Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4txk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N THR 1.A OG1 no hydrogen 2.639 N/A HIS 5.A N ASN 2.A O no hydrogen 3.141 N/A ASP 6.A N PRO 3.A O no hydrogen 2.916 N/A HIS 7.A N PRO 3.A O no hydrogen 2.946 N/A PHE 8.A N ALA 4.A O no hydrogen 2.842 N/A GLU 9.A N HIS 5.A O no hydrogen 2.920 N/A THR 10.A N ASP 6.A O no hydrogen 2.927 N/A THR 10.A OG1 ASP 6.A O no hydrogen 3.230 N/A PHE 11.A N HIS 7.A O no hydrogen 2.906 N/A VAL 12.A N PHE 8.A O no hydrogen 2.802 N/A GLN 13.A N GLU 9.A O no hydrogen 2.957 N/A ALA 14.A N PHE 11.A O no hydrogen 3.295 N/A GLN 15.A NE2 GLN 153.A OE1 no hydrogen 3.672 N/A CYS 17.A SG ILE 111.A O no hydrogen 3.884 N/A GLN 18.A NE2 ILE 111.A O no hydrogen 2.608 N/A VAL 20.A N LEU 16.A O no hydrogen 2.767 N/A LEU 21.A N CYS 17.A O no hydrogen 2.983 N/A SER 22.A N GLN 18.A O no hydrogen 2.969 N/A SER 22.A OG GLN 18.A O no hydrogen 3.539 N/A SER 22.A OG ASP 19.A O no hydrogen 3.433 N/A SER 23.A N ASP 19.A O no hydrogen 2.902 N/A SER 23.A OG ASP 19.A O no hydrogen 2.533 N/A SER 23.A OG VAL 20.A O no hydrogen 3.139 N/A PHE 24.A N VAL 20.A O no hydrogen 2.930 N/A GLN 25.A N LEU 21.A O no hydrogen 2.980 N/A GLY 26.A N SER 22.A O no hydrogen 2.875 N/A LEU 27.A N SER 23.A O no hydrogen 2.934 N/A CYS 28.A N PHE 24.A O no hydrogen 2.889 N/A CYS 28.A SG PHE 24.A O no hydrogen 3.312 N/A ARG 29.A N GLN 25.A O no hydrogen 2.892 N/A ALA 30.A N GLY 26.A O no hydrogen 2.942 N/A LEU 31.A N CYS 28.A O no hydrogen 3.100 N/A VAL 33.A N CYS 28.A O no hydrogen 3.139 N/A SER 35.A OG GLN 25.A OE1 no hydrogen 2.896 N/A GLY 37.A N GLN 41.A OE1 no hydrogen 2.916 N/A SER 40.A OG GLY 37.A O no hydrogen 3.141 N/A GLN 41.A N GLY 37.A O no hydrogen 3.041 N/A GLN 41.A NE2 LEU 163.A O no hydrogen 3.266 N/A GLN 41.A NE2 LEU 164.A O no hydrogen 3.364 N/A TYR 42.A OH ASP 62.A OD1 no hydrogen 2.916 N/A HIS 43.A N LEU 39.A O no hydrogen 2.997 N/A LYS 44.A N SER 40.A O no hydrogen 3.003 N/A ILE 45.A N GLN 41.A O no hydrogen 2.977 N/A LYS 46.A N TYR 42.A O no hydrogen 2.999 N/A LYS 46.A NZ ASP 62.A OD1 no hydrogen 2.989 N/A LYS 46.A NZ ASP 62.A OD2 no hydrogen 3.114 N/A ALA 47.A N HIS 43.A O no hydrogen 2.960 N/A GLN 48.A N LYS 44.A O no hydrogen 2.946 N/A LEU 49.A N ILE 45.A O no hydrogen 3.058 N/A SER 53.A OG GLU 9.A OE2 no hydrogen 3.102 N/A ALA 54.A N TYR 51.A O no hydrogen 3.045 N/A TRP 58.A N ALA 54.A O no hydrogen 2.968 N/A TRP 58.A NE1 LEU 49.A O no hydrogen 2.808 N/A ALA 59.A N LYS 55.A O no hydrogen 2.953 N/A LYS 60.A N SER 56.A O no hydrogen 2.914 N/A LEU 61.A N LEU 57.A O no hydrogen 2.959 N/A ASP 62.A N TRP 58.A O no hydrogen 2.831 N/A ASP 62.A N ALA 59.A O no hydrogen 3.027 N/A LYS 63.A N ALA 59.A O no hydrogen 2.907 N/A ARG 64.A N LYS 60.A O no hydrogen 3.048 N/A ARG 64.A NE GLU 96.A OE1 no hydrogen 3.054 N/A ARG 64.A NH2 GLU 96.A OE1 no hydrogen 2.720 N/A ALA 65.A N LEU 61.A O no hydrogen 2.894 N/A SER 66.A N ASP 62.A O no hydrogen 3.081 N/A SER 66.A OG ASP 62.A O no hydrogen 2.807 N/A SER 66.A OG LYS 63.A O no hydrogen 3.400 N/A GLN 67.A N ARG 64.A O no hydrogen 3.051 N/A TYR 70.A N GLN 67.A O no hydrogen 3.187 N/A TYR 70.A OH GLU 96.A OE1 no hydrogen 3.171 N/A TYR 70.A OH GLU 96.A OE2 no hydrogen 2.361 N/A GLY 73.A N TYR 70.A O no hydrogen 3.317 N/A GLN 74.A N TYR 70.A O no hydrogen 3.295 N/A GLN 74.A N GLN 71.A O no hydrogen 2.915 N/A GLN 74.A NE2 GLN 72.A O no hydrogen 3.371 N/A ALA 75.A N TYR 70.A O no hydrogen 3.109 N/A CYS 76.A N LEU 100.A O no hydrogen 2.879 N/A THR 77.A OG1 GLN 74.A OE1 no hydrogen 3.557 N/A THR 79.A N CYS 76.A O no hydrogen 2.812 N/A LYS 80.A N ASP 206.A OD1 no hydrogen 2.748 N/A LYS 80.A NZ GLU 204.A O no hydrogen 3.044 N/A CYS 81.A N ARG 103.A O no hydrogen 2.924 N/A LEU 82.A N VAL 207.A O no hydrogen 2.847 N/A VAL 83.A N VAL 105.A O no hydrogen 2.979 N/A VAL 84.A N ILE 209.A O no hydrogen 2.816 N/A GLY 85.A N VAL 107.A O no hydrogen 2.943 N/A ALA 86.A N GLU 108.A OE1 no hydrogen 2.769 N/A LEU 91.A N GLY 87.A O no hydrogen 2.948 N/A ARG 92.A N PRO 88.A O no hydrogen 2.847 N/A ARG 92.A NE ASP 128.A OD2 no hydrogen 2.870 N/A ARG 92.A NH1 ARG 92.A O no hydrogen 3.544 N/A ARG 92.A NH1 GLU 96.A OE1 no hydrogen 2.950 N/A ARG 92.A NH2 GLU 96.A OE1 no hydrogen 3.308 N/A ARG 92.A NH2 ASP 128.A OD1 no hydrogen 2.757 N/A ARG 92.A NH2 ASP 128.A OD2 no hydrogen 2.734 N/A ALA 93.A N CYS 89.A O no hydrogen 2.917 N/A ALA 94.A N GLY 90.A O no hydrogen 2.845 N/A VAL 95.A N LEU 91.A O no hydrogen 2.864 N/A GLU 96.A N ARG 92.A O no hydrogen 2.977 N/A LEU 97.A N ALA 93.A O no hydrogen 2.873 N/A ALA 98.A N ALA 94.A O no hydrogen 2.893 N/A LEU 99.A N VAL 95.A O no hydrogen 2.929 N/A LEU 100.A N GLU 96.A O no hydrogen 3.014 N/A GLY 101.A N ALA 98.A O no hydrogen 2.982 N/A ALA 102.A N LEU 97.A O no hydrogen 3.171 N/A ARG 103.A N THR 79.A O no hydrogen 3.188 N/A ARG 103.A NH2 GLU 168.A OE1 no hydrogen 3.412 N/A VAL 105.A N CYS 81.A O no hydrogen 3.348 N/A LEU 106.A N GLU 168.A O no hydrogen 2.483 N/A VAL 107.A N VAL 83.A O no hydrogen 3.126 N/A GLU 108.A N HIS 170.A O no hydrogen 2.828 N/A ARG 110.A N GLU 108.A OE2 no hydrogen 2.772 N/A ASN 117.A ND2 THR 235.A OG1 no hydrogen 2.781 N/A LEU 119.A N ILE 149.A O no hydrogen 2.870 N/A LEU 121.A N ASP 147.A O no hydrogen 2.465 N/A TRP 122.A NE1 GLY 397.A O no hydrogen 2.946 N/A THR 125.A OG1 TRP 122.A O no hydrogen 2.646 N/A ILE 126.A N TRP 122.A O no hydrogen 3.094 N/A HIS 127.A N PRO 123.A O no hydrogen 2.994 N/A ASP 128.A N PHE 124.A O no hydrogen 2.868 N/A LEU 129.A N THR 125.A O no hydrogen 2.973 N/A ARG 130.A N ILE 126.A O no hydrogen 2.903 N/A ALA 131.A N HIS 127.A O no hydrogen 2.916 N/A LEU 132.A N LEU 129.A O no hydrogen 2.848 N/A GLY 133.A N ARG 130.A O no hydrogen 2.705 N/A ALA 134.A N ARG 130.A O no hydrogen 3.449 N/A LYS 135.A NZ GLY 139.A O no hydrogen 2.926 N/A LYS 135.A NZ PHE 141.A O no hydrogen 3.139 N/A LYS 136.A N GLY 133.A O no hydrogen 3.078 N/A LYS 136.A NZ SER 53.A O no hydrogen 3.028 N/A LYS 136.A NZ SER 53.A OG no hydrogen 2.640 N/A PHE 137.A N GLY 133.A O no hydrogen 3.156 N/A TYR 138.A OH GLU 284.A OE2 no hydrogen 2.917 N/A CYS 142.A SG LEU 146.A O no hydrogen 3.761 N/A HIS 148.A NE2 GLU 251.A OE1 no hydrogen 3.123 N/A HIS 148.A NE2 GLU 251.A OE2 no hydrogen 2.947 N/A ILE 149.A N LEU 119.A O no hydrogen 2.964 N/A SER 150.A OG ASP 283.A OD2 no hydrogen 3.375 N/A ILE 151.A N ASN 117.A O no hydrogen 2.997 N/A ARG 152.A N ARG 115.A O no hydrogen 3.071 N/A ARG 152.A NE PHE 113.A O no hydrogen 3.191 N/A ARG 152.A NH1 GLN 15.A O no hydrogen 2.551 N/A GLN 153.A NE2 GLN 15.A OE1 no hydrogen 3.105 N/A LEU 154.A N SER 150.A O no hydrogen 3.200 N/A GLN 155.A N ILE 151.A O no hydrogen 2.919 N/A GLN 155.A NE2 ALA 86.A O no hydrogen 3.179 N/A LEU 156.A N ARG 152.A O no hydrogen 2.882 N/A LEU 157.A N GLN 153.A O no hydrogen 3.023 N/A LEU 158.A N LEU 154.A O no hydrogen 3.047 N/A LEU 159.A N GLN 155.A O no hydrogen 2.905 N/A LYS 160.A N LEU 156.A O no hydrogen 2.956 N/A LYS 160.A NZ ALA 14.A O no hydrogen 3.070 N/A VAL 161.A N LEU 157.A O no hydrogen 3.016 N/A ALA 162.A N LEU 158.A O no hydrogen 2.921 N/A LEU 163.A N LEU 159.A O no hydrogen 2.863 N/A LEU 164.A N LYS 160.A O no hydrogen 2.989 N/A LEU 165.A N VAL 161.A O no hydrogen 3.171 N/A GLY 166.A N LEU 163.A O no hydrogen 2.563 N/A VAL 167.A N ALA 162.A O no hydrogen 3.145 N/A GLU 168.A N VAL 104.A O no hydrogen 2.987 N/A HIS 170.A N LEU 106.A O no hydrogen 2.864 N/A HIS 170.A NE2 GLU 168.A OE2 no hydrogen 2.809 N/A GLY 172.A N ARG 110.A O no hydrogen 3.101 N/A VAL 173.A N GLU 108.A O no hydrogen 2.838 N/A LYS 174.A N GLN 193.A O no hydrogen 2.765 N/A THR 176.A N GLN 191.A O no hydrogen 2.901 N/A THR 176.A OG1 GLN 191.A O no hydrogen 3.157 N/A GLN 179.A N ARG 189.A O no hydrogen 2.407 N/A SER 186.A N ARG 183.A O no hydrogen 2.738 N/A TRP 188.A NE1 ALA 378.A O no hydrogen 3.165 N/A ARG 189.A N GLN 179.A O no hydrogen 2.883 N/A GLN 191.A N GLY 177.A O no hydrogen 2.731 N/A GLN 193.A N LYS 174.A O no hydrogen 2.846 N/A ALA 201.A N PRO 197.A O no hydrogen 2.958 N/A SER 202.A OG ALA 198.A O no hydrogen 2.370 N/A TYR 203.A N LEU 200.A O no hydrogen 3.306 N/A TYR 203.A OH CYS 81.A O no hydrogen 2.487 N/A PHE 205.A N TRP 188.A O no hydrogen 3.276 N/A ASP 206.A N LYS 80.A O no hydrogen 2.742 N/A VAL 207.A N LYS 80.A O no hydrogen 2.931 N/A LEU 208.A N LEU 381.A O no hydrogen 2.867 N/A ILE 209.A N LEU 82.A O no hydrogen 2.864 N/A SER 210.A N GLY 383.A O no hydrogen 2.915 N/A ALA 211.A N VAL 84.A O no hydrogen 2.817 N/A PHE 216.A N GLY 213.A O no hydrogen 3.159 N/A ARG 224.A N ARG 365.A O no hydrogen 2.680 N/A ARG 227.A NH1 THR 310.A OG1 no hydrogen 3.076 N/A ARG 227.A NH2 THR 310.A OG1 no hydrogen 3.135 N/A ARG 227.A NH2 ASP 359.A OD2 no hydrogen 2.259 N/A GLY 228.A N THR 361.A O no hydrogen 2.803 N/A ALA 231.A N THR 361.A OG1 no hydrogen 2.939 N/A ILE 232.A N ALA 292.A O no hydrogen 2.990 N/A GLY 233.A N PHE 358.A O no hydrogen 2.936 N/A ILE 234.A N MET 290.A O no hydrogen 2.840 N/A THR 235.A N ALA 356.A O no hydrogen 2.949 N/A ALA 236.A N PHE 288.A O no hydrogen 2.874 N/A ASN 237.A N ASP 354.A O no hydrogen 3.100 N/A ASN 237.A ND2 ASN 117.A OD1 no hydrogen 3.067 N/A PHE 238.A N HIS 286.A O no hydrogen 2.859 N/A VAL 239.A N GLU 344.A O no hydrogen 2.822 N/A ASN 240.A ND2 ASP 283.A O no hydrogen 2.919 N/A GLY 241.A N GLU 246.A OE1 no hydrogen 2.924 N/A ARG 242.A N ASN 240.A OD1 no hydrogen 2.818 N/A THR 243.A N GLU 246.A OE2 no hydrogen 3.221 N/A THR 243.A OG1 GLU 246.A OE2 no hydrogen 2.553 N/A THR 247.A N THR 243.A O no hydrogen 2.732 N/A THR 247.A OG1 THR 243.A O no hydrogen 3.252 N/A GLN 248.A N VAL 244.A O no hydrogen 3.066 N/A GLN 248.A N GLU 245.A O no hydrogen 3.081 N/A VAL 249.A N GLU 246.A O no hydrogen 3.361 N/A ILE 252.A N TYR 280.A O no hydrogen 2.876 N/A VAL 255.A N ILE 278.A O no hydrogen 3.443 N/A ARG 257.A N GLU 276.A O no hydrogen 3.278 N/A ARG 257.A NH1 LEU 275.A O no hydrogen 2.976 N/A TYR 259.A N ALA 256.A O no hydrogen 3.225 N/A ASN 260.A N ALA 256.A O no hydrogen 3.079 N/A ASN 260.A ND2 ALA 256.A O no hydrogen 2.946 N/A GLN 261.A N TYR 259.A O no hydrogen 2.845 N/A PHE 264.A N ASN 260.A O no hydrogen 3.244 N/A GLN 265.A N GLN 261.A O no hydrogen 2.878 N/A SER 266.A N LYS 262.A O no hydrogen 2.946 N/A SER 266.A OG LYS 262.A O no hydrogen 2.397 N/A LEU 267.A N PHE 263.A O no hydrogen 2.897 N/A LEU 268.A N PHE 264.A O no hydrogen 2.933 N/A LYS 269.A N GLN 265.A O no hydrogen 2.899 N/A ALA 270.A N LEU 267.A O no hydrogen 3.284 N/A THR 271.A OG1 LEU 267.A O no hydrogen 2.514 N/A GLY 272.A N LEU 268.A O no hydrogen 2.718 N/A ILE 273.A N THR 271.A OG1 no hydrogen 2.948 N/A GLU 276.A N THR 291.A O no hydrogen 2.715 N/A VAL 279.A N VAL 289.A O no hydrogen 2.833 N/A TYR 280.A N ILE 252.A O no hydrogen 2.885 N/A TYR 280.A OH HIS 286.A ND1 no hydrogen 2.802 N/A TYR 281.A N TYR 287.A O no hydrogen 2.924 N/A LYS 282.A NZ GLU 246.A O no hydrogen 3.100 N/A LYS 282.A NZ THR 247.A O no hydrogen 3.551 N/A LYS 282.A NZ VAL 249.A O no hydrogen 2.459 N/A LYS 282.A NZ TYR 280.A OH no hydrogen 2.996 N/A ASP 283.A N THR 285.A O no hydrogen 2.914 N/A GLU 284.A N ASP 283.A OD2 no hydrogen 2.857 N/A THR 285.A OG1 ASN 237.A OD1 no hydrogen 2.712 N/A HIS 286.A N PHE 238.A O no hydrogen 2.877 N/A HIS 286.A ND1 TYR 280.A OH no hydrogen 2.802 N/A HIS 286.A NE2 GLU 246.A OE1 no hydrogen 3.087 N/A TYR 287.A N TYR 281.A O no hydrogen 2.921 N/A PHE 288.A N ALA 236.A O no hydrogen 2.899 N/A VAL 289.A N VAL 279.A O no hydrogen 2.969 N/A MET 290.A N ILE 234.A O no hydrogen 2.896 N/A THR 291.A N ASN 277.A O no hydrogen 2.936 N/A ALA 292.A N ILE 232.A O no hydrogen 2.890 N/A LYS 294.A NZ ASP 306.A OD1 no hydrogen 3.123 N/A CYS 296.A SG GLY 272.A O no hydrogen 3.904 N/A CYS 296.A SG ASP 274.A O no hydrogen 3.824 N/A LEU 298.A N LYS 294.A O no hydrogen 2.929 N/A ARG 299.A N GLN 295.A O no hydrogen 2.992 N/A ARG 299.A NH2 GLY 272.A O no hydrogen 2.551 N/A LEU 300.A N CYS 296.A O no hydrogen 3.132 N/A GLY 301.A N LEU 298.A O no hydrogen 2.755 N/A LEU 303.A N LEU 297.A O no hydrogen 2.993 N/A ARG 304.A N ASN 318.A O no hydrogen 2.842 N/A ARG 304.A NE ALA 317.A O no hydrogen 3.155 N/A GLN 305.A N ASN 318.A OD1 no hydrogen 2.823 N/A LEU 307.A N GLN 305.A O no hydrogen 3.155 N/A GLN 312.A N GLU 309.A O no hydrogen 2.910 N/A LEU 313.A N GLU 309.A O no hydrogen 2.907 N/A LEU 314.A N THR 310.A O no hydrogen 3.125 N/A GLY 315.A N GLN 312.A O no hydrogen 3.290 N/A ASN 318.A N GLY 315.A O no hydrogen 3.073 N/A ASN 318.A ND2 GLN 305.A O no hydrogen 3.623 N/A ASN 318.A ND2 LEU 313.A O no hydrogen 2.707 N/A VAL 319.A N GLY 315.A O no hydrogen 3.116 N/A VAL 320.A N VAL 302.A O no hydrogen 2.809 N/A LEU 324.A N VAL 320.A O no hydrogen 3.048 N/A GLN 325.A N PRO 321.A O no hydrogen 2.963 N/A ARG 326.A N GLU 322.A O no hydrogen 2.994 N/A PHE 327.A N ALA 323.A O no hydrogen 2.859 N/A ALA 328.A N LEU 324.A O no hydrogen 2.859 N/A ARG 329.A N GLN 325.A O no hydrogen 2.856 N/A ARG 329.A NE LEU 343.A O no hydrogen 3.194 N/A ARG 329.A NH2 LEU 343.A O no hydrogen 3.293 N/A ALA 330.A N ARG 326.A O no hydrogen 2.869 N/A ALA 331.A N PHE 327.A O no hydrogen 2.969 N/A ALA 332.A N ALA 328.A O no hydrogen 2.920 N/A ASP 333.A N ARG 329.A O no hydrogen 2.899 N/A PHE 334.A N ALA 330.A O no hydrogen 2.981 N/A ALA 335.A N ALA 331.A O no hydrogen 2.971 N/A THR 336.A OG1 ALA 332.A O no hydrogen 3.138 N/A THR 336.A OG1 ASP 333.A O no hydrogen 3.561 N/A HIS 337.A N PHE 334.A O no hydrogen 3.077 N/A GLY 338.A N ASP 333.A O no hydrogen 2.925 N/A LYS 339.A N THR 336.A O no hydrogen 2.886 N/A LYS 339.A NZ HIS 337.A O no hydrogen 3.428 N/A GLY 341.A N GLY 338.A O no hydrogen 3.137 N/A ALA 346.A N ASN 237.A O no hydrogen 2.849 N/A ASP 348.A N ARG 352.A O no hydrogen 3.047 N/A ARG 350.A N ASP 348.A OD1 no hydrogen 2.830 N/A GLY 351.A N ASP 348.A O no hydrogen 3.102 N/A ASP 354.A N ALA 346.A O no hydrogen 2.777 N/A VAL 355.A N PRO 353.A O no hydrogen 2.812 N/A ALA 356.A N THR 235.A O no hydrogen 2.970 N/A PHE 358.A N GLY 233.A O no hydrogen 2.794 N/A PHE 360.A N ALA 231.A O no hydrogen 3.182 N/A THR 361.A N ASP 359.A OD1 no hydrogen 2.930 N/A THR 361.A OG1 ALA 231.A O no hydrogen 3.181 N/A THR 361.A OG1 ASP 359.A OD1 no hydrogen 2.779 N/A SER 362.A OG GLU 391.A OE1 no hydrogen 2.861 N/A SER 362.A OG GLU 391.A OE2 no hydrogen 2.659 N/A MET 363.A N MET 226.A O no hydrogen 2.908 N/A MET 364.A N GLU 391.A OE1 no hydrogen 2.808 N/A ARG 365.A N ARG 224.A O no hydrogen 3.210 N/A ALA 366.A N LEU 389.A O no hydrogen 3.248 N/A GLU 367.A N THR 222.A O no hydrogen 3.085 N/A SER 368.A OG ALA 370.A O no hydrogen 3.552 N/A SER 369.A N GLU 431.A OE2 no hydrogen 3.066 N/A SER 369.A OG GLU 431.A OE2 no hydrogen 3.025 N/A ARG 371.A N LEU 382.A O no hydrogen 2.960 N/A ARG 371.A NH2 ASP 478.A OD2 no hydrogen 3.558 N/A VAL 372.A N LEU 476.A O no hydrogen 2.751 N/A GLN 373.A N LEU 380.A O no hydrogen 2.904 N/A GLU 374.A N ASP 478.A O no hydrogen 3.028 N/A LYS 375.A N ALA 378.A O no hydrogen 2.992 N/A HIS 376.A N ASP 481.A OD1 no hydrogen 2.838 N/A HIS 376.A ND1 PRO 181.A O no hydrogen 3.054 N/A GLY 377.A N ASP 481.A OD2 no hydrogen 3.445 N/A ALA 378.A N LYS 375.A O no hydrogen 2.915 N/A LEU 380.A N GLN 373.A O no hydrogen 2.805 N/A LEU 381.A N ASP 206.A O no hydrogen 2.971 N/A LEU 382.A N ARG 371.A O no hydrogen 2.880 N/A GLY 383.A N LEU 208.A O no hydrogen 2.841 N/A LEU 384.A N SER 369.A O no hydrogen 2.786 N/A VAL 385.A N SER 210.A O no hydrogen 2.877 N/A CYS 388.A SG SER 210.A O no hydrogen 3.389 N/A CYS 388.A SG SER 210.A OG no hydrogen 3.676 N/A CYS 388.A SG VAL 385.A O no hydrogen 3.491 N/A LEU 389.A N GLY 386.A O no hydrogen 3.052 N/A VAL 390.A N GLY 386.A O no hydrogen 3.248 N/A GLU 391.A N MET 364.A O no hydrogen 3.188 N/A GLY 397.A N TRP 394.A O no hydrogen 2.968 N/A ARG 402.A NH2 THR 440.A O no hydrogen 3.097 N/A GLY 403.A N GLY 399.A O no hydrogen 2.895 N/A PHE 404.A N VAL 400.A O no hydrogen 2.834 N/A LEU 405.A N ALA 401.A O no hydrogen 2.993 N/A ALA 406.A N ARG 402.A O no hydrogen 2.908 N/A ALA 407.A N GLY 403.A O no hydrogen 2.871 N/A ALA 407.A N PHE 404.A O no hydrogen 2.826 N/A PHE 408.A N PHE 404.A O no hydrogen 2.794 N/A ASP 409.A N LEU 405.A O no hydrogen 2.865 N/A ALA 410.A N ALA 406.A O no hydrogen 2.928 N/A ALA 411.A N ALA 407.A O no hydrogen 2.853 N/A TRP 412.A N PHE 408.A O no hydrogen 2.833 N/A TRP 412.A NE1 GLU 429.A OE2 no hydrogen 2.895 N/A MET 413.A N ASP 409.A O no hydrogen 2.954 N/A VAL 414.A N ALA 410.A O no hydrogen 2.875 N/A LYS 415.A N ALA 411.A O no hydrogen 2.921 N/A LYS 415.A NZ GLU 419.A OE1 no hydrogen 2.961 N/A LYS 415.A NZ GLU 419.A OE2 no hydrogen 3.236 N/A ARG 416.A N TRP 412.A O no hydrogen 2.986 N/A ARG 416.A NE GLU 429.A OE1 no hydrogen 3.474 N/A TRP 417.A N MET 413.A O no hydrogen 2.944 N/A TRP 417.A NE1 ASP 206.A OD2 no hydrogen 2.764 N/A ALA 418.A N VAL 414.A O no hydrogen 2.894 N/A GLU 419.A N LYS 415.A O no hydrogen 3.116 N/A GLY 420.A N TRP 417.A O no hydrogen 3.306 N/A GLU 425.A N GLU 425.A OE1 no hydrogen 2.695 N/A VAL 426.A N GLY 422.A O no hydrogen 3.019 N/A LEU 427.A N PRO 423.A O no hydrogen 2.947 N/A ALA 428.A N LEU 424.A O no hydrogen 2.844 N/A GLU 429.A N GLU 425.A O no hydrogen 2.930 N/A ARG 430.A N VAL 426.A O no hydrogen 3.062 N/A ARG 430.A NH1 ARG 430.A O no hydrogen 2.991 N/A GLU 431.A N LEU 427.A O no hydrogen 2.858 N/A GLU 431.A N ALA 428.A O no hydrogen 2.864 N/A SER 432.A N ALA 428.A O no hydrogen 2.925 N/A SER 432.A OG ALA 428.A O no hydrogen 3.030 N/A LEU 433.A N GLU 429.A O no hydrogen 3.054 N/A TYR 434.A N ARG 430.A O no hydrogen 2.825 N/A TYR 434.A OH ALA 366.A O no hydrogen 2.484 N/A GLN 435.A N GLU 431.A O no hydrogen 2.963 N/A LEU 436.A N LEU 433.A O no hydrogen 3.025 N/A LEU 437.A N TYR 434.A O no hydrogen 3.012 N/A GLN 439.A N LEU 436.A O no hydrogen 3.292 N/A THR 440.A N LEU 437.A O no hydrogen 2.944 N/A THR 440.A OG1 LEU 437.A O no hydrogen 2.606 N/A SER 441.A OG GLU 443.A OE1 no hydrogen 3.562 N/A GLU 443.A N GLU 443.A OE1 no hydrogen 2.809 N/A ASN 444.A N SER 441.A O no hydrogen 3.002 N/A ASN 444.A ND2 GLN 439.A O no hydrogen 2.910 N/A HIS 446.A N ARG 459.A O no hydrogen 3.152 N/A TYR 452.A OH HIS 446.A O no hydrogen 2.989 N/A GLY 453.A N THR 458.A OG1 no hydrogen 3.039 N/A ALA 457.A N ASP 455.A OD1 no hydrogen 2.915 N/A THR 458.A N ASP 455.A O no hydrogen 3.112 N/A THR 458.A OG1 GLY 453.A O no hydrogen 3.234 N/A THR 458.A OG1 ASP 455.A O no hydrogen 3.110 N/A ARG 459.A N PRO 456.A O no hydrogen 3.155 N/A ARG 459.A NH1 GLY 453.A O no hydrogen 3.341 N/A ARG 459.A NH2 ASP 409.A OD1 no hydrogen 2.126 N/A TYR 460.A N PRO 456.A O no hydrogen 2.911 N/A TYR 460.A OH ASP 409.A OD2 no hydrogen 2.750 N/A ARG 466.A N ASN 464.A OD1 no hydrogen 3.138 N/A ALA 467.A N ASN 464.A O no hydrogen 3.333 N/A VAL 468.A N SER 432.A OG no hydrogen 2.930 N/A ASN 471.A ND2 ASP 563.A OD1 no hydrogen 3.214 N/A ASN 471.A ND2 ASP 563.A OD2 no hydrogen 3.388 N/A GLN 472.A N THR 469.A O no hydrogen 2.973 N/A GLN 472.A NE2 THR 469.A OG1 no hydrogen 3.414 N/A GLN 474.A N ASN 471.A O no hydrogen 3.408 N/A GLN 474.A NE2 ASN 471.A O no hydrogen 2.846 N/A GLN 474.A NE2 ASP 563.A OD2 no hydrogen 2.718 N/A LEU 476.A N VAL 473.A O no hydrogen 2.947 N/A TYR 477.A N GLN 474.A O no hydrogen 3.325 N/A TYR 477.A OH GLU 374.A OE1 no hydrogen 2.327 N/A ASP 478.A N VAL 372.A O no hydrogen 2.745 N/A MET 480.A N GLU 374.A O no hydrogen 3.172 N/A LEU 487.A N THR 483.A O no hydrogen 3.319 N/A HIS 488.A N GLU 484.A O no hydrogen 3.029 N/A TRP 489.A N GLU 485.A O no hydrogen 2.919 N/A CYS 490.A N LEU 486.A O no hydrogen 2.946 N/A CYS 490.A SG LEU 486.A O no hydrogen 3.355 N/A GLN 491.A N LEU 487.A O no hydrogen 2.898 N/A GLN 491.A NE2 VAL 502.A O no hydrogen 3.470 N/A GLU 492.A N HIS 488.A O no hydrogen 2.971 N/A GLN 493.A N TRP 489.A O no hydrogen 2.898 N/A THR 494.A N CYS 490.A O no hydrogen 2.966 N/A THR 494.A OG1 CYS 490.A O no hydrogen 2.826 N/A THR 494.A OG1 GLN 491.A O no hydrogen 3.480 N/A VAL 500.A N PHE 497.A O no hydrogen 3.364 N/A THR 503.A N SER 508.A OG no hydrogen 2.780 N/A THR 503.A OG1 SER 508.A OG no hydrogen 3.004 N/A SER 506.A OG GLY 561.A O no hydrogen 2.945 N/A SER 507.A N ASP 504.A OD2 no hydrogen 2.990 N/A SER 507.A OG ASP 504.A OD2 no hydrogen 2.727 N/A SER 508.A N ASP 504.A OD1 no hydrogen 2.843 N/A SER 508.A OG ASP 504.A OD1 no hydrogen 2.439 N/A TRP 509.A N SER 506.A O no hydrogen 3.065 N/A TRP 509.A NE1 ASP 504.A O no hydrogen 2.626 N/A ALA 510.A N SER 507.A O no hydrogen 3.226 N/A CYS 516.A N GLY 512.A O no hydrogen 3.450 N/A CYS 516.A SG GLY 512.A O no hydrogen 3.628 N/A CYS 516.A SG ALA 535.A O no hydrogen 3.200 N/A ALA 517.A N LEU 513.A O no hydrogen 3.039 N/A LEU 518.A N LEU 515.A O no hydrogen 3.006 N/A VAL 519.A N LEU 515.A O no hydrogen 3.063 N/A HIS 520.A N CYS 516.A O no hydrogen 2.738 N/A HIS 521.A N ALA 517.A O no hydrogen 3.313 N/A HIS 521.A ND1 GLN 493.A OE1 no hydrogen 2.876 N/A LEU 522.A N LEU 518.A O no hydrogen 2.790 N/A GLN 523.A N VAL 519.A O no hydrogen 2.831 N/A GLN 523.A NE2 GLU 546.A OE1 no hydrogen 3.430 N/A THR 536.A N ALA 532.A O no hydrogen 3.430 N/A THR 536.A OG1 ALA 532.A O no hydrogen 3.072 N/A THR 537.A N LEU 533.A O no hydrogen 2.951 N/A THR 537.A OG1 LEU 533.A O no hydrogen 3.054 N/A THR 537.A OG1 GLU 534.A O no hydrogen 3.190 N/A TRP 538.A N GLU 534.A O no hydrogen 2.929 N/A ALA 539.A N ALA 535.A O no hydrogen 2.910 N/A LEU 540.A N THR 536.A O no hydrogen 2.952 N/A ARG 541.A N THR 537.A O no hydrogen 2.964 N/A VAL 542.A N TRP 538.A O no hydrogen 2.884 N/A ALA 543.A N ALA 539.A O no hydrogen 2.813 N/A GLU 544.A N LEU 540.A O no hydrogen 2.959 N/A HIS 545.A N ARG 541.A O no hydrogen 2.875 N/A HIS 545.A ND1 GLU 546.A OE2 no hydrogen 2.945 N/A GLU 546.A N VAL 542.A O no hydrogen 2.836 N/A ILE 549.A N ALA 543.A O no hydrogen 3.354 N/A ALA 557.A N SER 554.A OG no hydrogen 2.694 N/A VAL 558.A N SER 554.A O no hydrogen 3.264 N/A MET 559.A N ALA 555.A O no hydrogen 2.999 N/A ALA 560.A N GLN 556.A O no hydrogen 2.784 N/A GLY 561.A N VAL 558.A O no hydrogen 3.167 N/A SER 562.A N ALA 557.A O no hydrogen 3.215 N/A LEU 565.A N GLN 474.A OE1 no hydrogen 3.045 N/A GLY 566.A N ASP 563.A OD2 no hydrogen 2.833 N/A LEU 567.A N ASP 563.A O no hydrogen 2.972 N/A ILE 568.A N PRO 564.A O no hydrogen 2.863 N/A ALA 569.A N LEU 565.A O no hydrogen 2.871 N/A TYR 570.A N GLY 566.A O no hydrogen 2.917 N/A LEU 571.A N LEU 567.A O no hydrogen 2.900 N/A SER 572.A N ILE 568.A O no hydrogen 2.886 N/A SER 572.A OG ILE 568.A O no hydrogen 2.790 N/A HIS 573.A N TYR 570.A O no hydrogen 3.106 N/A HIS 575.A N LEU 571.A O no hydrogen 2.999 N/A SER 576.A N SER 572.A O no hydrogen 2.870 N/A SER 576.A OG SER 572.A O no hydrogen 3.174 N/A ALA 577.A N HIS 573.A O no hydrogen 2.968 N/A PHE 578.A N PHE 574.A O no hydrogen 2.998 N/A LYS 579.A N HIS 575.A O no hydrogen 3.254 N/A THR 581.A N PHE 578.A O no hydrogen 3.258 N/A THR 581.A OG1 PHE 578.A O no hydrogen 2.796 N/A