Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ux2_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N ASN 2.A O no hydrogen 3.084 N/A GLY 7.A N MET 3.A O no hydrogen 2.882 N/A ARG 9.A NH1 TYR 288.A O no hydrogen 2.869 N/A ARG 9.A NH2 TYR 288.A O no hydrogen 2.719 N/A ILE 10.A N ILE 6.A O no hydrogen 2.984 N/A GLU 11.A N GLY 7.A O no hydrogen 2.875 N/A ARG 12.A N ARG 8.A O no hydrogen 2.884 N/A ILE 13.A N ARG 9.A O no hydrogen 3.002 N/A ARG 14.A N ILE 10.A O no hydrogen 2.889 N/A ASN 15.A N GLU 11.A O no hydrogen 2.865 N/A GLU 16.A N ARG 12.A O no hydrogen 2.937 N/A HIS 17.A N ARG 14.A O no hydrogen 3.136 N/A PHE 22.A N SER 37.A O no hydrogen 3.280 N/A ASP 24.A N TYR 34.A OH no hydrogen 2.895 N/A ASN 26.A N ASP 24.A OD1 no hydrogen 2.495 N/A TYR 29.A OH ASP 309.A OD2 no hydrogen 2.789 N/A ARG 30.A N ASP 89.A OD2 no hydrogen 3.121 N/A THR 31.A N ASP 89.A OD2 no hydrogen 3.361 N/A TRP 32.A NE1 VAL 88.A O no hydrogen 3.395 N/A TYR 34.A OH SER 37.A OG no hydrogen 2.565 N/A HIS 35.A N ILE 310.A O no hydrogen 3.050 N/A SER 37.A N PHE 22.A O no hydrogen 3.029 N/A SER 37.A OG TYR 34.A OH no hydrogen 2.565 N/A SER 37.A OG ASP 309.A OD1 no hydrogen 2.448 N/A TYR 38.A N MET 308.A O no hydrogen 2.951 N/A ALA 40.A N THR 306.A O no hydrogen 2.908 N/A SER 45.A N THR 75.A OG1 no hydrogen 3.092 N/A SER 48.A N ALA 71.A O no hydrogen 3.062 N/A ASN 51.A N ARG 457.A O no hydrogen 2.506 N/A ASN 51.A ND2 THR 469.A O no hydrogen 3.170 N/A VAL 54.A N ASN 51.A OD1 no hydrogen 2.841 N/A ARG 55.A N ASN 51.A O no hydrogen 3.292 N/A LEU 56.A N GLY 52.A O no hydrogen 2.923 N/A LEU 57.A N VAL 53.A O no hydrogen 2.899 N/A SER 58.A N VAL 54.A O no hydrogen 2.715 N/A SER 58.A OG VAL 54.A O no hydrogen 2.350 N/A ASP 62.A N LYS 59.A O no hydrogen 3.250 N/A VAL 63.A N PRO 60.A O no hydrogen 3.314 N/A THR 68.A N THR 65.A O no hydrogen 3.189 N/A THR 68.A OG1 THR 65.A O no hydrogen 3.177 N/A GLY 69.A N THR 65.A O no hydrogen 2.918 N/A ALA 71.A N THR 68.A O no hydrogen 2.996 N/A MET 72.A N GLY 69.A O no hydrogen 3.348 N/A THR 75.A N SER 45.A O no hydrogen 2.762 N/A THR 75.A OG1 SER 45.A O no hydrogen 3.515 N/A GLN 80.A N THR 76.A O no hydrogen 2.932 N/A GLN 80.A NE2 THR 75.A O no hydrogen 2.702 N/A GLN 81.A N PRO 77.A O no hydrogen 2.894 N/A GLN 81.A NE2 TYR 29.A OH no hydrogen 3.428 N/A ARG 82.A N TYR 78.A O no hydrogen 2.928 N/A VAL 83.A N GLY 79.A O no hydrogen 2.917 N/A PHE 84.A N GLN 80.A O no hydrogen 2.894 N/A LYS 85.A N GLN 81.A O no hydrogen 2.900 N/A GLU 86.A N ARG 82.A O no hydrogen 2.953 N/A LYS 87.A N VAL 83.A O no hydrogen 2.862 N/A VAL 88.A N PHE 84.A O no hydrogen 3.056 N/A ASP 89.A N PHE 84.A O no hydrogen 2.829 N/A THR 90.A N VAL 88.A O no hydrogen 2.737 N/A GLN 96.A N ASP 401.A OD2 no hydrogen 2.809 N/A GLN 96.A NE2 ASP 401.A OD1 no hydrogen 3.007 N/A GLY 98.A N TRP 353.A O no hydrogen 2.924 N/A THR 99.A N LEU 352.A O no hydrogen 3.145 N/A THR 99.A OG1 ASP 401.A OD2 no hydrogen 2.794 N/A ARG 100.A N GLN 96.A O no hydrogen 2.933 N/A ARG 100.A NH2 PRO 95.A O no hydrogen 2.802 N/A GLN 101.A N GLU 97.A O no hydrogen 2.924 N/A VAL 102.A N GLY 98.A O no hydrogen 2.913 N/A MET 103.A N THR 99.A O no hydrogen 2.902 N/A ASN 104.A N ARG 100.A O no hydrogen 2.892 N/A ILE 105.A N GLN 101.A O no hydrogen 2.954 N/A VAL 106.A N VAL 102.A O no hydrogen 2.934 N/A SER 107.A N MET 103.A O no hydrogen 2.870 N/A SER 107.A OG MET 103.A O no hydrogen 2.568 N/A SER 108.A N ASN 104.A O no hydrogen 2.909 N/A TRP 109.A N ILE 105.A O no hydrogen 2.951 N/A LEU 110.A N VAL 106.A O no hydrogen 2.889 N/A TRP 111.A N SER 107.A O no hydrogen 2.880 N/A LYS 112.A N SER 108.A O no hydrogen 2.936 N/A GLU 113.A N TRP 109.A O no hydrogen 2.898 N/A LEU 114.A N LEU 110.A O no hydrogen 2.878 N/A GLY 115.A N TRP 111.A O no hydrogen 3.260 N/A GLY 115.A N LYS 112.A O no hydrogen 3.249 N/A LYS 116.A N GLU 113.A O no hydrogen 3.192 N/A LYS 116.A NZ GLU 113.A OE2 no hydrogen 3.123 N/A LYS 118.A NZ ASP 212.A O no hydrogen 2.977 N/A ARG 121.A NE ASP 212.A OD1 no hydrogen 3.062 N/A ARG 121.A NH1 VAL 122.A O no hydrogen 2.549 N/A ARG 121.A NH1 GLU 127.A OE1 no hydrogen 2.860 N/A ARG 121.A NH2 ASP 212.A OD1 no hydrogen 2.983 N/A CYS 123.A SG PHE 203.A O no hydrogen 3.611 N/A ILE 129.A N LYS 125.A O no hydrogen 2.844 N/A ASN 130.A N GLU 126.A O no hydrogen 2.985 N/A LYS 131.A N GLU 127.A O no hydrogen 3.036 N/A VAL 132.A N PHE 128.A O no hydrogen 3.110 N/A ILE 137.A N GLY 135.A O no hydrogen 2.832 N/A ALA 150.A N THR 146.A O no hydrogen 3.133 N/A VAL 151.A N ALA 147.A O no hydrogen 2.905 N/A ASN 152.A ND2 VAL 148.A O no hydrogen 3.355 N/A ASP 153.A N ALA 150.A O no hydrogen 3.232 N/A ARG 155.A NH1 ASP 153.A OD2 no hydrogen 3.043 N/A PHE 156.A N ASP 153.A OD1 no hydrogen 3.092 N/A TRP 157.A NE1 VAL 151.A O no hydrogen 2.682 N/A ALA 158.A N PRO 154.A O no hydrogen 2.915 N/A LEU 159.A N ARG 155.A O no hydrogen 2.905 N/A VAL 160.A N PHE 156.A O no hydrogen 2.926 N/A ASP 161.A N TRP 157.A O no hydrogen 2.853 N/A ARG 162.A N ALA 158.A O no hydrogen 2.967 N/A ARG 164.A N VAL 160.A O no hydrogen 2.924 N/A GLU 165.A N ASP 161.A O no hydrogen 2.903 N/A HIS 166.A N ARG 162.A O no hydrogen 2.949 N/A HIS 167.A N GLU 163.A O no hydrogen 2.892 N/A LEU 168.A N ARG 164.A O no hydrogen 2.915 N/A ARG 169.A N GLU 165.A O no hydrogen 2.859 N/A GLY 170.A N HIS 167.A O no hydrogen 3.303 N/A GLU 171.A N HIS 166.A O no hydrogen 2.736 N/A CYS 172.A SG GLU 163.A OE2 no hydrogen 3.169 N/A CYS 172.A SG HIS 167.A NE2 no hydrogen 3.299 N/A HIS 173.A N GLU 163.A OE1 no hydrogen 3.243 N/A HIS 173.A N GLU 163.A OE2 no hydrogen 2.763 N/A SER 174.A N GLU 163.A OE2 no hydrogen 3.244 N/A SER 174.A OG GLU 163.A OE1 no hydrogen 3.255 N/A CYS 175.A SG HIS 167.A NE2 no hydrogen 3.631 N/A TYR 177.A N VAL 294.A O no hydrogen 2.873 N/A MET 179.A N LYS 296.A O no hydrogen 3.140 N/A MET 180.A N ILE 191.A O no hydrogen 2.892 N/A LYS 182.A N ARG 189.A O no hydrogen 3.057 N/A ARG 183.A NE ASP 74.A OD1 no hydrogen 3.400 N/A ARG 183.A NE ASP 74.A OD2 no hydrogen 3.490 N/A SER 188.A N LYS 186.A O no hydrogen 2.856 N/A ILE 191.A N MET 180.A O no hydrogen 2.886 N/A ARG 199.A N TRP 195.A O no hydrogen 3.062 N/A ARG 199.A NH1 GLY 135.A O no hydrogen 3.061 N/A PHE 200.A N LEU 196.A O no hydrogen 2.896 N/A LEU 201.A N GLY 197.A O no hydrogen 2.925 N/A GLU 202.A N ALA 198.A O no hydrogen 2.947 N/A PHE 203.A N ARG 199.A O no hydrogen 2.835 N/A GLU 204.A N PHE 200.A O no hydrogen 2.867 N/A ALA 205.A N LEU 201.A O no hydrogen 2.972 N/A LEU 206.A N GLU 202.A O no hydrogen 2.892 N/A LEU 206.A N PHE 203.A O no hydrogen 3.178 N/A GLY 207.A N PHE 203.A O no hydrogen 2.805 N/A LEU 209.A N LEU 206.A O no hydrogen 3.199 N/A ASN 210.A N GLY 207.A O no hydrogen 2.810 N/A ASN 210.A ND2 VAL 322.A O no hydrogen 2.843 N/A GLU 211.A N GLY 207.A O no hydrogen 2.855 N/A ASP 212.A N PHE 208.A O no hydrogen 2.998 N/A HIS 213.A N ASN 210.A O no hydrogen 3.145 N/A TRP 214.A N LEU 209.A O no hydrogen 3.050 N/A GLY 216.A N HIS 213.A O no hydrogen 3.057 N/A ARG 217.A NE GLY 223.A O no hydrogen 3.161 N/A ASN 219.A ND2 LEU 114.A O no hydrogen 3.014 N/A ASN 219.A ND2 TRP 214.A O no hydrogen 3.187 N/A SER 220.A N GLY 216.A O no hydrogen 2.721 N/A SER 220.A OG MET 215.A O no hydrogen 3.098 N/A SER 220.A OG GLY 216.A O no hydrogen 2.372 N/A GLY 221.A N ARG 217.A O no hydrogen 2.798 N/A GLY 223.A N SER 220.A OG no hydrogen 2.932 N/A LEU 227.A N VAL 224.A O no hydrogen 3.201 N/A LEU 229.A N HIS 516.A O no hydrogen 3.128 N/A GLN 230.A N GLN 230.A OE1 no hydrogen 2.737 N/A ARG 231.A N GLY 228.A O no hydrogen 3.191 N/A ARG 231.A NH1 GLU 538.A O no hydrogen 3.354 N/A ARG 231.A NH2 VAL 534.A O no hydrogen 2.791 N/A ARG 231.A NH2 GLU 538.A O no hydrogen 3.138 N/A ILE 235.A N ARG 231.A O no hydrogen 3.034 N/A LEU 236.A N LEU 232.A O no hydrogen 2.902 N/A GLU 237.A N GLY 233.A O no hydrogen 2.923 N/A GLU 238.A N TYR 234.A O no hydrogen 2.932 N/A MET 239.A N ILE 235.A O no hydrogen 2.956 N/A ASN 240.A N LEU 236.A O no hydrogen 2.906 N/A ARG 241.A N GLU 237.A O no hydrogen 3.007 N/A ALA 242.A N MET 239.A O no hydrogen 3.205 N/A LYS 246.A N ASP 390.A OD1 no hydrogen 2.772 N/A LYS 246.A NZ ASP 390.A OD2 no hydrogen 3.556 N/A MET 247.A N TRP 418.A O no hydrogen 3.223 N/A TYR 248.A N VAL 385.A O no hydrogen 2.886 N/A TYR 248.A OH ASP 390.A OD1 no hydrogen 2.881 N/A ALA 253.A N VAL 405.A O no hydrogen 3.093 N/A TRP 255.A NE1 ASN 328.A OD1 no hydrogen 2.664 N/A ARG 258.A N GLY 254.A O no hydrogen 3.213 N/A ARG 258.A N TRP 255.A O no hydrogen 2.936 N/A SER 260.A N ASP 263.A OD2 no hydrogen 2.860 N/A SER 260.A OG ASP 263.A OD2 no hydrogen 3.211 N/A ASP 263.A N SER 260.A OG no hydrogen 3.268 N/A LEU 264.A N SER 260.A O no hydrogen 3.365 N/A GLU 265.A N LYS 261.A O no hydrogen 2.881 N/A ASN 266.A N PHE 262.A O no hydrogen 2.879 N/A GLU 267.A N ASP 263.A O no hydrogen 2.901 N/A ALA 268.A N LEU 264.A O no hydrogen 2.905 N/A LEU 269.A N ASN 266.A O no hydrogen 3.475 N/A ILE 270.A N GLU 267.A O no hydrogen 3.492 N/A THR 271.A N ALA 268.A O no hydrogen 3.097 N/A THR 271.A OG1 ALA 268.A O no hydrogen 2.543 N/A THR 271.A OG1 ASN 272.A OD1 no hydrogen 3.257 N/A ASN 272.A N LEU 269.A O no hydrogen 3.172 N/A GLN 273.A N ILE 270.A O no hydrogen 3.141 N/A GLN 273.A NE2 TRP 111.A O no hydrogen 2.796 N/A HIS 278.A NE2 ARG 121.A O no hydrogen 2.721 N/A ARG 279.A N GLU 275.A O no hydrogen 2.514 N/A ARG 279.A NE THR 271.A O no hydrogen 2.871 N/A THR 280.A N GLU 276.A O no hydrogen 2.898 N/A THR 280.A OG1 GLU 276.A O no hydrogen 3.343 N/A THR 280.A OG1 GLY 277.A O no hydrogen 2.292 N/A LEU 281.A N GLY 277.A O no hydrogen 3.025 N/A ALA 282.A N HIS 278.A O no hydrogen 2.924 N/A LEU 283.A N ARG 279.A O no hydrogen 2.860 N/A ALA 284.A N THR 280.A O no hydrogen 2.942 N/A VAL 285.A N LEU 281.A O no hydrogen 2.993 N/A ILE 286.A N ALA 282.A O no hydrogen 2.881 N/A LYS 287.A N LEU 283.A O no hydrogen 2.920 N/A TYR 288.A N ALA 284.A O no hydrogen 2.910 N/A TYR 290.A N ILE 286.A O no hydrogen 2.821 N/A TYR 290.A OH GLU 202.A OE2 no hydrogen 2.224 N/A GLN 291.A N ILE 286.A O no hydrogen 2.796 N/A ASN 292.A ND2 LYS 287.A O no hydrogen 2.769 N/A LYS 293.A N ARG 313.A O no hydrogen 2.931 N/A LYS 293.A NZ TYR 290.A O no hydrogen 3.040 N/A LYS 293.A NZ GLN 316.A O no hydrogen 2.357 N/A VAL 295.A N ILE 311.A O no hydrogen 2.840 N/A LYS 296.A N TYR 177.A O no hydrogen 3.079 N/A VAL 297.A N ASP 309.A O no hydrogen 2.986 N/A ARG 299.A N VAL 307.A O no hydrogen 2.881 N/A ARG 299.A NE ASP 309.A OD2 no hydrogen 2.466 N/A ARG 299.A NH1 ASP 24.A OD2 no hydrogen 3.237 N/A ARG 299.A NH2 ASP 24.A OD2 no hydrogen 3.255 N/A ARG 299.A NH2 ASP 309.A OD1 no hydrogen 2.857 N/A ARG 299.A NH2 ASP 309.A OD2 no hydrogen 3.262 N/A ALA 301.A N LYS 305.A O no hydrogen 3.029 N/A THR 306.A OG1 ALA 40.A O no hydrogen 2.649 N/A VAL 307.A N ARG 299.A O no hydrogen 2.915 N/A MET 308.A N TYR 38.A O no hydrogen 2.848 N/A ASP 309.A N VAL 297.A O no hydrogen 2.843 N/A ILE 310.A N GLY 36.A O no hydrogen 2.964 N/A ILE 311.A N VAL 295.A O no hydrogen 2.880 N/A SER 312.A OG LYS 293.A O no hydrogen 3.229 N/A ARG 313.A N LYS 293.A O no hydrogen 2.938 N/A GLN 316.A NE2 VAL 88.A O no hydrogen 3.041 N/A ARG 317.A N ASP 256.A O no hydrogen 3.262 N/A ARG 317.A NH1 ASN 328.A OD1 no hydrogen 2.953 N/A ARG 317.A NH2 GLU 267.A OE1 no hydrogen 2.243 N/A GLY 318.A N GLN 321.A OE1 no hydrogen 2.811 N/A SER 319.A OG ALA 190.A O no hydrogen 2.998 N/A GLY 320.A N TRP 192.A O no hydrogen 2.502 N/A THR 324.A N GLN 321.A O no hydrogen 3.446 N/A THR 324.A OG1 GLY 318.A O no hydrogen 3.176 N/A LEU 327.A N VAL 323.A O no hydrogen 3.229 N/A ASN 328.A N THR 324.A O no hydrogen 2.934 N/A ASN 328.A ND2 ASP 256.A OD1 no hydrogen 3.293 N/A THR 329.A N TYR 325.A O no hydrogen 2.889 N/A THR 329.A OG1 TYR 325.A O no hydrogen 2.825 N/A PHE 330.A N ALA 326.A O no hydrogen 2.920 N/A THR 331.A N LEU 327.A O no hydrogen 2.918 N/A THR 331.A OG1 GLU 267.A OE2 no hydrogen 2.339 N/A THR 331.A OG1 LEU 327.A O no hydrogen 3.052 N/A ASN 332.A N ASN 328.A O no hydrogen 2.915 N/A ASN 332.A ND2 GLY 380.A O no hydrogen 2.989 N/A ASN 332.A ND2 ASP 382.A O no hydrogen 3.670 N/A LEU 333.A N THR 329.A O no hydrogen 2.882 N/A VAL 334.A N PHE 330.A O no hydrogen 2.978 N/A VAL 335.A N THR 331.A O no hydrogen 2.901 N/A GLN 336.A N ASN 332.A O no hydrogen 2.899 N/A LEU 337.A N LEU 333.A O no hydrogen 2.932 N/A ILE 338.A N VAL 334.A O no hydrogen 2.942 N/A ARG 339.A N VAL 335.A O no hydrogen 2.930 N/A ARG 339.A NE PHE 392.A O no hydrogen 3.319 N/A ARG 339.A NE ALA 395.A O no hydrogen 3.072 N/A ARG 339.A NH1 ASP 250.A OD2 no hydrogen 3.367 N/A ARG 339.A NH2 PHE 392.A O no hydrogen 3.125 N/A ARG 339.A NH2 SER 415.A OG no hydrogen 3.077 N/A ASN 340.A N GLN 336.A O no hydrogen 2.870 N/A MET 341.A N LEU 337.A O no hydrogen 2.950 N/A GLU 342.A N ILE 338.A O no hydrogen 2.933 N/A ALA 343.A N ARG 339.A O no hydrogen 2.895 N/A GLU 344.A N ASN 340.A O no hydrogen 2.940 N/A GLU 345.A N GLU 342.A O no hydrogen 3.283 N/A LEU 347.A N MET 341.A O no hydrogen 3.262 N/A GLU 348.A N ASP 351.A OD2 no hydrogen 3.490 N/A ASP 351.A N GLU 348.A O no hydrogen 3.249 N/A LEU 352.A N MET 349.A O no hydrogen 3.196 N/A TRP 353.A N GLN 350.A O no hydrogen 3.277 N/A LEU 354.A N GLN 350.A O no hydrogen 3.508 N/A LYS 360.A N LYS 357.A O no hydrogen 3.186 N/A LYS 360.A NZ ASP 351.A OD2 no hydrogen 3.282 N/A VAL 361.A N PRO 358.A O no hydrogen 2.922 N/A THR 362.A N PRO 358.A O no hydrogen 3.339 N/A THR 362.A OG1 GLU 359.A O no hydrogen 2.710 N/A ARG 363.A N GLU 359.A O no hydrogen 2.755 N/A TRP 364.A N LYS 360.A O no hydrogen 3.453 N/A TRP 364.A NE1 GLU 344.A OE2 no hydrogen 3.133 N/A LEU 365.A N VAL 361.A O no hydrogen 3.140 N/A GLN 366.A N THR 362.A O no hydrogen 2.783 N/A SER 367.A N ARG 363.A O no hydrogen 2.675 N/A ASN 368.A N TRP 364.A O no hydrogen 2.479 N/A GLY 369.A N TRP 364.A O no hydrogen 3.091 N/A ARG 372.A N ASN 368.A O no hydrogen 3.205 N/A ARG 372.A NE GLU 344.A OE1 no hydrogen 2.471 N/A ARG 372.A NH1 ASP 371.A OD2 no hydrogen 3.097 N/A ARG 372.A NH2 GLU 344.A OE1 no hydrogen 2.508 N/A ARG 372.A NH2 GLU 344.A OE2 no hydrogen 2.513 N/A LEU 373.A N GLY 369.A O no hydrogen 3.105 N/A LYS 374.A N TRP 370.A O no hydrogen 3.131 N/A ARG 375.A N ASP 371.A O no hydrogen 3.223 N/A ARG 375.A N ARG 372.A O no hydrogen 3.004 N/A ALA 377.A N VAL 384.A O no hydrogen 2.851 N/A VAL 378.A N GLY 222.A O no hydrogen 2.818 N/A SER 379.A N ASP 382.A O no hydrogen 2.867 N/A SER 379.A OG HIS 516.A NE2 no hydrogen 2.545 N/A GLY 380.A N THR 329.A OG1 no hydrogen 2.951 N/A ASP 382.A N SER 379.A O no hydrogen 2.941 N/A CYS 383.A SG ASP 250.A O no hydrogen 3.728 N/A CYS 383.A SG GLN 336.A OE1 no hydrogen 3.301 N/A VAL 384.A N ALA 377.A O no hydrogen 2.911 N/A VAL 385.A N TYR 248.A O no hydrogen 2.899 N/A LYS 386.A N ARG 375.A O no hydrogen 2.811 N/A LYS 386.A NZ ASN 240.A O no hydrogen 2.794 N/A LYS 386.A NZ ASN 240.A OD1 no hydrogen 3.269 N/A LYS 386.A NZ ALA 242.A O no hydrogen 3.274 N/A ARG 391.A N ASP 389.A OD1 no hydrogen 3.101 N/A ARG 391.A NE ASP 389.A OD1 no hydrogen 2.948 N/A ARG 391.A NE ASP 389.A OD2 no hydrogen 2.978 N/A ARG 391.A NH2 ASP 389.A OD2 no hydrogen 2.670 N/A ALA 393.A N ASP 390.A O no hydrogen 2.927 N/A HIS 394.A N ARG 391.A O no hydrogen 2.939 N/A ALA 395.A N PHE 392.A O no hydrogen 3.473 N/A ARG 397.A N GLU 342.A OE1 no hydrogen 2.778 N/A PHE 398.A N GLU 342.A OE2 no hydrogen 3.069 N/A ASN 400.A N LEU 396.A O no hydrogen 2.884 N/A ASN 400.A ND2 GLU 411.A O no hydrogen 2.983 N/A ASP 401.A N ARG 397.A O no hydrogen 2.910 N/A MET 402.A N PHE 398.A O no hydrogen 3.104 N/A GLY 403.A N ASN 400.A O no hydrogen 2.881 N/A LYS 404.A N LEU 399.A O no hydrogen 3.132 N/A LYS 404.A NZ ASP 263.A OD1 no hydrogen 3.418 N/A LYS 404.A NZ ASP 263.A OD2 no hydrogen 2.381 N/A LYS 404.A NZ MET 402.A O no hydrogen 3.516 N/A ARG 406.A NH1 LYS 413.A O no hydrogen 2.744 N/A ARG 406.A NH1 SER 415.A OG no hydrogen 2.641 N/A ARG 406.A NH2 GLU 411.A O no hydrogen 2.971 N/A ARG 406.A NH2 LYS 413.A O no hydrogen 2.598 N/A LYS 407.A N ASP 251.A O no hydrogen 2.515 N/A THR 409.A OG1 LYS 407.A O no hydrogen 3.510 N/A THR 409.A OG1 ASP 408.A O no hydrogen 2.623 N/A LYS 413.A N GLN 410.A O no hydrogen 3.396 N/A SER 415.A N ALA 393.A O no hydrogen 3.037 N/A SER 415.A OG ASP 250.A OD2 no hydrogen 2.273 N/A TRP 418.A N MET 247.A O no hydrogen 2.790 N/A GLU 422.A N ASN 420.A OD1 no hydrogen 3.400 N/A GLU 423.A N ASN 420.A O no hydrogen 3.067 N/A PHE 426.A N HIS 429.A O no hydrogen 2.736 N/A CYS 427.A N ASP 382.A OD2 no hydrogen 2.515 N/A HIS 429.A N PHE 426.A O no hydrogen 3.257 N/A HIS 429.A ND1 CYS 427.A O no hydrogen 2.566 N/A HIS 429.A NE2 TYR 484.A OH no hydrogen 2.528 N/A HIS 430.A N CYS 446.A O no hydrogen 2.902 N/A ASN 432.A N VAL 444.A O no hydrogen 2.925 N/A LYS 433.A N GLU 422.A OE2 no hydrogen 2.704 N/A LEU 434.A N ILE 442.A O no hydrogen 2.912 N/A LEU 436.A N ARG 440.A O no hydrogen 3.020 N/A GLY 439.A N LEU 436.A O no hydrogen 3.220 N/A ARG 440.A NH1 THR 546.A O no hydrogen 3.084 N/A ARG 440.A NH2 THR 546.A O no hydrogen 2.875 N/A ILE 442.A N LEU 434.A O no hydrogen 2.880 N/A VAL 443.A N TYR 234.A OH no hydrogen 3.462 N/A VAL 444.A N ASN 432.A O no hydrogen 2.884 N/A CYS 446.A N HIS 430.A O no hydrogen 2.884 N/A CYS 446.A SG HIS 430.A NE2 no hydrogen 3.664 N/A CYS 446.A SG ARG 447.A O no hydrogen 3.698 N/A ARG 447.A NE GLU 451.A OE2 no hydrogen 2.891 N/A ARG 447.A NH2 GLU 451.A OE2 no hydrogen 3.146 N/A GLN 449.A N CYS 565.A O no hydrogen 3.055 N/A ASP 450.A N HIS 448.A ND1 no hydrogen 3.134 N/A LEU 452.A N HIS 448.A O no hydrogen 3.341 N/A ILE 453.A N GLN 449.A O no hydrogen 2.904 N/A GLY 454.A N ASP 450.A O no hydrogen 2.895 N/A ARG 455.A N GLU 451.A O no hydrogen 2.914 N/A ALA 456.A N ILE 453.A O no hydrogen 2.970 N/A ARG 457.A N GLY 454.A O no hydrogen 3.069 N/A ARG 457.A NE SER 58.A OG no hydrogen 3.025 N/A ARG 457.A NH2 SER 58.A OG no hydrogen 2.774 N/A ARG 457.A NH2 ASP 62.A OD1 no hydrogen 2.498 N/A SER 459.A N LEU 49.A O no hydrogen 2.797 N/A THR 469.A N SER 465.A O no hydrogen 3.296 N/A ALA 470.A N ILE 466.A O no hydrogen 2.941 N/A CYS 471.A N ARG 467.A O no hydrogen 3.111 N/A CYS 471.A SG VAL 506.A O no hydrogen 2.561 N/A LEU 472.A N GLU 468.A O no hydrogen 3.045 N/A ALA 473.A N THR 469.A O no hydrogen 3.030 N/A LYS 474.A N ALA 470.A O no hydrogen 3.152 N/A LYS 474.A NZ PRO 502.A O no hydrogen 3.064 N/A SER 475.A N CYS 471.A O no hydrogen 3.064 N/A SER 475.A OG CYS 471.A O no hydrogen 2.582 N/A SER 475.A OG LEU 472.A O no hydrogen 3.398 N/A SER 475.A OG THR 508.A O no hydrogen 2.698 N/A TYR 476.A N LEU 472.A O no hydrogen 2.944 N/A TYR 476.A OH THR 511.A O no hydrogen 3.094 N/A ALA 477.A N ALA 473.A O no hydrogen 2.906 N/A GLN 478.A N LYS 474.A O no hydrogen 2.945 N/A GLN 478.A NE2 THR 523.A O no hydrogen 3.459 N/A MET 479.A N SER 475.A O no hydrogen 2.893 N/A TRP 480.A N TYR 476.A O no hydrogen 2.933 N/A GLN 481.A N ALA 477.A O no hydrogen 2.910 N/A LEU 482.A N GLN 478.A O no hydrogen 2.950 N/A LEU 483.A N MET 479.A O no hydrogen 2.888 N/A TYR 484.A N TRP 480.A O no hydrogen 2.693 N/A TYR 484.A OH HIS 429.A NE2 no hydrogen 2.528 N/A HIS 486.A NE2 PRO 445.A O no hydrogen 2.533 N/A ARG 487.A N TYR 484.A O no hydrogen 3.286 N/A ARG 487.A NE ASP 562.A OD1 no hydrogen 2.754 N/A ARG 487.A NH1 ARG 447.A O no hydrogen 2.746 N/A ARG 487.A NH2 CYS 565.A O no hydrogen 2.471 N/A ARG 488.A N ASP 562.A OD2 no hydrogen 3.292 N/A ARG 488.A NH2 ASP 562.A OD2 no hydrogen 3.433 N/A ARG 491.A N ARG 487.A O no hydrogen 2.988 N/A ARG 491.A NE PHE 485.A O no hydrogen 2.724 N/A ARG 491.A NH1 TRP 551.A O no hydrogen 2.616 N/A ARG 491.A NH2 PHE 485.A O no hydrogen 3.188 N/A ARG 491.A NH2 ILE 554.A O no hydrogen 3.143 N/A LEU 492.A N ARG 488.A O no hydrogen 2.949 N/A MET 493.A N ASP 489.A O no hydrogen 2.871 N/A ALA 494.A N LEU 490.A O no hydrogen 2.866 N/A ASN 495.A N ARG 491.A O no hydrogen 2.970 N/A ALA 496.A N LEU 492.A O no hydrogen 2.907 N/A ILE 497.A N MET 493.A O no hydrogen 2.834 N/A CYS 498.A N ALA 494.A O no hydrogen 2.951 N/A CYS 498.A SG ALA 494.A O no hydrogen 3.471 N/A SER 499.A OG ASN 495.A O no hydrogen 2.906 N/A SER 499.A OG ALA 496.A O no hydrogen 2.507 N/A ALA 500.A N ALA 496.A O no hydrogen 2.886 N/A VAL 501.A N ILE 497.A O no hydrogen 2.889 N/A TRP 505.A N PRO 502.A O no hydrogen 3.460 N/A THR 508.A N CYS 471.A O no hydrogen 3.123 N/A HIS 516.A N SER 514.A OG no hydrogen 3.354 N/A HIS 516.A ND1 LEU 227.A O no hydrogen 2.726 N/A HIS 516.A NE2 SER 379.A OG no hydrogen 2.545 N/A GLY 517.A N SER 514.A O no hydrogen 3.013 N/A GLU 520.A N GLU 520.A OE1 no hydrogen 2.498 N/A GLU 525.A N THR 523.A OG1 no hydrogen 3.077 N/A MET 529.A N ASP 526.A OD2 no hydrogen 3.281 N/A VAL 530.A N ASP 526.A O no hydrogen 3.082 N/A TRP 531.A N MET 527.A O no hydrogen 2.877 N/A ASN 532.A N LEU 528.A O no hydrogen 2.877 N/A ASN 532.A ND2 VAL 548.A O no hydrogen 3.660 N/A ARG 533.A N MET 529.A O no hydrogen 2.895 N/A VAL 534.A N VAL 530.A O no hydrogen 2.917 N/A TRP 535.A N TRP 531.A O no hydrogen 2.885 N/A TRP 535.A NE1 LEU 482.A O no hydrogen 2.883 N/A ILE 536.A N ASN 532.A O no hydrogen 2.935 N/A GLU 537.A N ASN 532.A O no hydrogen 2.701 N/A GLU 538.A N ARG 533.A O no hydrogen 2.843 N/A ASN 539.A ND2 TYR 234.A OH no hydrogen 3.196 N/A ASN 539.A ND2 TRP 535.A O no hydrogen 2.917 N/A HIS 541.A N ASN 539.A OD1 no hydrogen 2.984 N/A MET 542.A N ASN 539.A O no hydrogen 3.277 N/A VAL 548.A N ASN 532.A OD1 no hydrogen 3.378 N/A ASP 553.A N LYS 550.A O no hydrogen 2.665 N/A ILE 554.A N TRP 551.A O no hydrogen 3.056 N/A LEU 557.A N HIS 486.A O no hydrogen 3.026 N/A ASP 562.A N GLY 558.A O no hydrogen 3.001 N/A LEU 563.A N LYS 559.A O no hydrogen 2.883 N/A TRP 564.A N ARG 560.A O no hydrogen 2.931 N/A CYS 565.A N GLU 561.A O no hydrogen 2.911 N/A CYS 565.A SG HIS 430.A NE2 no hydrogen 2.914 N/A GLY 566.A N LEU 563.A O no hydrogen 3.411 N/A SER 567.A N ASP 562.A O no hydrogen 3.068 N/A LEU 568.A N ASP 489.A OD2 no hydrogen 3.216 N/A HIS 571.A N LEU 568.A O no hydrogen 3.085 N/A ARG 574.A NE ASP 489.A OD1 no hydrogen 2.956 N/A ARG 574.A NH1 ARG 574.A O no hydrogen 3.485 N/A ARG 574.A NH2 ASP 489.A OD1 no hydrogen 3.408 N/A THR 575.A N HIS 571.A O no hydrogen 2.761 N/A THR 575.A OG1 HIS 571.A O no hydrogen 2.846 N/A THR 576.A N ARG 572.A O no hydrogen 2.925 N/A THR 576.A OG1 ARG 572.A O no hydrogen 3.117 N/A TRP 577.A N PRO 573.A O no hydrogen 2.858 N/A TRP 577.A NE1 LEU 57.A O no hydrogen 2.775 N/A ALA 578.A N ARG 574.A O no hydrogen 2.899 N/A GLU 579.A N THR 575.A O no hydrogen 2.894 N/A ASN 580.A N THR 576.A O no hydrogen 2.904 N/A ILE 581.A N ALA 578.A O no hydrogen 3.414 N/A THR 584.A N ASN 580.A O no hydrogen 2.875 N/A THR 584.A OG1 ASN 580.A O no hydrogen 2.684 N/A VAL 585.A N ILE 581.A O no hydrogen 2.852 N/A ASN 586.A N LYS 582.A O no hydrogen 2.958 N/A MET 587.A N ASP 583.A O no hydrogen 2.922 N/A VAL 588.A N THR 584.A O no hydrogen 2.869 N/A VAL 588.A N VAL 585.A O no hydrogen 3.261 N/A ARG 589.A N VAL 585.A O no hydrogen 2.866 N/A ARG 590.A N ASN 586.A O no hydrogen 3.252 N/A GLY 593.A N ARG 589.A O no hydrogen 3.391 N/A TYR 596.A OH GLU 594.A OE1 no hydrogen 2.454 N/A MET 597.A SD ASP 598.A O no hydrogen 3.742 N/A