A THR 289.A OG1 LEU 285.A O no hydrogen 2.875 N/A ASP 290.A N HIS 526.A O no hydrogen 2.932 N/A ASN 291.A N ASP 11.A OD1 no hydrogen 2.707 N/A THR 294.A N ASP 522.A O no hydrogen 2.976 N/A THR 294.A OG1 ASP 522.A O no hydrogen 3.461 N/A THR 294.A OG1 ASP 522.A OD1.B no hydrogen 2.590 N/A PHE 296.A N THR 294.A OG1 no hydrogen 3.335 N/A LEU 297.A N TRP 446.A O no hydrogen 2.791 N/A HIS 298.A N VAL 520.A O no hydrogen 2.918 N/A HIS 298.A ND1 THR 444.A O no hydrogen 2.989 N/A PHE 299.A N THR 444.A O no hydrogen 3.029 N/A VAL 300.A N LEU 517.A O no hydrogen 2.996 N/A ALA 301.A N LEU 442.A O no hydrogen 2.832 N/A MET 302.A N VAL 515.A O no hydrogen 2.856 N/A GLN 303.A N GLY 440.A O no hydrogen 3.088 N/A GLN 303.A NE2 ALA 301.A O no hydrogen 3.132 N/A GLN 303.A NE2 LEU 439.A O no hydrogen 3.139 N/A ILE 306.A N GLN 303.A O no hydrogen 2.909 N/A PHE 309.A N ILE 306.A O no hydrogen 2.852 N/A ASN 311.A N PRO 308.A O no hydrogen 3.119 N/A HIS 313.A N ASN 311.A OD1 no hydrogen 2.810 N/A ARG 315.A N ASN 311.A O no hydrogen 3.321 N/A ARG 315.A NE HIS 513.A O no hydrogen 2.818 N/A ARG 315.A NH1 PHE 309.A O no hydrogen 2.859 N/A ARG 315.A NH2 HIS 513.A O no hydrogen 2.801 N/A ARG 316.A N VAL 312.A O no hydrogen 2.849 N/A ARG 316.A NE TYR 358.A OH no hydrogen 2.895 N/A ARG 316.A NH2 GLU 512.A O no hydrogen 2.895 N/A ALA 317.A N HIS 313.A O no hydrogen 2.932 N/A VAL 318.A N VAL 314.A O no hydrogen 3.112 N/A GLN 319.A N ARG 315.A O no hydrogen 3.055 N/A GLN 319.A NE2 ALA 514.A O no hydrogen 3.074 N/A GLN 319.A NE2 LEU 516.A O no hydrogen 2.919 N/A TYR 320.A N ARG 316.A O no hydrogen 2.874 N/A ALA 321.A N ALA 317.A O no hydrogen 2.934 N/A ALA 322.A N GLN 319.A O no hydrogen 3.263 N/A ASP 323.A N SER 405.A OG no hydrogen 3.136 N/A LYS 324.A N LEU 364.A O no hydrogen 3.092 N/A LYS 324.A NZ THR 341.A O no hydrogen 2.936 N/A LYS 324.A NZ PRO 518.A O no hydrogen 3.441 N/A LEU 326.A N ASP 323.A OD1 no hydrogen 3.005 N/A LEU 327.A N ASP 323.A O no hydrogen 2.873 N/A GLN 328.A N LYS 324.A O no hydrogen 2.988 N/A GLN 328.A NE2 GLY 337.A O no hydrogen 3.309 N/A GLN 328.A NE2 GLY 338.A O no hydrogen 3.008 N/A ASP 329.A N ILE 325.A O no hydrogen 2.885 N/A ALA 330.A N LEU 326.A O no hydrogen 2.937 N/A ARG 331.A N LEU 327.A O no hydrogen 3.243 N/A ARG 331.A NE ASP 522.A OD1.A no hydrogen 3.184 N/A ARG 331.A NH2 ASP 522.A OD2.A no hydrogen 2.406 N/A GLY 332.A N ASP 329.A O no hydrogen 3.334 N/A GLY 333.A N GLN 328.A O no hydrogen 2.941 N/A ASN 336.A N GLY 332.A O no hydrogen 3.226 N/A ASP 339.A N HIS 521.A O no hydrogen 2.683 N/A THR 341.A N LEU 519.A O no hydrogen 3.271 N/A THR 341.A OG1 ALA 343.A O no hydrogen 2.768 N/A THR 341.A OG1 HIS 521.A NE2 no hydrogen 3.246 N/A THR 342.A OG1 LEU 355.A O no hydrogen 2.679 N/A ALA 343.A N THR 341.A OG1 no hydrogen 3.171 N/A LEU 344.A N GLU 507.A OE2 no hydrogen 2.812 N/A PHE 345.A N GLU 507.A OE2 no hydrogen 2.927 N/A LEU 349.A N PRO 346.A O no hydrogen 3.081 N/A ALA 351.A N GLU 453.A OE2 no hydrogen 2.761 N/A HIS 352.A N LEU 349.A O no hydrogen 3.049 N/A HIS 352.A ND1 PHE 345.A O no hydrogen 3.044 N/A GLN 353.A NE2 ARG 504.A O no hydrogen 3.100 N/A GLN 353.A NE2 GLU 507.A OE1 no hydrogen 2.901 N/A TYR 358.A OH MET 511.A O no hydrogen 2.792 N/A LEU 364.A N GLY 361.A O no hydrogen 3.109 N/A ARG 365.A N ASP 363.A OD1 no hydrogen 3.055 N/A ARG 365.A NH1 ASP 323.A OD2 no hydrogen 3.011 N/A GLY 366.A N THR 360.A O no hydrogen 2.914 N/A ASP 367.A N TYR 320.A O no hydrogen 2.871 N/A ALA 370.A N ASP 367.A OD1 no hydrogen 2.978 N/A ALA 371.A N ASP 367.A O no hydrogen 3.003 N/A ARG 372.A N LEU 368.A O no hydrogen 2.942 N/A ARG 372.A NH2 ARG 408.A O no hydrogen 3.203 N/A ALA 373.A N ASP 369.A O no hydrogen 3.052 N/A GLU 374.A N ALA 370.A O no hydrogen 3.006 N/A LEU 375.A N ALA 371.A O no hydrogen 2.938 N/A ALA 376.A N ARG 372.A O no hydrogen 2.926 N/A ALA 377.A N ALA 373.A O no hydrogen 3.029 N/A ALA 378.A N GLU 374.A O no hydrogen 3.015 N/A GLY 379.A N ALA 376.A O no hydrogen 2.984 N/A LEU 380.A N LEU 375.A O no hydrogen 2.901 N/A GLY 383.A N LEU 380.A O no hydrogen 3.075 N/A PHE 384.A N GLY 410.A O no hydrogen 3.156 N/A ARG 385.A NH2 GLU 412.A OE2 no hydrogen 3.050 N/A ALA 386.A N GLU 412.A O no hydrogen 2.991 N/A ILE 388.A N THR 414.A O no hydrogen 2.932 N/A GLY 389.A N LEU 441.A O no hydrogen 2.832 N/A THR 390.A N LYS 416.A O no hydrogen 3.029 N/A THR 390.A OG1 GLN 391.A O no hydrogen 3.500 N/A ARG 396.A N GLY 393.A O no hydrogen 3.076 N/A ARG 396.A NE ASP 400.A OD1 no hydrogen 2.976 N/A ARG 396.A NH1 GLU 417.A OE2 no hydrogen 2.856 N/A LEU 397.A N GLY 393.A O no hydrogen 3.265 N/A VAL 398.A N LYS 394.A O no hydrogen 3.068 N/A ALA 399.A N PHE 395.A O no hydrogen 2.917 N/A ASP 400.A N ARG 396.A O no hydrogen 2.853 N/A ALA 401.A N LEU 397.A O no hydrogen 3.150 N/A VAL 402.A N VAL 398.A O no hydrogen 2.956 N/A VAL 403.A N ALA 399.A O no hydrogen 2.856 N/A GLU 404.A N ASP 400.A O no hydrogen 2.936 N/A SER 405.A N ALA 401.A O no hydrogen 2.898 N/A SER 405.A OG ALA 401.A O no hydrogen 2.860 N/A LEU 406.A N VAL 402.A O no hydrogen 2.977 N/A ALA 407.A N VAL 403.A O no hydrogen 3.040 N/A ARG 408.A NE SER 405.A O no hydrogen 2.935 N/A ARG 408.A NH1 ARG 365.A O no hydrogen 2.887 N/A ARG 408.A NH2 ALA 321.A O no hydrogen 2.847 N/A ARG 408.A NH2 ARG 365.A O no hydrogen 2.789 N/A VAL 409.A N LEU 406.A O no hydrogen 3.030 N/A GLY 410.A N ALA 407.A O no hydrogen 3.020 N/A ILE 411.A N LEU 406.A O no hydrogen 3.163 N/A GLU 412.A N PHE 384.A O no hydrogen 2.816 N/A THR 414.A N ALA 386.A O no hydrogen 2.950 N/A THR 414.A OG1 ALA 386.A O no hydrogen 3.440 N/A LYS 416.A N ILE 388.A O no hydrogen 2.859 N/A LEU 418.A N THR 390.A O no hydrogen 2.807 N/A THR 422.A N ASP 419.A OD2 no hydrogen 3.013 N/A THR 422.A OG1 ASP 419.A OD2 no hydrogen 2.697 N/A TYR 423.A N VAL 420.A O no hydrogen 3.363 N/A TYR 423.A OH VAL 443.A O no hydrogen 2.714 N/A SER 425.A N THR 422.A O no hydrogen 3.096 N/A SER 425.A OG THR 422.A O no hydrogen 3.155 N/A LEU 426.A N THR 422.A O no hydrogen 2.773 N/A GLY 427.A N THR 422.A O no hydrogen 2.994 N/A GLY 429.A N TYR 423.A O no hydrogen 3.393 N/A HIS 430.A N GLY 427.A O no hydrogen 3.160 N/A GLU 432.A N HIS 430.A ND1 no hydrogen 3.071 N/A THR 433.A OG1 LEU 426.A O no hydrogen 2.606 N/A VAL 434.A N HIS 430.A O no hydrogen 3.122 N/A ARG 435.A N PRO 431.A O no hydrogen 3.175 N/A ARG 435.A NH1 PRO 431.A O no hydrogen 3.079 N/A ARG 435.A NH1 GLU 477.A OE1 no hydrogen 3.386 N/A ARG 435.A NH1 GLU 477.A OE2 no hydrogen 2.768 N/A ARG 435.A NH2 GLU 477.A OE1 no hydrogen 2.758 N/A GLU 436.A N GLU 432.A O no hydrogen 2.817 N/A HIS 437.A N THR 433.A O no hydrogen 3.086 N/A GLY 438.A N ARG 435.A O no hydrogen 3.232 N/A LEU 439.A N VAL 434.A O no hydrogen 2.985 N/A LEU 441.A N VAL 387.A O no hydrogen 3.358 N/A LEU 442.A N ALA 301.A O no hydrogen 2.853 N/A VAL 443.A N GLY 389.A O no hydrogen 3.073 N/A THR 444.A N PHE 299.A O no hydrogen 2.999 N/A ASP 445.A N THR 444.A OG1 no hydrogen 2.876 N/A TRP 446.A N LEU 297.A O no hydrogen 2.922 N/A TRP 446.A NE1 PHE 456.A O no hydrogen 2.748 N/A THR 452.A N PHE 450.A O no hydrogen 2.826 N/A THR 452.A OG1 ASP 175.A OD2 no hydrogen 2.560 N/A GLU 453.A N GLU 453.A OE1 no hydrogen 2.782 N/A GLY 455.A N THR 452.A OG1 no hydrogen 3.066 N/A PHE 456.A N THR 452.A O no hydrogen 2.767 N/A LEU 457.A N GLU 453.A O no hydrogen 2.803 N/A ALA 458.A N TYR 454.A O no hydrogen 3.056 N/A LEU 460.A N LEU 457.A O no hydrogen 2.915 N/A VAL 461.A N LEU 457.A O no hydrogen 3.117 N/A VAL 461.A N ALA 458.A O no hydrogen 3.243 N/A ASP 462.A N ALA 458.A O no hydrogen 2.903 N/A GLY 463.A N ASN 484.A OD1 no hydrogen 3.009 N/A ARG 464.A N ASP 462.A OD1 no hydrogen 2.834 N/A ARG 464.A NE ASP 462.A OD1 no hydrogen 2.650 N/A ARG 464.A NH1 ASP 488.A OD1 no hydrogen 3.241 N/A ARG 464.A NH1 ASP 488.A OD2 no hydrogen 3.074 N/A ARG 464.A NH2 ASP 462.A OD2 no hydrogen 3.006 N/A ARG 464.A NH2 ASP 488.A OD1 no hydrogen 2.699 N/A GLN 465.A N ASP 462.A O no hydrogen 2.915 N/A ILE 466.A N GLY 463.A O no hydrogen 3.471 N/A LYS 467.A N ASN 472.A OD1 no hydrogen 3.009 N/A LYS 467.A NZ GLN 465.A OE1 no hydrogen 3.136 N/A ARG 468.A NH1 GLU 477.A OE1 no hydrogen 2.962 N/A GLY 470.A N LYS 467.A O no hydrogen 3.366 N/A GLY 471.A N SER 425.A O no hydrogen 2.973 N/A ASN 472.A N GLY 429.A O no hydrogen 2.731 N/A ASN 472.A ND2 ASN 474.A O no hydrogen 2.799 N/A ASN 474.A N ASN 472.A OD1 no hydrogen 3.162 N/A ASN 474.A ND2 ASP 462.A O no hydrogen 2.926 N/A ASN 474.A ND2 LEU 478.A O no hydrogen 2.921 N/A GLU 477.A N ASN 474.A O no hydrogen 2.929 N/A LEU 478.A N ASN 474.A OD1 no hydrogen 2.915 N/A GLU 482.A N ASP 480.A OD1 no hydrogen 2.822 N/A ASN 484.A N ASP 480.A O no hydrogen 2.895 N/A ASN 484.A ND2 ASP 479.A OD1 no hydrogen 2.811 N/A ALA 485.A N PRO 481.A O no hydrogen 2.922 N/A LEU 486.A N GLU 482.A O no hydrogen 3.042 N/A ILE 487.A N VAL 483.A O no hydrogen 3.008 N/A ASP 488.A N ASN 484.A O no hydrogen 2.997 N/A GLU 489.A N ALA 485.A O no hydrogen 3.001 N/A THR 490.A N LEU 486.A O no hydrogen 2.996 N/A THR 490.A OG1 ILE 487.A O no hydrogen 2.702 N/A LEU 491.A N ILE 487.A O no hydrogen 3.215 N/A LEU 491.A N ASP 488.A O no hydrogen 3.113 N/A HIS 492.A N GLU 489.A O no hydrogen 3.264 N/A THR 493.A N THR 490.A O no hydrogen 3.150 N/A THR 493.A OG1 GLU 489.A O no hydrogen 2.587 N/A ALA 497.A N ASP 495.A OD1 no hydrogen 2.644 N/A ALA 498.A N ASP 495.A OD1 no hydrogen 3.078 N/A ARG 499.A N ASP 495.A O no hydrogen 3.071 N/A ARG 499.A NH1 THR 493.A O no hydrogen 2.893 N/A ARG 499.A NH1 THR 494.A O no hydrogen 3.241 N/A ALA 500.A N PRO 496.A O no hydrogen 2.899 N/A GLU 501.A N ALA 497.A O no hydrogen 3.114 N/A LEU 502.A N ALA 498.A O no hydrogen 3.107 N/A TRP 503.A N ARG 499.A O no hydrogen 2.950 N/A ARG 504.A N ALA 500.A O no hydrogen 2.834 N/A ARG 504.A NE ALA 351.A O no hydrogen 3.072 N/A ARG 504.A NH1 GLU 501.A OE2 no hydrogen 2.395 N/A ARG 504.A NH2 HIS 352.A O no hydrogen 3.116 N/A ALA 505.A N GLU 501.A O no hydrogen 3.121 N/A VAL 506.A N LEU 502.A O no hydrogen 3.017 N/A GLU 507.A N TRP 503.A O no hydrogen 2.969 N/A ARG 508.A N ARG 504.A O no hydrogen 3.088 N/A ARG 509.A N ALA 505.A O no hydrogen 2.951 N/A VAL 510.A N VAL 506.A O no hydrogen 2.885 N/A MET 511.A N GLU 507.A O no hydrogen 2.955 N/A GLU 512.A N ARG 508.A O no hydrogen 2.867 N/A HIS 513.A N ARG 509.A O no hydrogen 3.180 N/A HIS 513.A NE2 ASP 480.A OD2 no hydrogen 2.679 N/A ALA 514.A N VAL 510.A O no hydrogen 3.288 N/A LEU 517.A N VAL 300.A O no hydrogen 2.831 N/A LEU 519.A N HIS 298.A O no hydrogen 2.937 N/A VAL 520.A N HIS 298.A O no hydrogen 3.352 N/A HIS 521.A N ASP 339.A O no hydrogen 2.704 N/A ASP 522.A N PHE 296.A O no hydrogen 2.892 N/A THR 524.A N PRO 292.A O no hydrogen 3.093 N/A THR 524.A OG1 ARG 269.A O no hydrogen 3.413 N/A HIS 526.A N ASP 290.A O no hydrogen 2.815 N/A HIS 526.A NE2 GLY 542.A O no hydrogen 2.926 N/A ARG 528.A N HIS 288.A O no hydrogen 2.872 N/A ARG 528.A NE ASP 290.A OD2 no hydrogen 2.858 N/A ARG 528.A NH1 SER 287.A O no hydrogen 2.868 N/A ARG 528.A NH2 GLY 9.A O no hydrogen 2.750 N/A ARG 528.A NH2 ASP 290.A OD1 no hydrogen 2.966 N/A ASN 529.A ND2 LEU 257.A O no hydrogen 3.046 N/A ASN 529.A ND2 ASP 263.A O no hydrogen 3.232 N/A TRP 531.A NE1 ASP 263.A OD1 no hydrogen 2.831 N/A VAL 532.A N ASN 529.A O no hydrogen 3.293 N/A THR 533.A N GLY 550.A O no hydrogen 2.894 N/A ASN 534.A N ASN 19.A O no hydrogen 2.859 N/A ASN 534.A ND2 SER 21.A O no hydrogen 2.858 N/A ASN 534.A ND2 ALA 548.A O no hydrogen 3.090 N/A VAL 535.A N VAL 18.A O no hydrogen 3.032 N/A TYR 536.A OH ASP 545.A OD2 no hydrogen 2.620 N/A VAL 537.A N GLY 13.A O no hydrogen 2.810 N/A HIS 538.A N LEU 543.A O no hydrogen 2.944 N/A HIS 538.A NE2 PRO 64.A O no hydrogen 2.845 N/A ALA 540.A N HIS 538.A ND1 no hydrogen 3.038 N/A PHE 541.A N HIS 538.A O no hydrogen 2.937 N/A GLY 542.A N HIS 538.A O no hydrogen 2.847 N/A TYR 544.A OH ASP 290.A OD2 no hydrogen 2.668 N/A ASP 545.A N TYR 536.A O no hydrogen 3.061 N/A GLN 547.A NE2 ILE 234.A O no hydrogen 3.644 N/A GLN 547.A NE2 ASP 545.A OD2 no hydrogen 2.970 N/A ALA 548.A N ASP 545.A O no hydrogen 3.061 N/A MET 549.A N ILE 546.A O no hydrogen 3.014 N/A GLY 550.A N THR 533.A O no hydrogen 3.144 N/A ALA 552.A N TRP 531.A O no hydrogen 2.824 N/A