Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6aru_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ GLN 56.A OE1 no hydrogen 2.738 N/A CYS 4.A N VAL 33.A O no hydrogen 3.100 N/A CYS 4.A SG VAL 33.A O no hydrogen 3.895 N/A THR 7.A N ASN 37.A O no hydrogen 3.059 N/A THR 7.A OG1 GLU 39.A OE1 no hydrogen 2.587 N/A ASN 9.A N GLU 39.A OE1 no hydrogen 2.811 N/A LYS 10.A N GLU 39.A OE2 no hydrogen 2.847 N/A THR 12.A N ASN 9.A O no hydrogen 2.716 N/A THR 12.A OG1 ASN 9.A O no hydrogen 2.532 N/A LEU 14.A N HIS 20.A ND1 no hydrogen 3.051 N/A HIS 20.A N THR 16.A O no hydrogen 2.907 N/A PHE 21.A N PHE 17.A O no hydrogen 2.947 N/A LEU 22.A N GLU 18.A O no hydrogen 2.840 N/A SER 23.A N ASP 19.A O no hydrogen 2.923 N/A SER 23.A OG HIS 20.A O no hydrogen 2.809 N/A LEU 24.A N HIS 20.A O no hydrogen 2.948 N/A GLN 25.A N PHE 21.A O no hydrogen 2.861 N/A ARG 26.A N LEU 22.A O no hydrogen 2.882 N/A MET 27.A N SER 23.A O no hydrogen 2.963 N/A PHE 28.A N LEU 24.A O no hydrogen 2.926 N/A ASN 29.A N GLN 25.A O no hydrogen 2.887 N/A CYS 31.A N PHE 28.A O no hydrogen 3.030 N/A CYS 31.A SG VAL 33.A O no hydrogen 3.426 N/A GLU 32.A N LYS 2.A O no hydrogen 3.005 N/A VAL 33.A N LYS 2.A O no hydrogen 3.225 N/A VAL 34.A N GLU 57.A O no hydrogen 2.765 N/A LEU 35.A N CYS 4.A O no hydrogen 3.015 N/A ASN 37.A ND2 THR 7.A O no hydrogen 3.153 N/A LEU 38.A N TYR 61.A O no hydrogen 2.953 N/A ILE 40.A N LEU 63.A O no hydrogen 2.858 N/A THR 41.A OG1 HIS 20.A NE2 no hydrogen 2.977 N/A TYR 42.A N ALA 65.A O no hydrogen 3.352 N/A TYR 42.A OH LEU 11.A O no hydrogen 3.200 N/A VAL 43.A N ASN 67.A OD1 no hydrogen 2.928 N/A TYR 47.A N GLN 44.A O no hydrogen 3.284 N/A SER 50.A N ASP 48.A OD2 no hydrogen 3.232 N/A SER 50.A OG ASP 48.A OD1 no hydrogen 3.260 N/A SER 50.A OG ASP 48.A OD2 no hydrogen 2.650 N/A LEU 52.A N LEU 49.A O no hydrogen 3.048 N/A LYS 53.A N SER 50.A O no hydrogen 2.969 N/A THR 54.A N PHE 51.A O no hydrogen 2.990 N/A THR 54.A OG1 CYS 31.A O no hydrogen 2.815 N/A THR 54.A OG1 PHE 51.A O no hydrogen 2.469 N/A ILE 55.A N LEU 52.A O no hydrogen 3.260 N/A GLN 56.A N GLU 32.A O no hydrogen 2.710 N/A GLU 57.A N GLU 32.A O no hydrogen 3.340 N/A VAL 58.A N ILE 79.A O no hydrogen 3.111 N/A ALA 59.A N VAL 34.A O no hydrogen 2.650 N/A GLY 60.A N GLY 36.A O no hydrogen 2.880 N/A TYR 61.A N ASN 37.A OD1 no hydrogen 2.945 N/A TYR 61.A OH GLU 39.A OE2 no hydrogen 2.474 N/A VAL 62.A N ALA 91.A O no hydrogen 2.836 N/A LEU 63.A N LEU 38.A O no hydrogen 2.908 N/A ILE 64.A N ALA 93.A O no hydrogen 2.891 N/A ALA 65.A N ILE 40.A O no hydrogen 2.991 N/A LEU 66.A N LEU 95.A O no hydrogen 3.142 N/A ASN 67.A N ASN 97.A OD1 no hydrogen 3.012 N/A ASN 67.A ND2 ILE 40.A O no hydrogen 3.042 N/A ASN 67.A ND2 ASN 97.A OD1 no hydrogen 3.219 N/A THR 68.A N VAL 43.A O no hydrogen 2.777 N/A VAL 69.A N VAL 43.A O no hydrogen 3.119 N/A ARG 71.A NE GLU 107.A OE2 no hydrogen 2.850 N/A ARG 71.A NH1 GLU 75.A OE2 no hydrogen 2.953 N/A ILE 72.A N GLU 107.A O no hydrogen 2.939 N/A LEU 74.A N ILE 72.A O no hydrogen 2.913 N/A ASN 76.A ND2 LYS 53.A O no hydrogen 2.379 N/A GLN 78.A N GLN 56.A O no hydrogen 3.094 N/A ILE 80.A N GLU 115.A O no hydrogen 3.128 N/A ARG 81.A N VAL 58.A O no hydrogen 2.792 N/A ARG 81.A NE GLU 57.A OE1 no hydrogen 3.373 N/A ARG 81.A NH1 CYS 224.A O no hydrogen 2.797 N/A ARG 81.A NH2 GLU 57.A OE1 no hydrogen 3.427 N/A ARG 81.A NH2 CYS 224.A O no hydrogen 3.176 N/A ASN 83.A N ALA 59.A O no hydrogen 2.880 N/A TYR 86.A N TYR 90.A O no hydrogen 3.158 N/A ASN 88.A ND2 TYR 90.A OH no hydrogen 3.433 N/A TYR 90.A N GLU 87.A O no hydrogen 3.240 N/A ALA 91.A N ALA 120.A O no hydrogen 2.687 N/A LEU 92.A N ALA 120.A O no hydrogen 3.439 N/A ALA 93.A N VAL 62.A O no hydrogen 2.902 N/A VAL 94.A N ARG 122.A O no hydrogen 2.841 N/A LEU 95.A N ILE 64.A O no hydrogen 2.908 N/A SER 96.A N SER 124.A O no hydrogen 3.006 N/A ASN 97.A N ASN 126.A OD1 no hydrogen 3.324 N/A ASN 97.A ND2 ILE 64.A O no hydrogen 3.462 N/A ASN 101.A ND2 ASP 99.A OD2 no hydrogen 2.717 N/A LYS 102.A N ASP 99.A O no hydrogen 2.923 N/A THR 103.A N ASP 99.A OD1 no hydrogen 3.349 N/A THR 103.A OG1 ASP 99.A OD1 no hydrogen 3.431 N/A LEU 105.A N ASN 97.A O no hydrogen 2.978 N/A LYS 106.A N GLU 70.A O no hydrogen 2.865 N/A GLU 107.A N GLU 70.A O no hydrogen 2.607 N/A MET 110.A N LEU 108.A O no hydrogen 2.925 N/A LEU 113.A N MET 110.A O no hydrogen 3.089 N/A GLN 114.A N GLN 78.A O no hydrogen 3.013 N/A GLU 115.A N GLN 78.A O no hydrogen 3.365 N/A ILE 116.A N ILE 140.A O no hydrogen 3.245 N/A ALA 120.A N SER 89.A O no hydrogen 2.470 N/A ARG 122.A N LEU 92.A O no hydrogen 2.834 N/A PHE 123.A N SER 150.A O no hydrogen 2.734 N/A SER 124.A N VAL 94.A O no hydrogen 3.219 N/A ASN 126.A ND2 VAL 94.A O no hydrogen 3.293 N/A LEU 129.A N ASN 126.A O no hydrogen 3.161 N/A CYS 130.A N LYS 106.A O no hydrogen 2.882 N/A CYS 130.A SG ALA 128.A O no hydrogen 3.613 N/A ASN 131.A ND2 GLN 161.A O no hydrogen 2.811 N/A VAL 132.A N CYS 130.A O no hydrogen 2.732 N/A SER 134.A N ASN 131.A O no hydrogen 2.927 N/A SER 134.A OG ASN 131.A O no hydrogen 2.822 N/A ILE 135.A N VAL 132.A O no hydrogen 3.083 N/A GLN 136.A N GLN 181.A OE1 no hydrogen 2.826 N/A ASP 139.A N GLN 136.A O no hydrogen 3.015 N/A ILE 140.A N TRP 137.A O no hydrogen 2.782 N/A VAL 141.A N TRP 137.A O no hydrogen 2.732 N/A SER 142.A OG LEU 117.A O no hydrogen 3.194 N/A PHE 145.A N SER 142.A O no hydrogen 2.730 N/A LEU 146.A N SER 143.A O no hydrogen 3.382 N/A ASN 148.A N PHE 145.A O no hydrogen 2.911 N/A ASN 148.A ND2 SER 89.A OG no hydrogen 3.059 N/A SER 150.A N VAL 121.A O no hydrogen 3.169 N/A ASP 152.A N PHE 123.A O no hydrogen 2.955 N/A HIS 156.A N PRO 127.A O no hydrogen 3.020 N/A LEU 157.A N PRO 127.A O no hydrogen 3.210 N/A CYS 163.A SG GLY 170.A O no hydrogen 3.437 N/A SER 166.A N ASP 164.A OD2 no hydrogen 3.148 N/A SER 166.A OG ASP 164.A OD2 no hydrogen 3.012 N/A CYS 167.A N ASP 164.A O no hydrogen 3.109 N/A CYS 167.A SG ASP 164.A O no hydrogen 3.403 N/A GLY 170.A N CYS 167.A O no hydrogen 3.476 N/A SER 171.A N PRO 168.A O no hydrogen 2.985 N/A SER 171.A OG SER 134.A O no hydrogen 2.530 N/A CYS 172.A N SER 134.A OG no hydrogen 2.729 N/A CYS 172.A SG GLY 174.A O no hydrogen 3.134 N/A TRP 173.A N ASN 179.A O no hydrogen 2.781 N/A ASN 179.A ND2 ALA 175.A O no hydrogen 2.901 N/A CYS 180.A SG GLU 177.A O no hydrogen 3.484 N/A GLN 181.A N SER 171.A O no hydrogen 3.156 N/A GLN 181.A NE2 GLN 136.A O no hydrogen 3.292 N/A THR 184.A N ASP 139.A OD1 no hydrogen 3.229 N/A THR 184.A N ASP 139.A OD2 no hydrogen 2.915 N/A THR 184.A OG1 GLN 114.A OE1 no hydrogen 3.417 N/A THR 184.A OG1 ALA 211.A O no hydrogen 2.672 N/A LYS 185.A N ASP 139.A OD2 no hydrogen 2.632 N/A LYS 185.A NZ ARG 138.A O no hydrogen 2.906 N/A ILE 186.A N ASP 139.A OD2 no hydrogen 3.054 N/A CYS 188.A N LYS 185.A O no hydrogen 3.352 N/A CYS 188.A SG THR 184.A O no hydrogen 3.348 N/A CYS 188.A SG LYS 185.A O no hydrogen 3.653 N/A CYS 188.A SG GLY 194.A O no hydrogen 3.716 N/A CYS 192.A N ALA 189.A O no hydrogen 2.913 N/A ARG 195.A NH1 ASP 139.A O no hydrogen 2.792 N/A ARG 195.A NH1 ASP 139.A OD1 no hydrogen 3.308 N/A ARG 195.A NH1 THR 184.A OG1 no hydrogen 3.178 N/A ARG 195.A NH2 GLU 115.A OE2 no hydrogen 3.382 N/A ARG 195.A NH2 ASP 139.A O no hydrogen 3.043 N/A CYS 196.A N THR 184.A O no hydrogen 3.224 N/A CYS 196.A SG GLY 198.A O no hydrogen 3.405 N/A LYS 199.A NZ ILE 187.A O no hydrogen 3.035 N/A SER 202.A OG ASP 203.A OD1 no hydrogen 3.569 N/A CYS 204.A SG CYS 205.A O no hydrogen 3.952 N/A CYS 205.A N ARG 195.A O no hydrogen 3.215 N/A GLN 208.A N HIS 206.A ND1 no hydrogen 3.287 N/A GLN 208.A NE2 ASP 235.A OD1 no hydrogen 2.757 N/A CYS 209.A N HIS 206.A O no hydrogen 2.813 N/A CYS 209.A SG HIS 206.A O no hydrogen 3.067 N/A ALA 210.A N VAL 223.A O no hydrogen 2.751 N/A ALA 211.A N GLU 115.A OE1 no hydrogen 3.113 N/A GLY 212.A N ALA 210.A O no hydrogen 2.676 N/A CYS 213.A SG GLY 215.A O no hydrogen 3.207 N/A THR 214.A N ASP 220.A O no hydrogen 3.188 N/A ARG 217.A N ASP 220.A OD1 no hydrogen 2.979 N/A GLU 218.A N GLU 218.A OE1 no hydrogen 2.765 N/A SER 219.A OG ASP 220.A OD2 no hydrogen 3.152 N/A ASP 220.A N ARG 217.A O no hydrogen 3.235 N/A LEU 222.A N GLY 212.A O no hydrogen 2.685 N/A CYS 224.A SG PHE 227.A O no hydrogen 3.684 N/A ARG 225.A N GLN 208.A O no hydrogen 3.037 N/A PHE 227.A N LYS 234.A O no hydrogen 3.007 N/A ARG 228.A N ALA 262.A O no hydrogen 2.922 N/A ARG 228.A NH1 CYS 221.A O no hydrogen 3.004 N/A ASP 229.A N THR 232.A O no hydrogen 2.868 N/A THR 232.A N ASP 229.A O no hydrogen 2.934 N/A THR 232.A OG1 ASP 229.A O no hydrogen 3.097 N/A CYS 233.A N GLU 218.A O no hydrogen 2.729 N/A CYS 233.A SG GLU 218.A O no hydrogen 3.316 N/A LYS 234.A N PHE 227.A O no hydrogen 2.872 N/A LYS 234.A NZ ASP 229.A OD2 no hydrogen 3.390 N/A THR 236.A OG1 ASP 235.A O no hydrogen 2.796 N/A CYS 237.A SG TYR 258.A O no hydrogen 3.591 N/A CYS 237.A SG THR 263.A O no hydrogen 3.685 N/A LEU 242.A N ASP 251.A O no hydrogen 2.897 N/A TYR 243.A N MET 573.A O no hydrogen 2.725 N/A TYR 243.A OH ASP 560.A OD1 no hydrogen 2.442 N/A ASN 244.A N GLN 249.A O no hydrogen 3.476 N/A THR 247.A N ASN 244.A OD1 no hydrogen 2.713 N/A THR 247.A OG1 ASN 244.A OD1 no hydrogen 3.184 N/A THR 247.A OG1 ASP 251.A OD2 no hydrogen 2.883 N/A TYR 248.A N ASN 244.A O no hydrogen 2.910 N/A ASP 251.A N LEU 242.A O no hydrogen 2.907 N/A ASN 253.A N LEU 240.A O no hydrogen 2.764 N/A ASN 253.A ND2 PRO 239.A O no hydrogen 3.296 N/A GLY 256.A N ASN 253.A O no hydrogen 2.884 N/A LYS 257.A N PRO 238.A O no hydrogen 2.984 N/A LYS 257.A NZ ASP 229.A OD1 no hydrogen 2.697 N/A TYR 258.A N VAL 265.A O no hydrogen 2.820 N/A SER 259.A N GLY 278.A O no hydrogen 2.974 N/A SER 259.A OG GLY 278.A O no hydrogen 3.473 N/A PHE 260.A N THR 263.A O no hydrogen 2.895 N/A THR 263.A N PHE 260.A O no hydrogen 2.868 N/A THR 263.A OG1 PHE 260.A O no hydrogen 3.318 N/A CYS 264.A N ARG 228.A O no hydrogen 3.026 N/A VAL 265.A N TYR 258.A O no hydrogen 2.922 N/A TYR 272.A N PRO 269.A O no hydrogen 3.070 N/A VAL 273.A N VAL 281.A O no hydrogen 2.816 N/A VAL 274.A N ARG 297.A O no hydrogen 3.040 N/A THR 275.A N SER 279.A O no hydrogen 2.966 N/A THR 275.A OG1 SER 279.A O no hydrogen 3.029 N/A THR 275.A OG1 SER 279.A OG no hydrogen 2.817 N/A GLY 278.A N THR 275.A O no hydrogen 3.407 N/A SER 279.A N THR 275.A OG1 no hydrogen 3.092 N/A SER 279.A OG THR 275.A OG1 no hydrogen 2.817 N/A SER 279.A OG HIS 277.A NE2 no hydrogen 3.046 N/A CYS 280.A N SER 259.A O no hydrogen 3.070 N/A CYS 280.A SG SER 259.A O no hydrogen 3.556 N/A VAL 281.A N VAL 273.A O no hydrogen 3.089 N/A CYS 284.A SG TYR 289.A O no hydrogen 3.929 N/A TYR 289.A N LYS 300.A O no hydrogen 2.870 N/A MET 291.A N LYS 298.A O no hydrogen 2.949 N/A GLU 293.A N VAL 296.A O no hydrogen 2.968 N/A VAL 296.A N GLU 293.A O no hydrogen 2.932 N/A LYS 298.A N MET 291.A O no hydrogen 2.864 N/A CYS 299.A N VAL 274.A O no hydrogen 2.727 N/A LYS 300.A N TYR 289.A O no hydrogen 2.927 N/A CYS 302.A N ASP 287.A O no hydrogen 2.836 N/A CYS 306.A SG ALA 286.A O no hydrogen 3.380 N/A LYS 308.A N THR 336.A OG1 no hydrogen 2.927 N/A CYS 310.A N SER 337.A O no hydrogen 3.047 N/A ILE 313.A N ASP 341.A O no hydrogen 2.767 N/A GLY 314.A N PHE 318.A O no hydrogen 2.953 N/A ILE 315.A N GLY 312.A O no hydrogen 3.067 N/A GLU 317.A N GLU 317.A OE1 no hydrogen 2.301 N/A LYS 319.A N GLY 316.A O no hydrogen 2.831 N/A SER 321.A N PHE 318.A O no hydrogen 3.128 N/A SER 321.A OG PHE 318.A O no hydrogen 2.459 N/A SER 323.A OG ILE 324.A O no hydrogen 2.922 N/A SER 323.A OG HIS 343.A O no hydrogen 3.208 N/A ILE 324.A N HIS 343.A O no hydrogen 2.905 N/A ASN 325.A N ASN 328.A OD1 no hydrogen 2.751 N/A THR 327.A N ASN 325.A OD1 no hydrogen 2.892 N/A ASN 328.A N ASN 325.A OD1 no hydrogen 3.360 N/A ASN 328.A ND2 SER 323.A O no hydrogen 2.650 N/A ILE 329.A N ASN 325.A O no hydrogen 3.027 N/A HIS 331.A N ASN 328.A O no hydrogen 2.879 N/A PHE 332.A N ILE 329.A O no hydrogen 2.987 N/A LYS 333.A N LYS 330.A O no hydrogen 3.335 N/A CYS 335.A N PHE 332.A O no hydrogen 3.134 N/A CYS 335.A SG HIS 331.A O no hydrogen 3.701 N/A CYS 335.A SG PHE 332.A O no hydrogen 3.240 N/A CYS 335.A SG LYS 333.A O no hydrogen 3.829 N/A THR 336.A N LYS 308.A O no hydrogen 2.688 N/A THR 336.A OG1 LYS 308.A O no hydrogen 3.302 N/A SER 337.A N LYS 308.A O no hydrogen 3.171 N/A ILE 338.A N GLU 373.A O no hydrogen 2.615 N/A SER 339.A N CYS 310.A O no hydrogen 2.762 N/A GLY 340.A N THR 375.A OG1 no hydrogen 2.800 N/A LEU 342.A N PHE 377.A O no hydrogen 2.941 N/A ILE 344.A N LEU 379.A O no hydrogen 2.867 N/A LEU 345.A N SER 323.A OG no hydrogen 3.085 N/A ALA 348.A N LEU 345.A O no hydrogen 2.865 N/A ARG 350.A N PRO 346.A O no hydrogen 2.961 N/A GLY 351.A N VAL 347.A O no hydrogen 3.087 N/A ASP 352.A N THR 357.A O no hydrogen 2.608 N/A THR 355.A N ASP 352.A OD2 no hydrogen 2.946 N/A THR 355.A OG1 ASP 352.A O no hydrogen 3.569 N/A THR 355.A OG1 ASP 352.A OD2 no hydrogen 2.775 N/A THR 355.A OG1 THR 357.A OG1 no hydrogen 2.223 N/A HIS 356.A N SER 353.A O no hydrogen 2.751 N/A THR 357.A N ASP 352.A O no hydrogen 2.855 N/A THR 357.A OG1 ASP 352.A O no hydrogen 3.541 N/A THR 357.A OG1 THR 355.A OG1 no hydrogen 2.223 N/A LEU 360.A N ALA 348.A O no hydrogen 2.950 N/A GLN 363.A N ASP 361.A OD1 no hydrogen 3.412 N/A GLU 364.A N ASP 361.A O no hydrogen 2.776 N/A LEU 365.A N PRO 362.A O no hydrogen 2.973 N/A ASP 366.A N GLN 363.A O no hydrogen 2.980 N/A ILE 367.A N GLU 364.A O no hydrogen 2.913 N/A LEU 368.A N LEU 365.A O no hydrogen 2.964 N/A LYS 369.A N ASP 366.A O no hydrogen 2.952 N/A LYS 369.A NZ HIS 391.A O no hydrogen 3.492 N/A LYS 369.A NZ GLU 394.A OE2 no hydrogen 2.988 N/A THR 370.A OG1 CYS 335.A O no hydrogen 2.711 N/A THR 370.A OG1 ILE 367.A O no hydrogen 3.457 N/A VAL 371.A N LEU 368.A O no hydrogen 3.124 N/A LYS 372.A N THR 336.A O no hydrogen 2.676 N/A GLU 373.A N THR 336.A O no hydrogen 3.148 N/A ILE 374.A N ILE 398.A O no hydrogen 2.941 N/A THR 375.A N ILE 338.A O no hydrogen 3.014 N/A THR 375.A OG1 ILE 338.A O no hydrogen 3.538 N/A GLY 376.A N GLY 340.A O no hydrogen 3.162 N/A PHE 377.A N ASP 341.A OD1 no hydrogen 2.874 N/A LEU 378.A N SER 410.A O no hydrogen 2.927 N/A LEU 379.A N LEU 342.A O no hydrogen 2.874 N/A ILE 380.A N ALA 412.A O no hydrogen 2.838 N/A GLN 381.A N ILE 344.A O no hydrogen 2.810 N/A ALA 382.A N ILE 344.A O no hydrogen 3.241 N/A TRP 383.A NE1 ASP 389.A O no hydrogen 2.991 N/A ARG 387.A N PRO 384.A O no hydrogen 3.138 N/A PHE 393.A N LEU 390.A O no hydrogen 3.254 N/A GLU 394.A N HIS 391.A O no hydrogen 3.006 N/A LEU 396.A N PHE 393.A O no hydrogen 3.029 N/A GLU 397.A N LYS 372.A O no hydrogen 2.714 N/A ILE 398.A N LYS 372.A O no hydrogen 3.043 N/A ILE 399.A N GLU 428.A O no hydrogen 3.045 N/A ARG 400.A N ILE 374.A O no hydrogen 2.848 N/A ARG 400.A NE GLU 373.A OE2 no hydrogen 2.819 N/A ARG 400.A NH2 GLU 373.A OE2 no hydrogen 2.817 N/A GLY 401.A N GLY 376.A O no hydrogen 2.848 N/A ARG 402.A N THR 375.A O no hydrogen 2.942 N/A THR 403.A OG1 ASP 341.A OD1 no hydrogen 2.785 N/A LYS 404.A NZ GLY 401.A O no hydrogen 3.119 N/A LYS 404.A NZ ARG 402.A O no hydrogen 3.553 N/A LYS 404.A NZ ASP 431.A OD2 no hydrogen 2.940 N/A GLN 405.A N PHE 409.A O no hydrogen 2.950 N/A GLN 405.A NE2 HIS 406.A NE2 no hydrogen 2.784 N/A GLY 407.A N LYS 404.A O no hydrogen 2.856 N/A GLN 408.A N GLN 405.A O no hydrogen 2.864 N/A PHE 409.A N GLN 405.A O no hydrogen 3.044 N/A SER 410.A N ASP 433.A O no hydrogen 2.864 N/A SER 410.A OG ASP 431.A O no hydrogen 2.703 N/A SER 410.A OG ASP 433.A O no hydrogen 3.388 N/A LEU 411.A N ASP 433.A O no hydrogen 3.457 N/A ALA 412.A N LEU 378.A O no hydrogen 2.900 N/A VAL 413.A N ILE 435.A O no hydrogen 2.931 N/A VAL 414.A N ILE 380.A O no hydrogen 2.947 N/A SER 415.A N SER 437.A O no hydrogen 2.718 N/A LEU 416.A N ASN 439.A OD1 no hydrogen 2.634 N/A ASN 417.A ND2 GLU 385.A O no hydrogen 2.902 N/A THR 419.A N THR 388.A O no hydrogen 2.638 N/A THR 419.A OG1 THR 388.A O no hydrogen 3.047 N/A SER 420.A N THR 388.A O no hydrogen 3.070 N/A GLY 422.A N TRP 489.A O no hydrogen 3.251 N/A ARG 424.A NH1 ASP 495.A OD1 no hydrogen 2.644 N/A ARG 424.A NH2 ASP 389.A OD2 no hydrogen 3.386 N/A ARG 424.A NH2 GLU 394.A OE1 no hydrogen 3.489 N/A SER 425.A OG GLU 394.A O no hydrogen 3.121 N/A LEU 426.A N LEU 423.A O no hydrogen 3.106 N/A LYS 427.A N GLU 397.A O no hydrogen 2.706 N/A ILE 429.A N LEU 453.A O no hydrogen 2.885 N/A SER 430.A N ILE 399.A O no hydrogen 3.191 N/A SER 430.A OG GLU 428.A OE2 no hydrogen 3.169 N/A ASP 433.A N GLN 408.A O no hydrogen 3.004 N/A VAL 434.A N LYS 460.A O no hydrogen 3.233 N/A ILE 435.A N LEU 411.A O no hydrogen 2.880 N/A ILE 436.A N LYS 462.A O no hydrogen 2.884 N/A SER 437.A N VAL 413.A O no hydrogen 3.158 N/A GLY 438.A N ILE 464.A O no hydrogen 3.364 N/A ASN 439.A N ASN 466.A OD1 no hydrogen 2.836 N/A ASN 439.A ND2 VAL 413.A O no hydrogen 3.260 N/A ASN 439.A ND2 ASN 466.A OD1 no hydrogen 3.275 N/A ASN 441.A ND2 ASN 417.A O no hydrogen 3.026 N/A LEU 442.A N ASN 439.A O no hydrogen 2.869 N/A CYS 443.A N THR 419.A O no hydrogen 2.682 N/A CYS 443.A SG GLN 477.A OE1 no hydrogen 3.573 N/A THR 447.A OG1 TYR 444.A O no hydrogen 2.608 N/A THR 447.A OG1 CYS 488.A O no hydrogen 3.366 N/A TRP 450.A NE1 ALA 445.A O no hydrogen 3.147 N/A LYS 451.A N ASN 449.A OD1 no hydrogen 3.152 N/A LYS 452.A N ASN 449.A O no hydrogen 2.986 N/A LYS 452.A NZ GLU 486.A OE1 no hydrogen 2.802 N/A PHE 454.A N TRP 450.A O no hydrogen 3.085 N/A GLY 455.A N GLN 459.A OE1 no hydrogen 3.129 N/A THR 456.A N GLN 459.A OE1 no hydrogen 3.110 N/A THR 456.A OG1 SER 430.A O no hydrogen 3.073 N/A THR 456.A OG1 ASP 431.A OD1 no hydrogen 2.984 N/A THR 456.A OG1 GLN 459.A OE1 no hydrogen 3.266 N/A GLN 459.A NE2 ILE 429.A O no hydrogen 3.015 N/A GLN 459.A NE2 GLY 432.A O no hydrogen 2.538 N/A LYS 460.A N ASP 433.A OD1 no hydrogen 2.775 N/A LYS 462.A N VAL 434.A O no hydrogen 2.859 N/A ILE 464.A N ILE 436.A O no hydrogen 2.876 N/A ASN 466.A ND2 ILE 436.A O no hydrogen 3.261 N/A ARG 467.A N LEU 442.A O no hydrogen 3.180 N/A ARG 467.A NE SER 471.A OG no hydrogen 2.524 N/A CYS 472.A N GLY 468.A O no hydrogen 2.552 N/A CYS 472.A SG CYS 443.A O no hydrogen 3.490 N/A CYS 472.A SG ARG 467.A O no hydrogen 3.942 N/A CYS 472.A SG GLY 468.A O no hydrogen 3.426 N/A LYS 473.A N GLU 469.A O no hydrogen 3.003 N/A ALA 474.A N ASN 470.A O no hydrogen 2.848 N/A THR 475.A N SER 471.A O no hydrogen 2.920 N/A THR 475.A N CYS 472.A O no hydrogen 3.210 N/A THR 475.A OG1 SER 471.A O no hydrogen 2.945 N/A THR 475.A OG1 CYS 472.A O no hydrogen 3.478 N/A THR 475.A OG1 GLN 477.A OE1 no hydrogen 2.818 N/A GLY 476.A N LYS 473.A O no hydrogen 3.045 N/A GLN 477.A N CYS 472.A O no hydrogen 3.055 N/A VAL 478.A N GLY 476.A O no hydrogen 2.909 N/A CYS 479.A SG THR 447.A OG1 no hydrogen 3.601 N/A LEU 482.A N HIS 480.A ND1 no hydrogen 3.054 N/A CYS 483.A N HIS 480.A O no hydrogen 2.937 N/A SER 484.A N SER 498.A O no hydrogen 2.801 N/A SER 484.A OG SER 498.A O no hydrogen 2.631 N/A SER 484.A OG SER 498.A OG no hydrogen 2.317 N/A GLY 487.A N SER 484.A O no hydrogen 3.358 N/A CYS 488.A SG GLY 490.A O no hydrogen 3.158 N/A TRP 489.A N ASP 495.A O no hydrogen 2.828 N/A GLU 492.A N ASP 495.A OD2 no hydrogen 3.057 N/A ASP 495.A N GLU 492.A O no hydrogen 3.042 N/A CYS 496.A SG PRO 493.A O no hydrogen 3.391 N/A VAL 497.A N GLY 487.A O no hydrogen 2.966 N/A SER 498.A OG SER 484.A OG no hydrogen 2.317 N/A SER 498.A OG GLU 486.A OE2 no hydrogen 2.293 N/A CYS 499.A SG VAL 502.A O no hydrogen 3.727 N/A ARG 500.A N LEU 482.A O no hydrogen 2.817 N/A ARG 500.A NE ALA 481.A O no hydrogen 2.960 N/A VAL 502.A N VAL 509.A O no hydrogen 3.036 N/A SER 503.A N SER 526.A O no hydrogen 3.230 N/A SER 503.A OG SER 526.A O no hydrogen 3.483 N/A ARG 504.A N GLU 507.A O no hydrogen 2.858 N/A ARG 504.A NE GLU 521.A OE1 no hydrogen 3.013 N/A ARG 504.A NE GLU 521.A OE2 no hydrogen 2.626 N/A ARG 504.A NH2 LYS 511.A O no hydrogen 3.455 N/A ARG 504.A NH2 GLU 521.A OE1 no hydrogen 2.732 N/A GLU 507.A N ARG 504.A O no hydrogen 2.975 N/A CYS 508.A N PRO 493.A O no hydrogen 3.104 N/A VAL 509.A N VAL 502.A O no hydrogen 2.830 N/A LYS 513.A N GLU 521.A OE1 no hydrogen 3.203 N/A LEU 514.A N CYS 512.A O no hydrogen 2.522 N/A ARG 520.A NE GLY 517.A O no hydrogen 2.767 N/A ARG 520.A NH1 GLN 538.A O no hydrogen 2.826 N/A GLU 521.A N LYS 513.A O no hydrogen 3.201 N/A PHE 522.A N ILE 529.A O no hydrogen 2.872 N/A GLU 524.A N GLU 527.A O no hydrogen 2.909 N/A GLU 527.A N GLU 524.A O no hydrogen 2.929 N/A CYS 528.A N SER 503.A O no hydrogen 2.793 N/A CYS 528.A SG SER 503.A O no hydrogen 3.385 N/A ILE 529.A N PHE 522.A O no hydrogen 2.940 N/A CYS 531.A N ARG 520.A O no hydrogen 2.595 N/A GLU 534.A N HIS 532.A ND1 no hydrogen 3.016 N/A CYS 535.A N HIS 532.A O no hydrogen 2.850 N/A LEU 536.A N GLN 554.A O no hydrogen 2.826 N/A GLN 538.A N THR 543.A OG1 no hydrogen 2.874 N/A GLN 538.A NE2 GLN 554.A OE1 no hydrogen 2.643 N/A ASN 541.A N GLN 538.A O no hydrogen 3.359 N/A CYS 544.A SG GLY 546.A O no hydrogen 3.733 N/A THR 545.A N ASN 551.A O no hydrogen 2.876 N/A THR 545.A OG1 ASN 551.A O no hydrogen 3.365 N/A ASN 551.A ND2 ARG 547.A O no hydrogen 2.862 N/A CYS 552.A SG PRO 549.A O no hydrogen 3.345 N/A ILE 553.A N THR 543.A O no hydrogen 3.122 N/A ALA 556.A N GLU 534.A O no hydrogen 2.788 N/A HIS 557.A ND1 GLU 534.A OE1 no hydrogen 2.905 N/A TYR 558.A N VAL 565.A O no hydrogen 2.980 N/A ILE 559.A N HIS 588.A O no hydrogen 3.176 N/A ASP 560.A N HIS 563.A O no hydrogen 2.876 N/A HIS 563.A N ASP 560.A O no hydrogen 2.915 N/A HIS 563.A NE2 THR 247.A O no hydrogen 3.018 N/A CYS 564.A N PRO 549.A O no hydrogen 3.232 N/A CYS 564.A SG PRO 549.A O no hydrogen 3.408 N/A VAL 565.A N TYR 558.A O no hydrogen 2.837 N/A GLY 571.A N VAL 580.A O no hydrogen 2.905 N/A GLY 574.A N THR 578.A O no hydrogen 3.044 N/A ASN 577.A ND2 ASN 577.A O no hydrogen 2.738 N/A THR 578.A N GLU 575.A O no hydrogen 3.327 N/A THR 578.A OG1 GLU 575.A O no hydrogen 3.408 N/A THR 578.A OG1 ASN 576.A O no hydrogen 3.005 N/A VAL 580.A N VAL 572.A O no hydrogen 2.771 N/A LYS 582.A N PRO 569.A O no hydrogen 3.160 N/A LYS 582.A NZ TYR 243.A OH no hydrogen 3.052 N/A LYS 582.A NZ ASP 560.A OD2 no hydrogen 2.895 N/A TYR 583.A N HIS 591.A O no hydrogen 2.904 N/A ASP 585.A N VAL 589.A O no hydrogen 3.389 N/A GLY 587.A N ASP 585.A OD1 no hydrogen 2.933 N/A HIS 588.A N ASP 585.A O no hydrogen 2.782 N/A HIS 588.A ND1 ASP 585.A O no hydrogen 3.342 N/A VAL 589.A N ASP 585.A OD1 no hydrogen 2.936 N/A CYS 590.A N ILE 559.A O no hydrogen 2.940 N/A CYS 590.A SG ILE 559.A O no hydrogen 3.645 N/A HIS 591.A N TYR 583.A O no hydrogen 2.968 N/A CYS 593.A N TRP 581.A O no hydrogen 2.708 N/A CYS 593.A SG CYS 601.A O no hydrogen 3.653 N/A ASN 596.A N HIS 594.A ND1 no hydrogen 3.265 N/A CYS 597.A N HIS 594.A O no hydrogen 2.780 N/A CYS 597.A SG GLY 605.A O no hydrogen 4.001 N/A THR 598.A N ASN 596.A O no hydrogen 2.903 N/A THR 598.A OG1 ASN 596.A O no hydrogen 3.515 N/A GLY 600.A N CYS 597.A O no hydrogen 3.118 N/A CYS 601.A SG GLY 603.A O no hydrogen 3.108 N/A GLY 608.A N PRO 604.A O no hydrogen 3.469 N/A CYS 609.A N ARG 607.A O no hydrogen 2.734 N/A CYS 609.A SG GLY 605.A O no hydrogen 3.879 N/A CYS 609.A SG GLY 608.A O no hydrogen 3.248 N/A