Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8hxk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 GLU 69.A OE1 no hydrogen 2.468 N/A ARG 6.A NH2 SER 1.A O no hydrogen 3.325 N/A ALA 7.A N THR 3.A O no hydrogen 2.875 N/A LYS 8.A N GLU 4.A O no hydrogen 2.881 N/A ILE 9.A N ASP 5.A O no hydrogen 2.914 N/A PHE 10.A N ARG 6.A O no hydrogen 2.905 N/A LEU 11.A N ALA 7.A O no hydrogen 2.877 N/A ASP 12.A N LYS 8.A O no hydrogen 2.902 N/A ASN 13.A N ILE 9.A O no hydrogen 2.931 N/A PHE 14.A N PHE 10.A O no hydrogen 2.805 N/A ASN 15.A N LEU 11.A O no hydrogen 2.820 N/A ASN 15.A ND2 LEU 11.A O no hydrogen 2.612 N/A HIS 16.A N ASP 12.A O no hydrogen 3.013 N/A HIS 16.A ND1 ASP 12.A O no hydrogen 2.985 N/A GLU 17.A N ASN 13.A O no hydrogen 2.986 N/A ALA 18.A N PHE 14.A O no hydrogen 2.805 N/A GLU 19.A N ASN 15.A O no hydrogen 2.894 N/A ASP 20.A N HIS 16.A O no hydrogen 2.936 N/A LEU 21.A N GLU 17.A O no hydrogen 2.963 N/A SER 22.A N ALA 18.A O no hydrogen 2.829 N/A SER 22.A OG ALA 18.A O no hydrogen 2.366 N/A TYR 23.A N GLU 19.A O no hydrogen 2.955 N/A GLN 24.A N GLN 24.A OE1 no hydrogen 2.881 N/A SER 25.A N LEU 21.A O no hydrogen 2.976 N/A SER 25.A OG LEU 21.A O no hydrogen 2.892 N/A SER 26.A N SER 22.A O no hydrogen 2.864 N/A LEU 27.A N TYR 23.A O no hydrogen 2.826 N/A ALA 28.A N GLN 24.A O no hydrogen 2.848 N/A SER 29.A N SER 25.A O no hydrogen 2.928 N/A SER 29.A OG SER 26.A O no hydrogen 2.545 N/A TRP 30.A N SER 26.A O no hydrogen 2.838 N/A GLU 31.A N LEU 27.A O no hydrogen 2.846 N/A TYR 32.A N ALA 28.A O no hydrogen 2.911 N/A ASN 33.A N SER 29.A O no hydrogen 2.851 N/A THR 34.A OG1 TRP 30.A O no hydrogen 2.380 N/A THR 34.A OG1 GLU 31.A O no hydrogen 3.307 N/A ASN 35.A N GLU 31.A O no hydrogen 2.920 N/A SER 37.A N ASN 40.A OD1 no hydrogen 3.060 N/A ASP 38.A N SER 37.A OG no hydrogen 2.684 N/A LYS 43.A N GLU 39.A O no hydrogen 2.996 N/A LYS 43.A NZ GLU 46.A OE2 no hydrogen 3.028 N/A MET 44.A N ASN 40.A O no hydrogen 2.843 N/A ASP 45.A N VAL 41.A O no hydrogen 2.900 N/A GLU 46.A N GLN 42.A O no hydrogen 2.932 N/A ALA 47.A N LYS 43.A O no hydrogen 2.917 N/A ALA 49.A N ASP 45.A O no hydrogen 2.933 N/A LYS 50.A N GLU 46.A O no hydrogen 2.914 N/A SER 52.A N GLY 48.A O no hydrogen 2.881 N/A SER 52.A OG GLY 48.A O no hydrogen 3.430 N/A SER 52.A OG ALA 49.A O no hydrogen 2.762 N/A ALA 53.A N ALA 49.A O no hydrogen 2.853 N/A PHE 54.A N LYS 50.A O no hydrogen 2.933 N/A TYR 55.A N TRP 51.A O no hydrogen 2.891 N/A TYR 55.A OH SER 85.A OG no hydrogen 3.110 N/A GLU 56.A N SER 52.A O no hydrogen 2.859 N/A GLU 57.A N ALA 53.A O no hydrogen 2.906 N/A GLN 58.A N PHE 54.A O no hydrogen 2.915 N/A GLN 58.A NE2 PHE 54.A O no hydrogen 2.719 N/A SER 59.A N TYR 55.A O no hydrogen 2.924 N/A SER 59.A OG TYR 55.A O no hydrogen 3.525 N/A SER 59.A OG GLU 56.A O no hydrogen 2.932 N/A SER 59.A OG GLU 56.A OE1 no hydrogen 3.458 N/A LYS 60.A N GLU 56.A O no hydrogen 2.839 N/A LEU 61.A N GLU 57.A O no hydrogen 3.089 N/A ALA 62.A N SER 59.A O no hydrogen 3.097 N/A LYS 63.A N LYS 60.A O no hydrogen 3.314 N/A LYS 63.A NZ SER 59.A O no hydrogen 3.440 N/A TYR 65.A N ALA 62.A O no hydrogen 2.937 N/A ILE 70.A N LEU 67.A O no hydrogen 3.068 N/A GLN 71.A NE2 GLU 69.A O no hydrogen 2.403 N/A LYS 76.A N THR 72.A O no hydrogen 2.645 N/A LEU 77.A N VAL 73.A O no hydrogen 2.918 N/A GLN 78.A N PRO 74.A O no hydrogen 2.870 N/A GLN 78.A NE2 PRO 74.A O no hydrogen 3.217 N/A LEU 79.A N VAL 75.A O no hydrogen 2.960 N/A GLN 80.A N LYS 76.A O no hydrogen 2.952 N/A ILE 81.A N LEU 77.A O no hydrogen 2.927 N/A LEU 82.A N GLN 78.A O no hydrogen 2.894 N/A GLN 83.A N LEU 79.A O no hydrogen 2.871 N/A GLN 83.A NE2 TYR 65.A O no hydrogen 3.095 N/A SER 85.A N ILE 81.A O no hydrogen 3.271 N/A SER 85.A OG TYR 55.A OH no hydrogen 3.110 N/A SER 85.A OG ILE 81.A O no hydrogen 2.539 N/A SER 85.A OG LEU 82.A O no hydrogen 3.226 N/A LYS 94.A N SER 91.A OG no hydrogen 3.095 N/A SER 95.A N SER 91.A O no hydrogen 2.732 N/A SER 95.A OG SER 91.A O no hydrogen 2.680 N/A SER 95.A OG GLU 92.A O no hydrogen 3.035 N/A LYS 96.A N GLU 92.A O no hydrogen 2.925 N/A ARG 97.A N ASP 93.A O no hydrogen 2.871 N/A ARG 97.A NE ARG 97.A O no hydrogen 2.848 N/A LEU 98.A N LYS 94.A O no hydrogen 2.889 N/A ASN 99.A N SER 95.A O no hydrogen 2.929 N/A ASN 99.A ND2 SER 95.A O no hydrogen 3.083 N/A SER 100.A N LYS 96.A O no hydrogen 2.922 N/A SER 100.A OG LYS 96.A O no hydrogen 3.319 N/A SER 100.A OG ARG 97.A O no hydrogen 2.477 N/A ILE 101.A N ARG 97.A O no hydrogen 2.859 N/A LEU 102.A N LEU 98.A O no hydrogen 2.964 N/A ASN 103.A N ASN 99.A O no hydrogen 2.950 N/A ALA 104.A N SER 100.A O no hydrogen 2.855 N/A MET 105.A N ILE 101.A O no hydrogen 2.876 N/A SER 106.A N LEU 102.A O no hydrogen 2.984 N/A THR 107.A N ASN 103.A O no hydrogen 2.919 N/A THR 107.A OG1 ASN 103.A O no hydrogen 2.691 N/A THR 107.A OG1 ALA 104.A O no hydrogen 2.951 N/A ILE 108.A N ALA 104.A O no hydrogen 2.927 N/A TYR 109.A N MET 105.A O no hydrogen 2.931 N/A SER 110.A N SER 106.A O no hydrogen 2.940 N/A SER 110.A OG SER 106.A O no hydrogen 2.331 N/A SER 110.A OG THR 107.A O no hydrogen 2.990 N/A CYS 115.A SG LYS 113.A O no hydrogen 3.367 N/A ASN 119.A N ASN 118.A OD1 no hydrogen 2.679 N/A CYS 123.A SG PRO 120.A O no hydrogen 3.268 N/A CYS 123.A SG GLN 121.A O no hydrogen 4.022 N/A LEU 130.A N LEU 126.A O no hydrogen 2.937 N/A ILE 133.A N LEU 130.A O no hydrogen 3.067 N/A GLY 135.A N ASN 132.A O no hydrogen 3.069 N/A SER 137.A OG ILE 133.A O no hydrogen 2.324 N/A LYS 138.A NZ TYR 234.A OH no hydrogen 3.414 N/A TYR 140.A OH HIS 237.A ND1 no hydrogen 2.635 N/A GLU 142.A N GLU 142.A OE1 no hydrogen 2.992 N/A ARG 143.A NH2 LEU 249.A O no hydrogen 3.065 N/A LEU 144.A N TYR 140.A O no hydrogen 2.720 N/A TRP 145.A N ASN 141.A O no hydrogen 2.906 N/A ALA 146.A N GLU 142.A O no hydrogen 2.861 N/A TRP 147.A N ARG 143.A O no hydrogen 2.893 N/A GLU 148.A N LEU 144.A O no hydrogen 2.927 N/A GLY 149.A N TRP 145.A O no hydrogen 2.854 N/A TRP 150.A N ALA 146.A O no hydrogen 2.891 N/A ARG 151.A N TRP 147.A O no hydrogen 2.944 N/A ARG 151.A NH2 SER 484.A OG no hydrogen 2.360 N/A ALA 152.A N GLU 148.A O no hydrogen 2.914 N/A GLU 153.A N GLY 149.A O no hydrogen 2.837 N/A VAL 154.A N TRP 150.A O no hydrogen 2.968 N/A GLY 155.A N ARG 151.A O no hydrogen 2.864 N/A LYS 156.A N ALA 152.A O no hydrogen 2.960 N/A GLN 157.A NE2 GLU 153.A O no hydrogen 2.422 N/A LEU 158.A N GLY 155.A O no hydrogen 3.123 N/A ARG 159.A N GLY 155.A O no hydrogen 2.970 N/A ARG 159.A NE GLU 477.A O no hydrogen 2.956 N/A TYR 162.A N LEU 158.A O no hydrogen 3.122 N/A GLU 163.A N ARG 159.A O no hydrogen 2.957 N/A GLU 164.A N PRO 160.A O no hydrogen 2.899 N/A TYR 165.A N LEU 161.A O no hydrogen 2.876 N/A VAL 166.A N TYR 162.A O no hydrogen 2.898 N/A LEU 168.A N GLU 164.A O no hydrogen 3.065 N/A LYS 169.A N TYR 165.A O no hydrogen 2.931 N/A ASN 170.A N VAL 166.A O no hydrogen 2.892 N/A GLU 171.A N ALA 167.A O no hydrogen 2.923 N/A MET 172.A N LEU 168.A O no hydrogen 2.896 N/A ALA 173.A N LYS 169.A O no hydrogen 2.928 N/A ARG 174.A N ASN 170.A O no hydrogen 2.897 N/A ARG 174.A NE GLU 171.A OE1 no hydrogen 3.245 N/A ARG 174.A NH2 GLU 171.A OE1 no hydrogen 3.506 N/A GLY 175.A N GLU 171.A O no hydrogen 3.431 N/A TYR 176.A N ALA 173.A O no hydrogen 3.146 N/A TYR 178.A N ALA 173.A O no hydrogen 3.315 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.765 N/A TYR 181.A OH ASP 491.A OD2 no hydrogen 2.325 N/A ASP 183.A N ASP 180.A O no hydrogen 3.009 N/A ASP 183.A N ASP 180.A OD1 no hydrogen 3.082 N/A TYR 184.A N ASP 180.A O no hydrogen 3.205 N/A TRP 185.A N TYR 181.A O no hydrogen 2.944 N/A ARG 186.A N GLY 182.A O no hydrogen 2.879 N/A ARG 186.A N ASP 183.A O no hydrogen 3.143 N/A ARG 186.A NH1 ASP 183.A OD1 no hydrogen 2.853 N/A ARG 186.A NH2 ASP 180.A OD1 no hydrogen 3.458 N/A ARG 187.A NH2 ILE 81.A O no hydrogen 3.405 N/A TYR 189.A N ARG 186.A O no hydrogen 3.247 N/A TYR 189.A OH THR 499.A OG1 no hydrogen 2.539 N/A THR 191.A N GLY 198.A O no hydrogen 3.231 N/A THR 191.A OG1 GLU 192.A O no hydrogen 3.461 N/A THR 191.A OG1 GLY 198.A O no hydrogen 2.553 N/A SER 195.A OG GLU 192.A OE2 no hydrogen 2.569 N/A SER 197.A OG GLY 196.A O no hydrogen 2.650 N/A GLY 198.A N GLU 192.A O no hydrogen 2.906 N/A TYR 199.A N SER 197.A O no hydrogen 2.906 N/A TYR 199.A OH ASP 207.A OD2 no hydrogen 3.000 N/A GLN 203.A NE2 SER 197.A O no hydrogen 3.629 N/A LEU 204.A N SER 200.A O no hydrogen 3.289 N/A MET 205.A N ARG 201.A O no hydrogen 2.923 N/A LYS 206.A N ASP 202.A O no hydrogen 3.002 N/A LYS 206.A NZ ASP 202.A O no hydrogen 2.949 N/A ASP 207.A N GLN 203.A O no hydrogen 2.846 N/A VAL 208.A N LEU 204.A O no hydrogen 2.867 N/A ASP 209.A N MET 205.A O no hydrogen 2.929 N/A ARG 210.A N LYS 206.A O no hydrogen 2.928 N/A ILE 211.A N ASP 207.A O no hydrogen 2.872 N/A PHE 212.A N VAL 208.A O no hydrogen 2.947 N/A THR 213.A N ASP 209.A O no hydrogen 2.934 N/A THR 213.A OG1 ARG 210.A O no hydrogen 2.871 N/A THR 213.A OG1 GLU 214.A OE1 no hydrogen 2.405 N/A LYS 216.A N PHE 212.A O no hydrogen 3.242 N/A LYS 216.A NZ ASP 465.A O no hydrogen 3.385 N/A TYR 219.A N ILE 215.A O no hydrogen 3.021 N/A TYR 219.A OH VAL 467.A O no hydrogen 2.645 N/A GLU 220.A N LYS 216.A O no hydrogen 2.851 N/A HIS 221.A N PRO 217.A O no hydrogen 2.934 N/A HIS 221.A ND1 PRO 217.A O no hydrogen 2.319 N/A LEU 222.A N LEU 218.A O no hydrogen 2.967 N/A HIS 223.A N TYR 219.A O no hydrogen 2.778 N/A ALA 224.A N GLU 220.A O no hydrogen 2.921 N/A TYR 225.A N HIS 221.A O no hydrogen 2.945 N/A TYR 225.A OH THR 264.A O no hydrogen 3.383 N/A VAL 226.A N LEU 222.A O no hydrogen 2.893 N/A ARG 227.A N HIS 223.A O no hydrogen 2.863 N/A ARG 227.A NH1 GLY 242.A O no hydrogen 2.371 N/A ARG 227.A NH1 GLY 587.A O no hydrogen 2.530 N/A ARG 227.A NH2 TYR 585.A O no hydrogen 2.839 N/A THR 228.A N ALA 224.A O no hydrogen 2.930 N/A THR 228.A OG1 ALA 224.A O no hydrogen 2.980 N/A THR 228.A OG1 TYR 225.A O no hydrogen 2.522 N/A LYS 229.A N TYR 225.A O no hydrogen 2.976 N/A LYS 229.A NZ TYR 225.A OH no hydrogen 2.452 N/A LYS 229.A NZ THR 264.A O no hydrogen 2.624 N/A LEU 230.A N VAL 226.A O no hydrogen 2.890 N/A LEU 230.A N ARG 227.A O no hydrogen 3.163 N/A THR 233.A OG1 LYS 229.A O no hydrogen 3.437 N/A TYR 234.A N LEU 230.A O no hydrogen 2.960 N/A THR 241.A N SER 239.A OG no hydrogen 3.224 N/A CYS 243.A SG ASN 589.A O no hydrogen 3.266 N/A LEU 248.A N PRO 245.A O no hydrogen 3.455 N/A PHE 256.A N ASP 251.A OD1 no hydrogen 2.796 N/A PHE 256.A N ASP 251.A OD2 no hydrogen 2.941 N/A ASN 259.A ND2 ASN 259.A O no hydrogen 2.454 N/A TYR 261.A N THR 258.A O no hydrogen 3.116 N/A TYR 261.A OH ASN 419.A O no hydrogen 3.142 N/A THR 264.A N TYR 261.A O no hydrogen 3.212 N/A THR 264.A OG1 LEU 260.A O no hydrogen 2.456 N/A LYS 270.A NZ PHE 267.A O no hydrogen 2.897 N/A ASN 272.A ND2 LYS 270.A O no hydrogen 3.501 N/A ASN 272.A ND2 ASP 274.A OD2 no hydrogen 3.529 N/A ASP 274.A N ASN 272.A OD1 no hydrogen 3.417 N/A MET 279.A N VAL 275.A O no hydrogen 2.645 N/A VAL 280.A N THR 276.A O no hydrogen 2.932 N/A ASN 281.A N ASP 277.A O no hydrogen 2.931 N/A GLN 282.A N ALA 278.A O no hydrogen 3.021 N/A GLN 282.A NE2 GLY 404.A O no hydrogen 3.636 N/A ARG 288.A N ASP 285.A OD1 no hydrogen 2.696 N/A ARG 288.A NH1 ARG 288.A O no hydrogen 3.335 N/A ILE 289.A N ASP 285.A O no hydrogen 2.877 N/A PHE 290.A N ALA 286.A O no hydrogen 2.946 N/A LYS 291.A N ASN 287.A O no hydrogen 2.913 N/A GLU 292.A N ARG 288.A O no hydrogen 2.905 N/A ALA 293.A N ILE 289.A O no hydrogen 2.931 N/A GLU 294.A N PHE 290.A O no hydrogen 2.912 N/A LYS 295.A N LYS 291.A O no hydrogen 2.936 N/A LYS 295.A NZ LYS 291.A O no hydrogen 3.104 N/A PHE 296.A N GLU 292.A O no hydrogen 2.967 N/A PHE 297.A N ALA 293.A O no hydrogen 2.881 N/A VAL 298.A N GLU 294.A O no hydrogen 2.855 N/A SER 299.A N LYS 295.A O no hydrogen 2.921 N/A SER 299.A OG LYS 295.A O no hydrogen 3.322 N/A SER 299.A OG PHE 296.A O no hydrogen 2.345 N/A VAL 300.A N PHE 296.A O no hydrogen 2.929 N/A GLY 301.A N PHE 297.A O no hydrogen 3.025 N/A LEU 302.A N PHE 297.A O no hydrogen 2.812 N/A ASN 304.A N ASN 304.A OD1 no hydrogen 2.549 N/A TRP 310.A N THR 306.A O no hydrogen 2.998 N/A ASN 311.A N GLU 307.A O no hydrogen 2.968 N/A ASN 312.A N GLY 308.A O no hydrogen 2.948 N/A SER 313.A OG ILE 340.A O no hydrogen 2.819 N/A THR 316.A OG1 GLU 317.A O no hydrogen 3.417 N/A ARG 322.A N ASP 320.A OD1 no hydrogen 3.370 N/A ARG 322.A NH2 THR 34.A OG1 no hydrogen 2.727 N/A HIS 327.A ND1 VAL 325.A O no hydrogen 3.258 N/A THR 329.A N LYS 341.A O no hydrogen 2.930 N/A THR 329.A OG1 HIS 327.A O no hydrogen 2.885 N/A TRP 331.A N ARG 339.A O no hydrogen 2.845 N/A GLY 334.A N ASP 332.A OD1 no hydrogen 3.227 N/A ARG 339.A N TRP 331.A O no hydrogen 2.958 N/A ILE 340.A N SER 313.A OG no hydrogen 2.593 N/A LYS 341.A N THR 329.A O no hydrogen 2.940 N/A LYS 341.A NZ THR 329.A OG1 no hydrogen 3.205 N/A THR 344.A OG1 MET 342.A O no hydrogen 3.148 N/A PHE 351.A N THR 347.A O no hydrogen 2.868 N/A LEU 352.A N MET 348.A O no hydrogen 2.910 N/A THR 353.A N GLU 349.A O no hydrogen 2.917 N/A THR 353.A OG1 ASP 350.A O no hydrogen 2.592 N/A ALA 354.A N ASP 350.A O no hydrogen 2.826 N/A HIS 355.A N PHE 351.A O no hydrogen 2.990 N/A HIS 356.A N LEU 352.A O no hydrogen 2.772 N/A HIS 356.A NE2 GLU 384.A OE1 no hydrogen 2.420 N/A GLU 357.A N THR 353.A O no hydrogen 2.898 N/A MET 358.A N ALA 354.A O no hydrogen 2.891 N/A GLY 359.A N HIS 355.A O no hydrogen 2.838 N/A HIS 360.A N HIS 356.A O no hydrogen 2.899 N/A HIS 360.A ND1 HIS 383.A ND1 no hydrogen 2.966 N/A HIS 360.A NE2 HIS 356.A NE2 no hydrogen 3.014 N/A HIS 360.A NE2 GLU 384.A OE1 no hydrogen 2.573 N/A ILE 361.A N GLU 357.A O no hydrogen 2.984 N/A GLN 362.A N MET 358.A O no hydrogen 2.921 N/A GLN 362.A NE2 PRO 303.A O no hydrogen 2.442 N/A TYR 363.A N GLY 359.A O no hydrogen 2.846 N/A ASP 364.A N HIS 360.A O no hydrogen 2.893 N/A MET 365.A N ILE 361.A O no hydrogen 2.875 N/A ALA 366.A N GLN 362.A O no hydrogen 2.994 N/A ALA 366.A N TYR 363.A O no hydrogen 2.910 N/A TYR 367.A N TYR 363.A O no hydrogen 3.188 N/A TYR 367.A OH HIS 383.A NE2 no hydrogen 3.028 N/A ALA 368.A N MET 365.A O no hydrogen 3.279 N/A GLN 370.A N TYR 367.A O no hydrogen 3.009 N/A GLN 370.A NE2 SER 541.A O no hydrogen 3.094 N/A TYR 372.A N ASN 15.A OD1 no hydrogen 2.450 N/A ARG 375.A N TYR 372.A O no hydrogen 2.894 N/A ARG 375.A NH2 GLN 370.A O no hydrogen 3.238 N/A ASN 376.A N LEU 374.A O no hydrogen 2.761 N/A ALA 378.A N TYR 363.A OH no hydrogen 2.722 N/A GLY 381.A N ASN 379.A OD1 no hydrogen 2.765 N/A PHE 382.A N ASN 379.A OD1 no hydrogen 2.419 N/A HIS 383.A NE2 ASP 364.A OD1 no hydrogen 3.068 N/A ALA 385.A N GLY 381.A O no hydrogen 2.873 N/A VAL 386.A N PHE 382.A O no hydrogen 2.946 N/A GLU 388.A N GLU 384.A O no hydrogen 2.959 N/A VAL 389.A N ALA 385.A O no hydrogen 2.850 N/A MET 390.A N VAL 386.A O no hydrogen 2.996 N/A SER 391.A N GLY 387.A O no hydrogen 2.905 N/A SER 391.A OG GLU 388.A O no hydrogen 2.634 N/A SER 391.A OG GLU 388.A OE2 no hydrogen 2.543 N/A LEU 392.A N GLU 388.A O no hydrogen 2.844 N/A SER 393.A N VAL 389.A O no hydrogen 2.911 N/A SER 393.A OG VAL 389.A O no hydrogen 3.181 N/A VAL 394.A N MET 390.A O no hydrogen 2.954 N/A THR 396.A OG1 SER 393.A O no hydrogen 3.273 N/A LYS 398.A NZ HIS 517.A NE2 no hydrogen 3.193 N/A HIS 399.A N THR 396.A OG1 no hydrogen 3.428 N/A HIS 399.A ND1 ASP 525.A OD2 no hydrogen 2.775 N/A LEU 400.A N THR 396.A O no hydrogen 3.023 N/A LYS 401.A N PRO 397.A O no hydrogen 2.915 N/A LYS 401.A NZ SER 407.A O no hydrogen 2.421 N/A LYS 401.A NZ PRO 408.A O no hydrogen 2.859 N/A THR 402.A N LYS 398.A O no hydrogen 2.950 N/A THR 402.A OG1 LYS 398.A O no hydrogen 3.159 N/A THR 402.A OG1 HIS 399.A O no hydrogen 2.719 N/A MET 403.A N HIS 399.A O no hydrogen 3.341 N/A GLY 404.A N LYS 401.A O no hydrogen 3.383 N/A LEU 406.A N LEU 400.A O no hydrogen 2.757 N/A SER 407.A OG ASP 409.A OD1 no hydrogen 2.311 N/A PHE 410.A N SER 407.A O no hydrogen 3.372 N/A GLU 415.A N ASP 413.A OD2 no hydrogen 3.346 N/A THR 416.A N ASP 413.A OD1 no hydrogen 3.216 N/A THR 416.A OG1 ASP 413.A OD1 no hydrogen 2.669 N/A GLU 417.A N ASP 413.A O no hydrogen 3.336 N/A ILE 418.A N ASN 414.A O no hydrogen 2.900 N/A ASN 419.A N GLU 415.A O no hydrogen 2.880 N/A PHE 420.A N THR 416.A O no hydrogen 2.908 N/A LEU 421.A N GLU 417.A O no hydrogen 2.867 N/A LEU 422.A N ILE 418.A O no hydrogen 2.782 N/A LYS 423.A N ASN 419.A O no hydrogen 2.941 N/A GLN 424.A N PHE 420.A O no hydrogen 2.963 N/A GLN 424.A NE2 TYR 569.A OH no hydrogen 3.417 N/A ALA 425.A N LEU 421.A O no hydrogen 2.761 N/A LEU 426.A N LEU 422.A O no hydrogen 2.871 N/A ASN 427.A N LYS 423.A O no hydrogen 2.972 N/A ILE 428.A N GLN 424.A O no hydrogen 2.892 N/A GLY 430.A N ALA 425.A O no hydrogen 3.134 N/A GLY 430.A N LEU 426.A O no hydrogen 2.916 N/A THR 431.A N ILE 428.A O no hydrogen 2.901 N/A THR 431.A OG1 ARG 255.A O no hydrogen 3.444 N/A LEU 432.A N ILE 428.A O no hydrogen 3.000 N/A THR 435.A N THR 431.A O no hydrogen 2.683 N/A TYR 436.A N LEU 432.A O no hydrogen 2.910 N/A TYR 436.A OH ASP 209.A OD1 no hydrogen 2.619 N/A MET 437.A N PRO 433.A O no hydrogen 2.838 N/A LEU 438.A N PHE 434.A O no hydrogen 2.935 N/A GLU 439.A N THR 435.A O no hydrogen 2.926 N/A LYS 440.A N TYR 436.A O no hydrogen 2.853 N/A LYS 440.A NZ ASP 209.A OD1 no hydrogen 3.295 N/A LYS 440.A NZ TYR 436.A OH no hydrogen 2.984 N/A TRP 441.A N MET 437.A O no hydrogen 2.791 N/A TRP 441.A NE1 TRP 455.A O no hydrogen 3.345 N/A ARG 442.A N LEU 438.A O no hydrogen 2.893 N/A ARG 442.A NH2 HIS 487.A O no hydrogen 3.381 N/A TRP 443.A N GLU 439.A O no hydrogen 2.875 N/A MET 444.A N LYS 440.A O no hydrogen 2.879 N/A VAL 445.A N TRP 441.A O no hydrogen 2.894 N/A PHE 446.A N ARG 442.A O no hydrogen 2.826 N/A ARG 447.A N TRP 443.A O no hydrogen 2.902 N/A GLY 448.A N MET 444.A O no hydrogen 2.942 N/A GLU 454.A N PRO 451.A O no hydrogen 2.965 N/A TRP 455.A NE1 ILE 450.A O no hydrogen 2.510 N/A MET 456.A N GLU 477.A OE2 no hydrogen 2.964 N/A LYS 458.A N GLU 454.A O no hydrogen 3.104 N/A LYS 458.A NZ GLU 461.A OE2 no hydrogen 2.812 N/A TRP 459.A N TRP 455.A O no hydrogen 2.771 N/A TRP 460.A N MET 456.A O no hydrogen 2.857 N/A TRP 460.A NE1 ASP 481.A OD2 no hydrogen 3.088 N/A GLU 461.A N LYS 458.A O no hydrogen 2.892 N/A MET 462.A N LYS 458.A O no hydrogen 3.193 N/A LYS 463.A N TRP 459.A O no hydrogen 3.233 N/A ARG 464.A N GLU 461.A O no hydrogen 3.224 N/A ARG 464.A NH2 GLU 471.A OE2 no hydrogen 3.060 N/A LEU 466.A N MET 462.A O no hydrogen 2.793 N/A VAL 467.A N MET 462.A O no hydrogen 3.411 N/A VAL 469.A N LYS 463.A O no hydrogen 2.373 N/A VAL 470.A N LEU 244.A O no hydrogen 2.773 N/A CYS 480.A SG VAL 154.A O no hydrogen 3.193 N/A ALA 483.A N CYS 480.A O no hydrogen 2.687 N/A SER 484.A OG ASP 481.A O no hydrogen 3.525 N/A ALA 489.A N LEU 485.A O no hydrogen 3.124 N/A ASN 490.A N PHE 486.A O no hydrogen 3.134 N/A TYR 492.A N HIS 487.A O no hydrogen 2.510 N/A SER 493.A OG GLU 380.A OE1 no hydrogen 2.414 N/A SER 493.A OG GLU 380.A OE2 no hydrogen 3.298 N/A PHE 494.A N GLU 439.A OE1 no hydrogen 3.281 N/A ARG 496.A NE SER 493.A O no hydrogen 3.024 N/A ARG 496.A NH1 GLU 384.A OE2 no hydrogen 2.400 N/A ARG 496.A NH2 TYR 497.A OH no hydrogen 3.469 N/A TYR 497.A OH HIS 487.A NE2 no hydrogen 2.389 N/A TYR 498.A OH VAL 208.A O no hydrogen 3.269 N/A THR 499.A N ILE 495.A O no hydrogen 2.937 N/A THR 499.A OG1 TYR 189.A OH no hydrogen 2.539 N/A THR 499.A OG1 ILE 495.A O no hydrogen 2.789 N/A THR 499.A OG1 ARG 496.A O no hydrogen 3.352 N/A ARG 500.A N ARG 496.A O no hydrogen 2.801 N/A THR 501.A N TYR 497.A O no hydrogen 2.948 N/A THR 501.A OG1 TYR 497.A O no hydrogen 2.946 N/A THR 501.A OG1 TYR 498.A O no hydrogen 2.579 N/A ILE 502.A N TYR 498.A O no hydrogen 2.923 N/A PHE 503.A N THR 499.A O no hydrogen 2.886 N/A PHE 507.A N PHE 503.A O no hydrogen 2.908 N/A HIS 508.A N GLU 504.A O no hydrogen 2.881 N/A GLU 509.A N PHE 505.A O no hydrogen 2.800 N/A ALA 510.A N GLN 506.A O no hydrogen 2.966 N/A LEU 511.A N PHE 507.A O no hydrogen 2.839 N/A CYS 512.A N GLU 509.A O no hydrogen 3.337 N/A CYS 512.A SG HIS 517.A O no hydrogen 3.401 N/A CYS 512.A SG GLY 519.A O no hydrogen 3.821 N/A ARG 513.A N GLU 509.A O no hydrogen 2.889 N/A ARG 513.A N ALA 510.A O no hydrogen 3.120 N/A ARG 513.A NH2 ASP 557.A OD1 no hydrogen 3.176 N/A ILE 514.A N ALA 510.A O no hydrogen 2.858 N/A GLN 516.A NE2 GLN 516.A O no hydrogen 3.556 N/A HIS 517.A ND1 ASP 518.A O no hydrogen 2.976 N/A LEU 521.A N GLY 519.A O no hydrogen 2.605 N/A CYS 524.A SG HIS 517.A O no hydrogen 3.319 N/A SER 527.A N ASP 525.A OD1 no hydrogen 3.334 N/A SER 527.A OG HIS 399.A ND1 no hydrogen 2.936 N/A SER 527.A OG ASP 525.A OD1 no hydrogen 2.949 N/A SER 527.A OG ASP 525.A OD2 no hydrogen 2.806 N/A GLY 533.A N SER 529.A O no hydrogen 3.051 N/A LYS 534.A N THR 530.A O no hydrogen 2.892 N/A LYS 534.A NZ THR 530.A OG1 no hydrogen 3.108 N/A LYS 535.A N ASP 531.A O no hydrogen 2.940 N/A LYS 535.A NZ ASP 554.A O no hydrogen 2.970 N/A LEU 536.A N ALA 532.A O no hydrogen 2.895 N/A HIS 537.A N GLY 533.A O no hydrogen 2.858 N/A GLN 538.A N LYS 534.A O no hydrogen 2.961 N/A MET 539.A N LYS 535.A O no hydrogen 3.026 N/A LEU 540.A N LEU 536.A O no hydrogen 2.805 N/A SER 541.A N HIS 537.A O no hydrogen 2.846 N/A SER 541.A OG GLN 538.A O no hydrogen 3.160 N/A VAL 542.A N GLN 538.A O no hydrogen 2.984 N/A LYS 544.A NZ ASP 188.A O no hydrogen 2.674 N/A LYS 544.A NZ ASP 188.A OD1 no hydrogen 3.185 N/A LYS 544.A NZ ALA 378.A O no hydrogen 3.172 N/A SER 545.A N VAL 542.A O no hydrogen 3.080 N/A SER 545.A OG VAL 542.A O no hydrogen 2.286 N/A THR 551.A N PRO 547.A O no hydrogen 3.163 N/A THR 551.A OG1 PRO 547.A O no hydrogen 3.272 N/A LEU 552.A N TRP 548.A O no hydrogen 2.852 N/A LYS 553.A N THR 549.A O no hydrogen 2.908 N/A LYS 553.A NZ ASP 557.A O no hydrogen 2.819 N/A ASP 554.A N VAL 550.A O no hydrogen 2.867 N/A ILE 555.A N THR 551.A O no hydrogen 2.920 N/A VAL 556.A N LEU 552.A O no hydrogen 3.020 N/A SER 558.A OG ASN 560.A O no hydrogen 2.882 N/A ASP 562.A N GLN 506.A OE1 no hydrogen 3.099 N/A LEU 566.A N VAL 563.A O no hydrogen 2.477 N/A ARG 568.A N GLY 564.A O no hydrogen 2.915 N/A TYR 569.A N PRO 565.A O no hydrogen 2.890 N/A TYR 569.A N LEU 566.A O no hydrogen 3.288 N/A PHE 570.A N LEU 566.A O no hydrogen 2.864 N/A PHE 570.A N LEU 567.A O no hydrogen 3.249 N/A GLU 571.A N GLU 571.A OE1 no hydrogen 2.977 N/A TYR 574.A N PHE 570.A O no hydrogen 2.649 N/A THR 575.A N GLU 571.A O no hydrogen 2.913 N/A THR 575.A OG1 GLU 571.A O no hydrogen 2.565 N/A TRP 576.A N PRO 572.A O no hydrogen 2.834 N/A LEU 577.A N LEU 573.A O no hydrogen 2.851 N/A GLN 578.A N TYR 574.A O no hydrogen 3.024 N/A GLN 578.A NE2 HIS 221.A NE2 no hydrogen 3.270 N/A GLU 579.A N THR 575.A O no hydrogen 3.301 N/A GLN 580.A N LEU 577.A O no hydrogen 2.791 N/A ASN 581.A N LEU 577.A O no hydrogen 2.711 N/A ASN 581.A ND2 HIS 221.A O no hydrogen 3.547 N/A SER 584.A OG ASN 581.A O no hydrogen 3.467 N/A ASN 589.A ND2 ASP 591.A OD2 no hydrogen 3.364 N/A ASP 591.A N ASN 589.A OD1 no hydrogen 3.309 N/A SER 593.A N SER 596.A OG no hydrogen 2.841 N/A SER 593.A N ASP 597.A OD2 no hydrogen 3.031 N/A SER 596.A OG ASP 591.A O no hydrogen 3.449 N/A SER 596.A OG SER 593.A O no hydrogen 2.879 N/A SER 596.A OG ASP 597.A OD2 no hydrogen 2.782 N/A ASP 597.A N SER 593.A O no hydrogen 2.506 N/A