Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1x9n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG ASP 1.A OD1 no hydrogen 3.154 N/A GLY 4.A N ASP 1.A O no hydrogen 2.995 N/A TYR 5.A N PRO 2.A O no hydrogen 2.928 N/A TYR 5.A OH TYR 12.A OH no hydrogen 2.859 N/A ALA 8.A N ASN 6.A OD1 no hydrogen 3.234 N/A LYS 9.A N ASN 6.A O no hydrogen 3.001 N/A LYS 9.A NZ ASN 11.A O no hydrogen 3.057 N/A LYS 9.A NZ ASP 17.A OD1 no hydrogen 3.110 N/A LYS 9.A NZ ASP 17.A OD2 no hydrogen 2.561 N/A TYR 12.A OH SER 56.A OG no hydrogen 2.653 N/A HIS 13.A N ASP 17.A OD2 no hydrogen 2.435 N/A ASP 17.A N HIS 13.A O no hydrogen 2.592 N/A TRP 20.A NE1 SER 61.A OG no hydrogen 2.858 N/A GLY 23.A N LEU 60.A O no hydrogen 2.833 N/A GLN 24.A N LYS 21.A O no hydrogen 2.809 N/A GLN 24.A NE2 LYS 25.A O no hydrogen 3.431 N/A VAL 26.A N ASP 64.A OD2 no hydrogen 2.700 N/A TYR 28.A N LEU 128.A O no hydrogen 2.794 N/A ALA 30.A N PRO 27.A O no hydrogen 2.946 N/A VAL 31.A N PRO 27.A O no hydrogen 3.459 N/A ALA 32.A N TYR 28.A O no hydrogen 2.773 N/A ARG 33.A N LEU 29.A O no hydrogen 2.901 N/A ARG 33.A NE GLU 36.A OE2 no hydrogen 2.873 N/A ARG 33.A NH1 SER 3.A O no hydrogen 2.855 N/A ARG 33.A NH2 GLU 36.A OE1 no hydrogen 3.214 N/A ARG 33.A NH2 GLU 36.A OE2 no hydrogen 3.040 N/A THR 34.A N ALA 30.A O no hydrogen 3.069 N/A THR 34.A OG1 ALA 30.A O no hydrogen 2.905 N/A PHE 35.A N VAL 31.A O no hydrogen 3.161 N/A GLU 36.A N ALA 32.A O no hydrogen 2.796 N/A LYS 37.A N ARG 33.A O no hydrogen 3.029 N/A ILE 38.A N THR 34.A O no hydrogen 2.918 N/A GLU 39.A N PHE 35.A O no hydrogen 3.038 N/A GLU 40.A N GLU 36.A O no hydrogen 3.029 N/A VAL 41.A N ILE 38.A O no hydrogen 2.812 N/A ARG 46.A NE ARG 46.A O no hydrogen 3.112 N/A ARG 46.A NE THR 49.A OG1 no hydrogen 3.183 N/A ARG 46.A NH2 THR 49.A OG1 no hydrogen 3.151 N/A GLU 48.A N LEU 45.A O no hydrogen 3.249 N/A THR 49.A N ARG 46.A O no hydrogen 2.955 N/A THR 49.A OG1 ARG 46.A O no hydrogen 3.228 N/A SER 51.A N VAL 47.A O no hydrogen 2.691 N/A ASN 52.A N GLU 48.A O no hydrogen 3.046 N/A ASN 52.A ND2 PRO 7.A O no hydrogen 2.651 N/A LEU 53.A N THR 49.A O no hydrogen 3.285 N/A LEU 54.A N LEU 50.A O no hydrogen 3.031 N/A ARG 55.A N SER 51.A O no hydrogen 2.733 N/A ARG 55.A NE THR 199.A OG1 no hydrogen 2.866 N/A ARG 55.A NH1 ASN 52.A OD1 no hydrogen 3.492 N/A ARG 55.A NH2 THR 199.A OG1 no hydrogen 3.349 N/A ARG 55.A NH2 VAL 209.A O no hydrogen 2.533 N/A SER 56.A N ASN 52.A O no hydrogen 3.225 N/A SER 56.A OG TYR 12.A OH no hydrogen 2.653 N/A SER 56.A OG PRO 14.A O no hydrogen 2.898 N/A SER 56.A OG ASN 52.A O no hydrogen 3.426 N/A VAL 57.A N LEU 53.A O no hydrogen 2.807 N/A VAL 58.A N LEU 54.A O no hydrogen 2.861 N/A ALA 59.A N ARG 55.A O no hydrogen 2.946 N/A LEU 60.A N SER 56.A O no hydrogen 2.665 N/A SER 61.A N VAL 57.A O no hydrogen 2.641 N/A SER 61.A OG GLN 24.A O no hydrogen 2.732 N/A ASP 64.A N SER 61.A O no hydrogen 2.741 N/A LEU 65.A N PRO 62.A O no hydrogen 2.963 N/A VAL 68.A N ASP 64.A O no hydrogen 2.820 N/A LEU 69.A N LEU 65.A O no hydrogen 2.697 N/A TYR 70.A N LEU 66.A O no hydrogen 2.876 N/A TYR 70.A OH ASP 241.A OD1 no hydrogen 2.872 N/A LEU 71.A N PRO 67.A O no hydrogen 2.817 N/A SER 72.A N VAL 68.A O no hydrogen 3.007 N/A SER 72.A OG VAL 68.A O no hydrogen 2.754 N/A LEU 73.A N LEU 69.A O no hydrogen 2.860 N/A ASN 74.A N LEU 71.A O no hydrogen 2.874 N/A HIS 75.A N TYR 70.A O no hydrogen 3.183 N/A GLN 81.A N PRO 78.A O no hydrogen 2.971 N/A GLN 81.A NE2 ASP 241.A OD2 no hydrogen 3.461 N/A GLY 82.A N PRO 79.A O no hydrogen 2.856 N/A LEU 92.A N GLY 88.A O no hydrogen 3.188 N/A LEU 93.A N ASP 89.A O no hydrogen 2.605 N/A LYS 94.A N GLY 90.A O no hydrogen 2.860 N/A ALA 95.A N VAL 91.A O no hydrogen 2.909 N/A VAL 96.A N LEU 92.A O no hydrogen 2.883 N/A ALA 97.A N LEU 93.A O no hydrogen 2.989 N/A GLN 98.A N LYS 94.A O no hydrogen 2.927 N/A ALA 99.A N ALA 95.A O no hydrogen 3.044 N/A THR 100.A N VAL 96.A O no hydrogen 2.913 N/A THR 100.A OG1 VAL 96.A O no hydrogen 2.935 N/A THR 100.A OG1 ALA 97.A O no hydrogen 3.091 N/A GLY 101.A N GLN 98.A O no hydrogen 3.048 N/A ARG 102.A N ALA 97.A O no hydrogen 2.859 N/A ARG 102.A NH1 GLU 110.A OE2 no hydrogen 3.082 N/A ARG 102.A NH2 GLU 110.A OE2 no hydrogen 2.783 N/A VAL 107.A N GLN 103.A O no hydrogen 3.123 N/A ARG 108.A N LEU 104.A O no hydrogen 2.759 N/A ALA 109.A N GLU 105.A O no hydrogen 2.672 N/A GLU 110.A N SER 106.A O no hydrogen 3.012 N/A ALA 111.A N VAL 107.A O no hydrogen 2.955 N/A ALA 112.A N ARG 108.A O no hydrogen 2.991 N/A GLU 113.A N ALA 109.A O no hydrogen 2.903 N/A LYS 114.A N GLU 110.A O no hydrogen 2.803 N/A GLY 115.A N ALA 111.A O no hydrogen 2.784 N/A LEU 119.A N ASP 116.A O no hydrogen 3.403 N/A ALA 130.A N VAL 26.A O no hydrogen 2.648 N/A SER 131.A OG ASP 64.A OD1 no hydrogen 3.251 N/A SER 131.A OG ASP 64.A OD2 no hydrogen 3.018 N/A VAL 133.A N THR 129.A O no hydrogen 2.928 N/A PHE 134.A N ALA 130.A O no hydrogen 3.440 N/A SER 135.A N SER 131.A O no hydrogen 3.292 N/A SER 135.A OG SER 131.A O no hydrogen 2.935 N/A SER 135.A OG GLY 132.A O no hydrogen 2.891 N/A LYS 136.A N GLY 132.A O no hydrogen 2.933 N/A PHE 137.A N VAL 133.A O no hydrogen 2.950 N/A ARG 138.A N PHE 134.A O no hydrogen 2.829 N/A ARG 138.A NH1 LEU 76.A O no hydrogen 2.773 N/A ASP 139.A N SER 135.A O no hydrogen 2.762 N/A ASP 139.A N LYS 136.A O no hydrogen 2.879 N/A ILE 140.A N LYS 136.A O no hydrogen 2.934 N/A ALA 141.A N PHE 137.A O no hydrogen 3.076 N/A ARG 142.A N ARG 138.A O no hydrogen 3.294 N/A ARG 142.A N ASP 139.A O no hydrogen 2.848 N/A ARG 142.A NH2 ASP 139.A OD1 no hydrogen 3.384 N/A LEU 143.A N ASP 139.A O no hydrogen 3.131 N/A LEU 143.A N ILE 140.A O no hydrogen 3.034 N/A SER 148.A N GLY 145.A O no hydrogen 3.241 N/A SER 148.A OG GLY 145.A O no hydrogen 2.241 N/A LYS 152.A N SER 148.A O no hydrogen 2.812 N/A LYS 152.A NZ LEU 85.A O no hydrogen 2.652 N/A LYS 152.A NZ ILE 140.A O no hydrogen 2.901 N/A LYS 152.A NZ LEU 143.A O no hydrogen 3.101 N/A ILE 153.A N THR 149.A O no hydrogen 2.783 N/A ASP 154.A N ALA 150.A O no hydrogen 2.851 N/A ILE 155.A N LYS 151.A O no hydrogen 3.325 N/A ILE 156.A N LYS 152.A O no hydrogen 3.243 N/A LYS 157.A N ILE 153.A O no hydrogen 2.971 N/A GLY 158.A N ASP 154.A O no hydrogen 3.062 N/A LEU 159.A N ILE 155.A O no hydrogen 2.850 N/A PHE 160.A N ILE 156.A O no hydrogen 2.761 N/A VAL 161.A N LYS 157.A O no hydrogen 2.887 N/A ALA 162.A N GLY 158.A O no hydrogen 2.995 N/A ALA 162.A N LEU 159.A O no hydrogen 3.259 N/A CYS 163.A N LEU 159.A O no hydrogen 3.170 N/A CYS 163.A N PHE 160.A O no hydrogen 2.894 N/A CYS 163.A SG LEU 159.A O no hydrogen 3.187 N/A ARG 164.A N GLU 167.A OE1 no hydrogen 2.990 N/A ARG 164.A NH1 PRO 125.A O no hydrogen 3.436 N/A SER 166.A OG GLU 36.A OE2 no hydrogen 3.248 N/A ARG 169.A N GLU 122.A OE2 no hydrogen 3.362 N/A ARG 169.A NH2 GLU 122.A OE1 no hydrogen 2.919 N/A ILE 171.A N GLU 167.A O no hydrogen 2.883 N/A ALA 172.A N ALA 168.A O no hydrogen 2.707 N/A ARG 173.A N ARG 169.A O no hydrogen 2.901 N/A ARG 173.A NE ASP 116.A OD1 no hydrogen 3.456 N/A ARG 173.A NH2 ASP 116.A OD1 no hydrogen 3.189 N/A SER 174.A N PHE 170.A O no hydrogen 2.984 N/A LEU 175.A N ILE 171.A O no hydrogen 3.248 N/A SER 176.A N ALA 172.A O no hydrogen 2.783 N/A SER 176.A OG ARG 173.A O no hydrogen 3.309 N/A GLY 177.A N SER 174.A O no hydrogen 2.912 N/A ARG 178.A N ARG 173.A O no hydrogen 2.877 N/A VAL 188.A N ALA 184.A O no hydrogen 2.885 N/A LEU 189.A N GLU 185.A O no hydrogen 2.780 N/A ALA 190.A N GLN 186.A O no hydrogen 2.686 N/A ALA 191.A N SER 187.A O no hydrogen 2.690 N/A LEU 192.A N VAL 188.A O no hydrogen 2.827 N/A SER 193.A N LEU 189.A O no hydrogen 2.925 N/A GLN 194.A N ALA 190.A O no hydrogen 3.023 N/A ALA 195.A N ALA 191.A O no hydrogen 2.964 N/A VAL 196.A N LEU 192.A O no hydrogen 2.897 N/A SER 197.A N SER 193.A O no hydrogen 2.819 N/A SER 197.A N GLN 194.A O no hydrogen 2.944 N/A SER 197.A OG SER 193.A O no hydrogen 3.160 N/A SER 197.A OG GLN 227.A OE1 no hydrogen 3.128 N/A LEU 198.A N GLN 194.A O no hydrogen 2.799 N/A LEU 198.A N ALA 195.A O no hydrogen 3.201 N/A THR 199.A N ALA 195.A O no hydrogen 2.916 N/A THR 199.A OG1 VAL 209.A O no hydrogen 2.790 N/A ALA 211.A N LEU 198.A O no hydrogen 2.919 N/A GLY 212.A N ASP 210.A OD2 no hydrogen 2.962 N/A LYS 213.A N ASP 210.A O no hydrogen 3.129 N/A LYS 215.A N GLY 212.A O no hydrogen 3.064 N/A ALA 219.A N THR 216.A OG1 no hydrogen 3.316 N/A ARG 220.A N THR 216.A O no hydrogen 2.783 N/A ARG 220.A NH2 ASP 210.A OD1 no hydrogen 3.043 N/A LYS 221.A N ALA 217.A O no hydrogen 2.806 N/A LYS 221.A NZ GLU 218.A OE2 no hydrogen 3.337 N/A THR 222.A N GLU 218.A O no hydrogen 3.015 N/A THR 222.A OG1 GLU 218.A O no hydrogen 3.526 N/A TRP 223.A N ALA 219.A O no hydrogen 3.024 N/A LEU 224.A N ARG 220.A O no hydrogen 2.862 N/A GLU 225.A N LYS 221.A O no hydrogen 2.882 N/A GLU 226.A N THR 222.A O no hydrogen 2.905 N/A GLN 227.A N TRP 223.A O no hydrogen 3.121 N/A GLN 227.A NE2 GLU 253.A OE1 no hydrogen 3.376 N/A GLY 228.A N LEU 224.A O no hydrogen 2.829 N/A LEU 230.A N GLN 227.A O no hydrogen 3.476 N/A LYS 231.A N GLY 228.A O no hydrogen 2.831 N/A LYS 231.A NZ GLN 186.A O no hydrogen 3.329 N/A LYS 231.A NZ GLN 186.A OE1 no hydrogen 3.116 N/A GLN 232.A NE2 GLU 236.A OE2 no hydrogen 3.050 N/A THR 233.A N ILE 229.A O no hydrogen 3.223 N/A THR 233.A N LEU 230.A O no hydrogen 2.949 N/A THR 233.A OG1 ILE 229.A O no hydrogen 2.621 N/A PHE 234.A N LEU 230.A O no hydrogen 2.973 N/A CYS 235.A N LYS 231.A O no hydrogen 3.331 N/A CYS 235.A SG LYS 231.A O no hydrogen 3.301 N/A GLU 236.A N GLN 232.A O no hydrogen 3.347 N/A VAL 237.A N THR 233.A O no hydrogen 2.779 N/A ARG 242.A N ASP 239.A O no hydrogen 2.853 N/A ARG 242.A N ASP 239.A OD1 no hydrogen 3.155 N/A ILE 243.A N ASP 239.A O no hydrogen 3.001 N/A ILE 244.A N LEU 240.A O no hydrogen 2.959 N/A LEU 247.A N ILE 243.A O no hydrogen 2.714 N/A LEU 248.A N ILE 244.A O no hydrogen 2.720 N/A GLU 249.A N PRO 245.A O no hydrogen 2.882 N/A HIS 250.A N VAL 246.A O no hydrogen 2.727 N/A HIS 250.A N LEU 247.A O no hydrogen 3.207 N/A GLY 251.A N LEU 247.A O no hydrogen 2.608 N/A LEU 255.A N LEU 252.A O no hydrogen 2.937 N/A HIS 258.A N LEU 255.A O no hydrogen 3.052 N/A HIS 258.A ND1 ARG 254.A O no hydrogen 3.091 N/A CYS 259.A N PRO 256.A O no hydrogen 3.014 N/A LYS 260.A NZ GLU 257.A O no hydrogen 3.398 N/A GLY 264.A N HIS 303.A ND1 no hydrogen 2.977 N/A ILE 265.A N SER 262.A O no hydrogen 2.960 N/A LEU 267.A N GLN 301.A OE1 no hydrogen 3.128 N/A LYS 268.A N CYS 235.A O no hydrogen 3.053 N/A LYS 268.A NZ GLU 185.A OE2 no hydrogen 2.887 N/A LYS 268.A NZ GLN 317.A OE1 no hydrogen 3.155 N/A LEU 270.A N SER 464.A O no hydrogen 2.733 N/A HIS 272.A N TRP 467.A O no hydrogen 2.570 N/A THR 274.A N LYS 469.A O no hydrogen 3.080 N/A ARG 275.A N GLU 279.A OE1 no hydrogen 2.724 N/A ARG 275.A NH1 GLU 279.A OE1 no hydrogen 3.346 N/A VAL 280.A N GLY 276.A O no hydrogen 3.267 N/A LEU 281.A N ILE 277.A O no hydrogen 2.900 N/A LYS 282.A N SER 278.A O no hydrogen 3.219 N/A ARG 283.A N GLU 279.A O no hydrogen 2.833 N/A ARG 283.A NE GLU 279.A OE2 no hydrogen 3.018 N/A ARG 283.A NH2 GLU 279.A OE2 no hydrogen 3.150 N/A PHE 284.A N VAL 280.A O no hydrogen 3.148 N/A GLU 285.A N LYS 282.A O no hydrogen 2.959 N/A ALA 287.A N PHE 284.A O no hydrogen 3.185 N/A THR 290.A N LYS 450.A O no hydrogen 2.740 N/A THR 290.A OG1 LEU 425.A O no hydrogen 3.492 N/A THR 290.A OG1 ASP 426.A OD1 no hydrogen 2.826 N/A CYS 291.A N LEU 425.A O no hydrogen 2.694 N/A TYR 293.A N THR 423.A O no hydrogen 3.136 N/A TYR 293.A OH ASP 443.A OD1 no hydrogen 3.164 N/A LYS 294.A N GLY 447.A O no hydrogen 2.681 N/A LYS 294.A NZ GLU 446.A OE2 no hydrogen 3.162 N/A GLN 298.A N ALA 348.A O no hydrogen 2.996 N/A GLN 298.A NE2 ASN 320.A OD1 no hydrogen 3.690 N/A ARG 299.A NE ASP 345.A OD2 no hydrogen 2.907 N/A ARG 299.A NH2 ASP 345.A OD1 no hydrogen 2.871 N/A ARG 299.A NH2 ASP 345.A OD2 no hydrogen 3.351 N/A ALA 300.A N THR 346.A O no hydrogen 2.601 N/A GLN 301.A N PHE 313.A O no hydrogen 2.875 N/A GLN 301.A NE2 LEU 267.A O no hydrogen 3.015 N/A ILE 302.A N LEU 344.A O no hydrogen 2.946 N/A HIS 303.A N LYS 311.A O no hydrogen 2.838 N/A HIS 303.A NE2 GLN 301.A OE1 no hydrogen 3.303 N/A ALA 304.A N PHE 342.A O no hydrogen 2.891 N/A LEU 305.A N GLU 309.A O no hydrogen 2.982 N/A GLY 308.A N LEU 305.A O no hydrogen 2.634 N/A GLU 309.A N GLU 309.A OE2 no hydrogen 2.391 N/A LYS 311.A N HIS 303.A O no hydrogen 2.962 N/A LYS 311.A NZ ASP 319.A OD2 no hydrogen 3.102 N/A LYS 311.A NZ THR 321.A OG1 no hydrogen 3.182 N/A ILE 312.A N THR 321.A OG1 no hydrogen 2.925 N/A PHE 313.A N GLN 301.A O no hydrogen 2.787 N/A SER 314.A N GLU 318.A O no hydrogen 3.081 N/A ASN 316.A N SER 314.A OG no hydrogen 2.911 N/A GLN 317.A N SER 314.A O no hydrogen 2.884 N/A GLU 318.A N SER 314.A OG no hydrogen 3.275 N/A ASN 320.A N ILE 312.A O no hydrogen 2.986 N/A THR 321.A N ILE 312.A O no hydrogen 3.241 N/A THR 321.A OG1 ASP 319.A OD1 no hydrogen 2.845 N/A TYR 324.A OH GLN 298.A OE1 no hydrogen 2.508 N/A ILE 328.A N TYR 324.A O no hydrogen 3.387 N/A SER 329.A OG ASP 326.A O no hydrogen 2.970 N/A ARG 330.A N ASP 326.A O no hydrogen 3.373 N/A ARG 330.A N ILE 327.A O no hydrogen 2.773 N/A ARG 330.A NH2 VAL 381.A O no hydrogen 3.185 N/A ARG 330.A NH2 GLU 418.A O no hydrogen 2.979 N/A ILE 331.A N ILE 328.A O no hydrogen 2.968 N/A LYS 333.A NZ GLU 418.A OE1 no hydrogen 3.313 N/A LYS 333.A NZ GLU 418.A OE2 no hydrogen 3.177 N/A ILE 334.A N ILE 331.A O no hydrogen 2.785 N/A LEU 336.A N ASN 411.A O no hydrogen 3.141 N/A VAL 339.A N LEU 336.A O no hydrogen 3.006 N/A THR 340.A N ASN 392.A OD1 no hydrogen 2.680 N/A THR 340.A OG1 GLU 306.A OE2 no hydrogen 2.763 N/A THR 340.A OG1 SER 341.A OG no hydrogen 3.362 N/A THR 340.A OG1 ASN 392.A OD1 no hydrogen 2.988 N/A SER 341.A N ASN 392.A OD1 no hydrogen 3.327 N/A SER 341.A OG GLU 306.A OE2 no hydrogen 2.847 N/A SER 341.A OG THR 340.A OG1 no hydrogen 3.362 N/A PHE 342.A N ALA 304.A O no hydrogen 3.102 N/A ILE 343.A N TYR 390.A O no hydrogen 2.732 N/A LEU 344.A N ILE 302.A O no hydrogen 2.826 N/A ASP 345.A N ASP 387.A O no hydrogen 2.674 N/A THR 346.A OG1 TYR 384.A O no hydrogen 3.323 N/A GLU 347.A N TYR 384.A O no hydrogen 2.798 N/A ALA 348.A N GLN 298.A O no hydrogen 2.731 N/A VAL 349.A N CYS 382.A O no hydrogen 2.791 N/A TRP 351.A N GLN 380.A O no hydrogen 2.848 N/A ASP 352.A N GLN 357.A O no hydrogen 2.917 N/A GLU 354.A N ASP 352.A OD1 no hydrogen 3.254 N/A LYS 355.A NZ ASP 352.A OD2 no hydrogen 3.052 N/A LYS 356.A NZ GLU 416.A OE1 no hydrogen 3.563 N/A GLN 359.A N ALA 350.A O no hydrogen 2.831 N/A LEU 364.A N PRO 360.A O no hydrogen 3.210 N/A THR 365.A N PHE 361.A O no hydrogen 3.094 N/A THR 365.A N GLN 362.A O no hydrogen 2.875 N/A THR 365.A OG1 GLN 362.A O no hydrogen 2.902 N/A THR 366.A N VAL 363.A O no hydrogen 3.197 N/A ARG 367.A NH1 ASP 326.A OD2 no hydrogen 3.117 N/A ARG 367.A NH2 LYS 323.A O no hydrogen 2.868 N/A ARG 367.A NH2 ASP 326.A OD1 no hydrogen 2.987 N/A SER 375.A OG GLU 376.A OE2 no hydrogen 3.416 N/A GLU 376.A N ASP 373.A O no hydrogen 2.641 N/A GLN 378.A NE2 GLU 376.A O no hydrogen 3.252 N/A CYS 382.A N VAL 349.A O no hydrogen 2.601 N/A CYS 382.A SG LEU 383.A O no hydrogen 3.722 N/A LEU 383.A N GLU 418.A O no hydrogen 3.040 N/A TYR 384.A N GLU 347.A O no hydrogen 2.638 N/A ALA 385.A N VAL 420.A O no hydrogen 3.110 N/A PHE 386.A N ASP 345.A O no hydrogen 2.987 N/A LEU 388.A N ASP 387.A OD1 no hydrogen 2.635 N/A ILE 389.A N ILE 343.A O no hydrogen 2.776 N/A LEU 391.A N GLU 394.A O no hydrogen 2.731 N/A ASN 392.A N SER 341.A O no hydrogen 2.820 N/A ASN 392.A ND2 SER 338.A O no hydrogen 3.286 N/A GLY 393.A N SER 341.A OG no hydrogen 3.156 N/A LEU 396.A N ILE 389.A O no hydrogen 2.635 N/A VAL 397.A N SER 395.A OG no hydrogen 3.174 N/A GLU 399.A N LEU 396.A O no hydrogen 2.878 N/A SER 402.A N LEU 452.A O no hydrogen 2.980 N/A SER 402.A OG LEU 452.A O no hydrogen 2.610 N/A ARG 403.A NE GLN 406.A OE1 no hydrogen 3.260 N/A ARG 404.A N PRO 400.A O no hydrogen 2.926 N/A ARG 404.A NE GLU 399.A O no hydrogen 3.426 N/A ARG 404.A NH1 ASP 387.A OD1 no hydrogen 2.858 N/A ARG 404.A NH2 GLU 399.A O no hydrogen 2.996 N/A ARG 405.A N LEU 401.A O no hydrogen 2.643 N/A ARG 405.A NH1 THR 290.A OG1 no hydrogen 2.976 N/A ARG 405.A NH2 ASP 426.A OD1 no hydrogen 3.194 N/A GLN 406.A N SER 402.A O no hydrogen 2.926 N/A LEU 407.A N ARG 403.A O no hydrogen 2.985 N/A LEU 408.A N ARG 404.A O no hydrogen 2.943 N/A ARG 409.A N ARG 405.A O no hydrogen 2.906 N/A ARG 409.A NH1 SER 424.A OG no hydrogen 3.260 N/A GLU 410.A N GLN 406.A O no hydrogen 2.818 N/A ASN 411.A N LEU 408.A O no hydrogen 3.345 N/A ASN 411.A ND2 LEU 407.A O no hydrogen 3.150 N/A PHE 412.A N LEU 408.A O no hydrogen 3.026 N/A VAL 413.A N ILE 334.A O no hydrogen 3.016 N/A THR 415.A N PHE 419.A O no hydrogen 2.649 N/A THR 415.A OG1 GLU 418.A OE2 no hydrogen 3.045 N/A GLU 418.A N THR 415.A O no hydrogen 2.827 N/A PHE 419.A N THR 415.A O no hydrogen 3.018 N/A VAL 420.A N LEU 383.A O no hydrogen 3.178 N/A PHE 421.A N GLU 414.A OE1 no hydrogen 2.858 N/A ALA 422.A N ALA 385.A O no hydrogen 2.913 N/A THR 423.A N TYR 295.A OH no hydrogen 3.307 N/A SER 424.A OG ALA 422.A O no hydrogen 3.222 N/A LEU 425.A N CYS 291.A O no hydrogen 2.565 N/A GLN 432.A N ASP 429.A OD2 no hydrogen 3.119 N/A ILE 433.A N ASP 429.A O no hydrogen 2.793 N/A ALA 434.A N ILE 430.A O no hydrogen 3.007 N/A GLU 435.A N GLU 431.A O no hydrogen 2.818 N/A PHE 436.A N GLN 432.A O no hydrogen 2.994 N/A LEU 437.A N ILE 433.A O no hydrogen 2.789 N/A GLU 438.A N ALA 434.A O no hydrogen 3.014 N/A GLN 439.A N GLU 435.A O no hydrogen 2.912 N/A GLN 439.A NE2 GLN 439.A O no hydrogen 3.002 N/A SER 440.A N PHE 436.A O no hydrogen 2.631 N/A SER 440.A OG LEU 437.A O no hydrogen 2.787 N/A VAL 441.A N LEU 437.A O no hydrogen 3.176 N/A LYS 442.A N GLU 438.A O no hydrogen 2.837 N/A LYS 442.A NZ GLU 438.A O no hydrogen 2.951 N/A ASP 443.A N SER 440.A O no hydrogen 3.324 N/A SER 444.A N VAL 441.A O no hydrogen 3.245 N/A CYS 445.A SG ASP 443.A O no hydrogen 3.906 N/A CYS 445.A SG SER 444.A O no hydrogen 3.045 N/A LEU 448.A N LEU 470.A O no hydrogen 3.157 N/A LYS 450.A N THR 290.A O no hydrogen 3.218 N/A LYS 450.A NZ GLU 292.A OE1 no hydrogen 3.089 N/A THR 451.A OG1 VAL 454.A O no hydrogen 2.720 N/A THR 451.A OG1 ASP 455.A O no hydrogen 3.408 N/A LEU 452.A N ALA 288.A O no hydrogen 2.931 N/A THR 457.A OG1 GLU 459.A OE2 no hydrogen 2.991 N/A TYR 458.A N VAL 397.A O no hydrogen 2.722 N/A TYR 458.A OH ASP 345.A OD1 no hydrogen 2.514 N/A ALA 461.A N GLN 232.A OE1 no hydrogen 3.182 N/A LYS 462.A N GLU 459.A O no hydrogen 3.033 N/A LYS 462.A NZ GLU 459.A OE2 no hydrogen 3.539 N/A ASN 466.A N LEU 270.A O no hydrogen 3.279 N/A ASN 466.A N SER 464.A O no hydrogen 2.807 N/A ASN 466.A ND2 ASP 455.A O no hydrogen 2.972 N/A TRP 467.A N LEU 270.A O no hydrogen 3.326 N/A LEU 468.A N VAL 449.A O no hydrogen 2.913 N/A LYS 469.A N HIS 272.A O no hydrogen 2.701 N/A LEU 470.A N LEU 448.A O no hydrogen 2.713 N/A LYS 472.A NZ ALA 572.A O no hydrogen 3.450 N/A LYS 472.A NZ ASP 573.A OD2 no hydrogen 3.136 N/A ASP 476.A N LYS 472.A O no hydrogen 2.512 N/A GLY 477.A N ASP 473.A O no hydrogen 3.115 N/A LEU 482.A N VAL 569.A O no hydrogen 2.816 N/A ASP 483.A N THR 613.A OG1 no hydrogen 3.079 N/A LEU 484.A N TRP 567.A O no hydrogen 2.692 N/A VAL 485.A N ALA 506.A O no hydrogen 2.886 N/A VAL 486.A N ALA 565.A O no hydrogen 2.890 N/A ILE 487.A N LEU 504.A O no hydrogen 2.769 N/A TYR 490.A N GLY 502.A O no hydrogen 2.638 N/A TYR 490.A OH VAL 555.A O no hydrogen 2.761 N/A LEU 491.A N ASP 558.A OD2 no hydrogen 2.698 N/A GLY 492.A N ARG 499.A O no hydrogen 2.944 N/A ARG 493.A NH2 ASP 89.A OD1 no hydrogen 3.069 N/A GLY 494.A N GLY 115.A O no hydrogen 3.495 N/A ARG 496.A NH1 GLY 522.A O no hydrogen 3.226 N/A ALA 497.A N GLY 494.A O no hydrogen 3.219 N/A ARG 499.A N ARG 496.A O no hydrogen 3.223 N/A ARG 499.A NH1 GLU 531.A OE1 no hydrogen 3.461 N/A GLY 501.A N TYR 490.A O no hydrogen 2.783 N/A GLY 502.A N TYR 490.A O no hydrogen 3.335 N/A PHE 503.A N LEU 521.A O no hydrogen 2.924 N/A LEU 504.A N GLY 488.A O no hydrogen 2.807 N/A LEU 505.A N CYS 519.A O no hydrogen 2.919 N/A ALA 506.A N VAL 485.A O no hydrogen 2.879 N/A SER 507.A N GLN 516.A O no hydrogen 2.783 N/A SER 507.A OG GLN 516.A O no hydrogen 3.560 N/A SER 507.A OG SER 615.A OG no hydrogen 3.085 N/A TYR 508.A N THR 613.A O no hydrogen 2.827 N/A ASP 509.A N GLU 514.A O no hydrogen 3.036 N/A GLU 510.A N GLU 510.A OE2 no hydrogen 2.619 N/A SER 512.A N ASP 509.A OD2 no hydrogen 3.130 N/A SER 512.A OG ASP 509.A O no hydrogen 3.552 N/A SER 512.A OG ASP 509.A OD2 no hydrogen 2.621 N/A GLU 514.A N ASP 509.A O no hydrogen 2.947 N/A GLN 516.A N SER 507.A O no hydrogen 2.944 N/A ALA 517.A N ARG 550.A O no hydrogen 3.014 N/A ILE 518.A N LEU 505.A O no hydrogen 2.471 N/A CYS 519.A N LEU 505.A O no hydrogen 3.328 N/A CYS 519.A SG LYS 520.A O no hydrogen 3.529 N/A LEU 521.A N PHE 503.A O no hydrogen 2.812 N/A SER 526.A N GLU 529.A OE2 no hydrogen 2.785 N/A GLU 529.A N SER 526.A OG no hydrogen 2.720 N/A LEU 530.A N SER 526.A O no hydrogen 2.806 N/A GLU 531.A N ASP 527.A O no hydrogen 2.879 N/A GLU 532.A N GLU 528.A O no hydrogen 2.886 N/A HIS 533.A N GLU 529.A O no hydrogen 3.008 N/A HIS 534.A N LEU 530.A O no hydrogen 2.758 N/A GLN 535.A N GLU 532.A O no hydrogen 3.188 N/A SER 536.A N GLU 532.A O no hydrogen 3.451 N/A SER 536.A OG GLU 532.A O no hydrogen 3.354 N/A SER 536.A OG HIS 533.A O no hydrogen 3.331 N/A LEU 537.A N HIS 533.A O no hydrogen 3.106 N/A LEU 540.A N LEU 537.A O no hydrogen 2.856 N/A VAL 541.A N LYS 538.A O no hydrogen 3.126 N/A LEU 542.A N TRP 560.A O no hydrogen 2.752 N/A SER 544.A OG PRO 545.A O no hydrogen 3.125 N/A ARG 546.A NH1 TYR 548.A OH no hydrogen 3.199 N/A ARG 546.A NH2 ASP 562.A OD2 no hydrogen 3.108 N/A VAL 549.A N ARG 546.A O no hydrogen 3.135 N/A ARG 550.A N LEU 515.A O no hydrogen 3.228 N/A ARG 550.A NE ASP 552.A OD2 no hydrogen 2.869 N/A ARG 550.A NH2 ASP 552.A OD2 no hydrogen 3.021 N/A HIS 559.A N ALA 489.A O no hydrogen 3.201 N/A LEU 561.A N ILE 487.A O no hydrogen 2.955 N/A ASP 562.A N LEU 540.A O no hydrogen 2.560 N/A TRP 567.A N LEU 484.A O no hydrogen 2.754 N/A GLU 568.A N ARG 602.A O no hydrogen 2.800 N/A VAL 569.A N LEU 482.A O no hydrogen 2.646 N/A LYS 570.A N ARG 599.A O no hydrogen 3.015 N/A CYS 571.A N ASP 480.A O no hydrogen 3.157 N/A CYS 571.A SG ASP 573.A O no hydrogen 2.973 N/A ALA 572.A N ARG 596.A O no hydrogen 2.827 N/A SER 575.A N SER 594.A O no hydrogen 3.141 N/A ILE 579.A N SER 577.A OG no hydrogen 2.893 N/A ALA 583.A N GLN 516.A OE1 no hydrogen 2.774 N/A ALA 583.A N SER 615.A OG no hydrogen 3.269 N/A ARG 584.A N PRO 581.A O no hydrogen 2.767 N/A LEU 586.A N ALA 583.A O no hydrogen 3.254 N/A ASP 590.A N ASP 588.A OD2 no hydrogen 3.334 N/A LYS 591.A N ASP 588.A OD2 no hydrogen 3.023 N/A GLY 592.A N SER 577.A O no hydrogen 3.121 N/A ILE 593.A N ALA 582.A O no hydrogen 2.818 N/A SER 594.A N SER 575.A O no hydrogen 2.814 N/A SER 594.A OG ILE 518.A O no hydrogen 2.564 N/A ARG 596.A N ASP 573.A O no hydrogen 3.229 N/A ARG 596.A NH1 ASP 296.A OD2 no hydrogen 2.801 N/A ARG 596.A NH1 ASP 573.A OD1 no hydrogen 3.565 N/A ARG 599.A N LYS 570.A O no hydrogen 2.932 N/A ARG 599.A NE PHE 597.A O no hydrogen 2.904 N/A ARG 599.A NH2 ASP 473.A OD2 no hydrogen 3.052 N/A PHE 600.A N THR 523.A O no hydrogen 2.756 N/A ILE 601.A N GLU 568.A O no hydrogen 3.039 N/A ARG 602.A N GLU 568.A O no hydrogen 3.467 N/A ARG 604.A N VAL 566.A O no hydrogen 3.093 N/A LYS 607.A N ARG 604.A O no hydrogen 3.281 N/A LYS 607.A NZ ASP 483.A OD2 no hydrogen 2.927 N/A ALA 612.A N PRO 609.A O no hydrogen 3.049 N/A THR 613.A N ASP 483.A O no hydrogen 2.766 N/A THR 613.A OG1 ASP 483.A O no hydrogen 3.399 N/A THR 614.A N GLN 617.A OE1 no hydrogen 2.525 N/A THR 614.A OG1 TYR 508.A O no hydrogen 3.127 N/A THR 614.A OG1 GLU 510.A OE1 no hydrogen 3.419 N/A THR 614.A OG1 GLU 510.A OE2 no hydrogen 3.006 N/A SER 615.A N TYR 508.A O no hydrogen 3.024 N/A SER 615.A OG SER 507.A OG no hydrogen 3.085 N/A SER 615.A OG GLN 516.A OE1 no hydrogen 2.840 N/A VAL 618.A N THR 614.A O no hydrogen 2.721 N/A ALA 619.A N SER 615.A O no hydrogen 2.637 N/A CYS 620.A N ALA 616.A O no hydrogen 2.470 N/A LEU 621.A N GLN 617.A O no hydrogen 2.918 N/A TYR 622.A N VAL 618.A O no hydrogen 2.796 N/A ARG 623.A N ALA 619.A O no hydrogen 2.960 N/A LYS 624.A N CYS 620.A O no hydrogen 2.786 N/A GLN 625.A N LEU 621.A O no hydrogen 3.114 N/A GLN 625.A N TYR 622.A O no hydrogen 2.987 N/A GLN 625.A NE2 LEU 574.A O no hydrogen 2.920 N/A