Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xzl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A ND2 HIS 51.A NE2 no hydrogen 3.380 N/A CYS 3.A N ILE 8.A O no hydrogen 2.910 N/A CYS 3.A SG HIS 35.A ND1 no hydrogen 3.914 N/A ALA 4.A N TRP 23.A O no hydrogen 2.824 N/A TYR 5.A OH GLU 134.A OE2 no hydrogen 2.555 N/A CYS 6.A SG HIS 35.A ND1 no hydrogen 3.950 N/A SER 10.A OG GLU 118.A OE2 no hydrogen 2.922 N/A LYS 12.A N SER 10.A OG no hydrogen 3.363 N/A CYS 13.A N SER 10.A O no hydrogen 3.022 N/A CYS 13.A SG GLU 112.A O no hydrogen 3.545 N/A CYS 13.A SG GLU 118.A OE1 no hydrogen 3.758 N/A VAL 14.A N SER 10.A O no hydrogen 3.244 N/A ILE 15.A N PHE 24.A O no hydrogen 2.641 N/A LYS 16.A N SER 49.A O no hydrogen 2.894 N/A CYS 17.A N LYS 22.A O no hydrogen 2.994 N/A CYS 17.A SG HIS 39.A NE2 no hydrogen 4.005 N/A CYS 17.A SG HIS 45.A ND1 no hydrogen 3.704 N/A ASN 18.A N VAL 47.A O no hydrogen 2.955 N/A CYS 20.A SG HIS 39.A NE2 no hydrogen 3.464 N/A LYS 21.A N CYS 17.A O no hydrogen 2.814 N/A LYS 21.A NZ ASN 18.A O no hydrogen 3.108 N/A PHE 24.A N ILE 15.A O no hydrogen 2.771 N/A CYS 25.A SG THR 27.A OG1 no hydrogen 3.593 N/A CYS 25.A SG HIS 35.A ND1 no hydrogen 3.486 N/A ASN 26.A ND2 LEU 106.A O no hydrogen 2.940 N/A ASN 26.A ND2 ALA 111.A O no hydrogen 3.054 N/A LYS 28.A NZ ASP 103.A O no hydrogen 2.683 N/A THR 31.A OG1 SER 33.A O no hydrogen 2.820 N/A THR 31.A OG1 ASN 38.A OD1 no hydrogen 3.183 N/A SER 33.A N THR 31.A OG1 no hydrogen 3.338 N/A SER 34.A N ARG 104.A O no hydrogen 2.909 N/A SER 34.A OG ASN 26.A OD1 no hydrogen 2.888 N/A SER 34.A OG ARG 104.A O no hydrogen 3.538 N/A HIS 35.A N THR 27.A O no hydrogen 3.065 N/A HIS 35.A NE2 ASN 29.A O no hydrogen 2.873 N/A ILE 36.A N CYS 25.A O no hydrogen 2.971 N/A ASN 38.A N SER 34.A O no hydrogen 2.835 N/A ASN 38.A ND2 TYR 5.A OH no hydrogen 3.239 N/A HIS 39.A N HIS 35.A O no hydrogen 3.093 N/A HIS 39.A ND1 GLU 134.A OE2 no hydrogen 2.482 N/A LEU 40.A N ILE 36.A O no hydrogen 3.083 N/A VAL 41.A N VAL 37.A O no hydrogen 2.958 N/A LEU 42.A N ASN 38.A O no hydrogen 3.228 N/A SER 43.A N HIS 39.A O no hydrogen 2.864 N/A SER 43.A OG HIS 39.A O no hydrogen 2.639 N/A HIS 44.A N LEU 40.A O no hydrogen 2.903 N/A HIS 44.A NE2 LEU 176.A O no hydrogen 2.909 N/A SER 49.A N LYS 16.A O no hydrogen 2.888 N/A SER 49.A OG ASN 18.A OD1 no hydrogen 2.770 N/A LEU 50.A N THR 59.A O no hydrogen 3.074 N/A ASP 53.A N HIS 51.A ND1 no hydrogen 2.829 N/A SER 54.A N HIS 51.A O no hydrogen 2.999 N/A SER 54.A OG HIS 51.A O no hydrogen 2.783 N/A LEU 56.A N SER 54.A OG no hydrogen 3.118 N/A GLY 57.A N SER 54.A O no hydrogen 3.399 N/A THR 59.A OG1 LEU 56.A O no hydrogen 3.077 N/A THR 59.A OG1 GLY 57.A O no hydrogen 3.303 N/A LEU 61.A N VAL 48.A O no hydrogen 3.275 N/A CYS 63.A N ARG 68.A O no hydrogen 2.988 N/A CYS 63.A SG LEU 81.A O no hydrogen 3.626 N/A TYR 64.A N LEU 81.A O no hydrogen 2.760 N/A ARG 68.A NH1 ILE 85.A O no hydrogen 3.130 N/A ASN 70.A ND2 ALA 601.A O no hydrogen 2.866 N/A VAL 71.A N ASN 46.A O no hydrogen 3.215 N/A PHE 72.A N ASN 70.A OD1 no hydrogen 2.903 N/A LEU 73.A N ASN 70.A O no hydrogen 2.960 N/A LEU 74.A N ASN 70.A O no hydrogen 3.316 N/A LEU 74.A N VAL 71.A O no hydrogen 3.143 N/A GLY 75.A N LEU 82.A O no hydrogen 3.033 N/A PHE 76.A N GLN 98.A O no hydrogen 2.781 N/A VAL 77.A N VAL 80.A O no hydrogen 2.955 N/A VAL 80.A N VAL 77.A O no hydrogen 2.857 N/A LEU 82.A N GLY 75.A O no hydrogen 2.884 N/A ARG 84.A N LEU 73.A O no hydrogen 2.793 N/A ARG 84.A NE GLU 598.A OE1 no hydrogen 2.857 N/A ARG 84.A NH1 PHE 72.A O no hydrogen 3.004 N/A ARG 84.A NH2 PHE 72.A O no hydrogen 3.166 N/A ARG 84.A NH2 GLU 598.A OE1 no hydrogen 2.705 N/A ARG 84.A NH2 ILE 599.A O no hydrogen 3.532 N/A GLN 89.A N PRO 86.A O no hydrogen 2.950 N/A GLN 89.A NE2 ARG 84.A O no hydrogen 3.465 N/A THR 90.A N PRO 86.A O no hydrogen 3.241 N/A GLN 96.A N ASP 93.A O no hydrogen 3.387 N/A TRP 97.A N THR 94.A O no hydrogen 3.084 N/A TRP 97.A NE1 LEU 82.A O no hydrogen 2.918 N/A GLN 98.A N PHE 76.A O no hydrogen 3.324 N/A LEU 100.A N LEU 74.A O no hydrogen 2.974 N/A GLU 102.A N GLN 105.A O no hydrogen 2.980 N/A ARG 104.A NE SER 33.A OG no hydrogen 2.665 N/A ARG 104.A NH2 SER 33.A OG no hydrogen 3.189 N/A GLN 105.A N GLU 102.A O no hydrogen 3.381 N/A LEU 106.A N ASN 26.A OD1 no hydrogen 3.064 N/A LEU 107.A N LEU 100.A O no hydrogen 2.981 N/A VAL 110.A N LEU 107.A O no hydrogen 2.865 N/A ALA 111.A N LEU 107.A O no hydrogen 2.968 N/A GLU 112.A N LYS 12.A O no hydrogen 2.811 N/A GLN 113.A NE2 ASN 26.A O no hydrogen 2.779 N/A THR 115.A N GLU 118.A OE1 no hydrogen 2.942 N/A GLU 118.A N THR 115.A OG1 no hydrogen 3.043 N/A LYS 119.A N THR 115.A O no hydrogen 2.923 N/A LEU 120.A N GLU 117.A O no hydrogen 3.212 N/A LYS 121.A N GLU 118.A O no hydrogen 3.238 N/A ALA 122.A N LYS 119.A O no hydrogen 3.077 N/A ARG 123.A N CYS 6.A O no hydrogen 2.824 N/A THR 126.A N GLN 129.A OE1 no hydrogen 2.800 N/A THR 126.A OG1 GLN 129.A OE1 no hydrogen 3.218 N/A GLN 129.A N THR 126.A OG1 no hydrogen 3.056 N/A ILE 130.A N THR 126.A O no hydrogen 3.209 N/A SER 131.A N PRO 127.A O no hydrogen 2.913 N/A LYS 132.A N SER 128.A O no hydrogen 2.995 N/A LEU 133.A N GLN 129.A O no hydrogen 3.134 N/A GLU 134.A N ILE 130.A O no hydrogen 3.271 N/A ALA 135.A N SER 131.A O no hydrogen 3.286 N/A LYS 136.A N LYS 132.A O no hydrogen 2.996 N/A TRP 137.A N LEU 133.A O no hydrogen 3.230 N/A TRP 137.A NE1 ASP 142.A O no hydrogen 2.858 N/A ARG 138.A N ALA 135.A O no hydrogen 3.214 N/A SER 139.A N LYS 136.A O no hydrogen 3.151 N/A SER 139.A OG LYS 136.A O no hydrogen 3.155 N/A ASN 140.A N LYS 136.A O no hydrogen 2.890 N/A LEU 149.A N TYR 152.A OH no hydrogen 2.933 N/A TYR 152.A N LEU 290.A O no hydrogen 2.793 N/A GLN 153.A N GLU 157.A OE1 no hydrogen 2.982 N/A ALA 155.A N TYR 286.A OH no hydrogen 3.268 N/A GLU 157.A N ASP 154.A O no hydrogen 3.144 N/A GLU 157.A N ASP 154.A OD1 no hydrogen 3.025 N/A TYR 158.A N ASP 154.A O no hydrogen 3.131 N/A TYR 158.A OH GLU 485.A OE2 no hydrogen 2.607 N/A GLN 159.A N ALA 155.A O no hydrogen 2.871 N/A ARG 160.A N TYR 156.A O no hydrogen 3.079 N/A SER 161.A N TYR 158.A O no hydrogen 3.187 N/A SER 161.A OG GLU 157.A O no hydrogen 2.928 N/A TYR 162.A N TYR 158.A O no hydrogen 3.195 N/A GLY 163.A N GLN 159.A O no hydrogen 2.800 N/A ILE 166.A N TYR 162.A O no hydrogen 3.001 N/A LYS 167.A N GLY 163.A O no hydrogen 3.121 N/A LYS 167.A NZ ASP 171.A OD2 no hydrogen 3.210 N/A LEU 168.A N PRO 164.A O no hydrogen 3.080 N/A GLU 169.A N LEU 165.A O no hydrogen 3.200 N/A ALA 170.A N ILE 166.A O no hydrogen 2.856 N/A ASP 171.A N LYS 167.A O no hydrogen 2.776 N/A TYR 172.A N LEU 168.A O no hydrogen 2.999 N/A ASP 173.A N GLU 169.A O no hydrogen 2.757 N/A LYS 174.A N ALA 170.A O no hydrogen 2.939 N/A GLN 175.A N ASP 171.A O no hydrogen 3.008 N/A LEU 176.A N TYR 172.A O no hydrogen 2.877 N/A LEU 176.A N ASP 173.A O no hydrogen 3.056 N/A LYS 177.A N ASP 173.A O no hydrogen 2.717 N/A ILE 183.A N PHE 253.A O no hydrogen 2.967 N/A VAL 185.A N THR 250.A O no hydrogen 2.654 N/A SER 186.A N SER 198.A O no hydrogen 3.043 N/A TRP 187.A NE1 LEU 249.A O no hydrogen 3.017 N/A SER 188.A N LEU 196.A O no hydrogen 3.199 N/A ALA 190.A N ARG 194.A O no hydrogen 2.834 N/A LEU 191.A N GLU 429.A OE2 no hydrogen 2.754 N/A ASN 193.A N ALA 190.A O no hydrogen 2.655 N/A LEU 196.A N SER 188.A O no hydrogen 2.926 N/A ALA 197.A N LEU 236.A O no hydrogen 2.854 N/A SER 198.A N SER 186.A O no hydrogen 3.123 N/A SER 198.A OG THR 235.A OG1 no hydrogen 3.034 N/A PHE 199.A N PHE 234.A O no hydrogen 2.962 N/A ALA 203.A N ASP 206.A OD2 no hydrogen 3.240 N/A GLY 205.A N ILE 226.A O no hydrogen 2.776 N/A ASP 206.A N ALA 203.A O no hydrogen 3.167 N/A MET 208.A N GLY 224.A O no hydrogen 2.838 N/A ILE 209.A N GLU 256.A O no hydrogen 2.929 N/A LEU 210.A N GLY 222.A O no hydrogen 2.641 N/A TRP 211.A N THR 254.A O no hydrogen 2.889 N/A TYR 212.A N TRP 220.A O no hydrogen 2.846 N/A SER 213.A OG ASP 219.A OD1 no hydrogen 2.904 N/A GLN 216.A N TYR 212.A OH no hydrogen 2.811 N/A HIS 217.A ND1 PRO 218.A O no hydrogen 2.685 N/A TRP 220.A N TYR 212.A O no hydrogen 3.115 N/A GLY 222.A N LEU 210.A O no hydrogen 2.702 N/A GLY 224.A N MET 208.A O no hydrogen 3.030 N/A TYR 225.A N GLU 237.A O no hydrogen 2.969 N/A ILE 226.A N ASP 206.A O no hydrogen 2.993 N/A VAL 227.A N THR 235.A O no hydrogen 2.827 N/A THR 233.A OG1 PHE 234.A O no hydrogen 3.126 N/A PHE 234.A N PHE 199.A O no hydrogen 3.088 N/A THR 235.A N ARG 228.A O no hydrogen 3.030 N/A THR 235.A OG1 SER 198.A OG no hydrogen 3.034 N/A LEU 236.A N ALA 197.A O no hydrogen 2.680 N/A GLU 237.A N TYR 225.A O no hydrogen 2.817 N/A LEU 238.A N HIS 195.A O no hydrogen 2.935 N/A LYS 239.A N ARG 223.A O no hydrogen 2.815 N/A THR 247.A N PRO 245.A O no hydrogen 2.795 N/A LEU 249.A N PRO 246.A O no hydrogen 3.005 N/A PHE 253.A N ILE 183.A O no hydrogen 3.159 N/A THR 254.A N TRP 211.A O no hydrogen 2.884 N/A GLU 256.A N ILE 209.A O no hydrogen 2.945 N/A ILE 258.A N GLU 207.A O no hydrogen 3.260 N/A TRP 259.A NE1 ASP 173.A OD1 no hydrogen 2.687 N/A TYR 264.A OH ASP 173.A OD2 no hydrogen 3.054 N/A ASP 265.A N GLY 261.A O no hydrogen 2.863 N/A ARG 266.A N THR 262.A O no hydrogen 3.101 N/A ARG 266.A NH1 VAL 461.A O no hydrogen 2.881 N/A MET 267.A N SER 263.A O no hydrogen 3.264 N/A GLN 268.A N TYR 264.A O no hydrogen 3.106 N/A GLN 268.A NE2 GLY 163.A O no hydrogen 3.057 N/A ASP 269.A N ASP 265.A O no hydrogen 3.005 N/A ALA 270.A N ARG 266.A O no hydrogen 3.052 N/A LEU 271.A N MET 267.A O no hydrogen 3.068 N/A LYS 272.A N GLN 268.A O no hydrogen 2.949 N/A LYS 273.A N ASP 269.A O no hydrogen 2.846 N/A LYS 273.A NZ VAL 493.A O no hydrogen 2.953 N/A PHE 274.A N ALA 270.A O no hydrogen 2.879 N/A ALA 275.A N LEU 271.A O no hydrogen 3.130 N/A ILE 276.A N LYS 273.A O no hydrogen 3.230 N/A ASP 277.A N LYS 273.A O no hydrogen 2.700 N/A LYS 279.A N ASP 277.A OD1 no hydrogen 2.869 N/A SER 280.A N ASP 277.A O no hydrogen 3.176 N/A SER 280.A OG LYS 273.A O no hydrogen 3.332 N/A SER 280.A OG ASP 277.A O no hydrogen 2.704 N/A SER 282.A N ALA 496.A O no hydrogen 3.235 N/A TYR 286.A N SER 282.A O no hydrogen 2.885 N/A TYR 287.A N GLY 283.A O no hydrogen 3.089 N/A LYS 288.A N TYR 284.A O no hydrogen 2.924 N/A ILE 289.A N LEU 285.A O no hydrogen 2.915 N/A LEU 290.A N TYR 286.A O no hydrogen 3.096 N/A GLY 291.A N LYS 288.A O no hydrogen 3.014 N/A HIS 292.A N TYR 287.A O no hydrogen 3.044 N/A HIS 292.A NE2 TYR 152.A O no hydrogen 2.630 N/A PHE 299.A N GLN 328.A O no hydrogen 2.859 N/A PHE 312.A N ILE 309.A O no hydrogen 3.088 N/A LEU 315.A N SER 308.A OG no hydrogen 2.844 N/A ASN 316.A N GLN 319.A OE1 no hydrogen 3.052 N/A ASN 316.A ND2 TYR 544.A OH no hydrogen 3.213 N/A SER 318.A OG ASN 316.A OD1 no hydrogen 2.704 N/A GLN 319.A N ASN 316.A OD1 no hydrogen 2.736 N/A GLN 319.A NE2 THR 340.A O no hydrogen 3.203 N/A SER 320.A N ASN 316.A O no hydrogen 2.944 N/A SER 320.A OG ASN 316.A O no hydrogen 2.830 N/A ASN 321.A N SER 317.A O no hydrogen 2.830 N/A ALA 322.A N SER 318.A O no hydrogen 3.002 N/A VAL 323.A N GLN 319.A O no hydrogen 3.072 N/A SER 324.A N SER 320.A O no hydrogen 2.999 N/A HIS 325.A N ASN 321.A O no hydrogen 2.835 N/A HIS 325.A ND1 ASN 321.A O no hydrogen 2.995 N/A VAL 326.A N ALA 322.A O no hydrogen 2.953 N/A LEU 327.A N VAL 323.A O no hydrogen 3.305 N/A GLN 328.A N HIS 325.A O no hydrogen 3.394 N/A GLN 328.A NE2 VAL 301.A O no hydrogen 3.476 N/A ARG 329.A N VAL 326.A O no hydrogen 3.129 N/A ARG 329.A NH1 ILE 297.A O no hydrogen 3.044 N/A SER 332.A N VAL 499.A O no hydrogen 2.896 N/A ILE 334.A N LEU 501.A O no hydrogen 2.847 N/A GLN 335.A N ILE 538.A O no hydrogen 2.789 N/A THR 340.A OG1 PRO 337.A O no hydrogen 2.914 N/A LYS 342.A NZ GLY 336.A O no hydrogen 3.022 N/A LYS 342.A NZ PRO 337.A O no hydrogen 2.863 N/A THR 343.A OG1 ASP 478.A OD2 no hydrogen 2.463 N/A THR 345.A N GLY 341.A O no hydrogen 2.953 N/A THR 345.A OG1 GLY 341.A O no hydrogen 2.705 N/A SER 346.A N LYS 342.A O no hydrogen 3.000 N/A SER 346.A OG LYS 342.A O no hydrogen 2.844 N/A ALA 347.A N THR 343.A O no hydrogen 2.863 N/A THR 348.A N VAL 344.A O no hydrogen 3.045 N/A THR 348.A OG1 VAL 344.A O no hydrogen 2.877 N/A ILE 349.A N THR 345.A O no hydrogen 2.963 N/A VAL 350.A N SER 346.A O no hydrogen 2.910 N/A TYR 351.A N ALA 347.A O no hydrogen 2.980 N/A HIS 352.A N THR 348.A O no hydrogen 2.956 N/A HIS 352.A NE2 PHE 307.A O no hydrogen 2.772 N/A LEU 353.A N ILE 349.A O no hydrogen 2.835 N/A SER 354.A N VAL 350.A O no hydrogen 2.957 N/A LYS 355.A N TYR 351.A O no hydrogen 3.256 N/A ILE 356.A N HIS 352.A O no hydrogen 3.025 N/A HIS 357.A N LEU 353.A O no hydrogen 3.024 N/A LYS 358.A N SER 354.A O no hydrogen 2.773 N/A ARG 360.A NH1 LEU 450.A O no hydrogen 3.104 N/A ARG 360.A NH1 THR 470.A OG1 no hydrogen 3.382 N/A ARG 360.A NH2 THR 470.A OG1 no hydrogen 2.722 N/A ARG 360.A NH2 LYS 471.A O no hydrogen 3.031 N/A ILE 361.A N ASP 454.A O no hydrogen 3.148 N/A LEU 362.A N THR 474.A O no hydrogen 2.970 N/A VAL 363.A N VAL 456.A O no hydrogen 2.820 N/A CYS 364.A N LEU 476.A O no hydrogen 2.912 N/A ALA 370.A N SER 367.A OG no hydrogen 3.410 N/A VAL 371.A N SER 367.A O no hydrogen 3.302 N/A ASP 372.A N ASN 368.A O no hydrogen 3.028 N/A HIS 373.A N VAL 369.A O no hydrogen 3.012 N/A LEU 374.A N ALA 370.A O no hydrogen 3.119 N/A ALA 375.A N VAL 371.A O no hydrogen 2.894 N/A ALA 376.A N ASP 372.A O no hydrogen 2.934 N/A LYS 377.A N HIS 373.A O no hydrogen 3.227 N/A LEU 378.A N LEU 374.A O no hydrogen 3.053 N/A ARG 379.A N ALA 375.A O no hydrogen 2.951 N/A ASP 380.A N ALA 376.A O no hydrogen 2.975 N/A LEU 381.A N LYS 377.A O no hydrogen 3.202 N/A LEU 381.A N LEU 378.A O no hydrogen 3.199 N/A GLY 382.A N ARG 379.A O no hydrogen 3.031 N/A LEU 383.A N LEU 378.A O no hydrogen 3.353 N/A LYS 384.A N ASP 454.A OD2 no hydrogen 2.745 N/A VAL 386.A N VAL 455.A O no hydrogen 2.905 N/A ARG 387.A N LEU 403.A O no hydrogen 2.794 N/A ARG 387.A NE ASP 372.A OD1 no hydrogen 2.841 N/A ARG 387.A NH1 LEU 388.A O no hydrogen 3.061 N/A ARG 387.A NH2 ASN 368.A OD1 no hydrogen 3.017 N/A ARG 387.A NH2 ASP 372.A OD1 no hydrogen 2.626 N/A LEU 388.A N CYS 457.A O no hydrogen 2.883 N/A ARG 393.A N ALA 390.A O no hydrogen 2.983 N/A GLU 394.A N LYS 391.A O no hydrogen 3.441 N/A VAL 396.A N ARG 393.A O no hydrogen 2.932 N/A SER 398.A OG ASP 372.A OD2 no hydrogen 3.014 N/A VAL 400.A N SER 398.A OG no hydrogen 3.081 N/A SER 401.A OG SER 398.A O no hydrogen 3.368 N/A LEU 403.A N VAL 400.A O no hydrogen 2.875 N/A ALA 404.A N SER 401.A O no hydrogen 3.055 N/A LEU 405.A N ARG 387.A O no hydrogen 3.002 N/A LEU 408.A N ALA 404.A O no hydrogen 2.873 N/A VAL 409.A N LEU 405.A O no hydrogen 2.905 N/A GLY 410.A N HIS 406.A O no hydrogen 3.427 N/A ARG 411.A N ASN 407.A O no hydrogen 2.954 N/A ASN 419.A N GLY 415.A O no hydrogen 3.212 N/A LEU 420.A N GLU 416.A O no hydrogen 3.052 N/A LEU 421.A N LEU 417.A O no hydrogen 2.974 N/A LYS 422.A N LYS 418.A O no hydrogen 3.085 N/A LEU 423.A N ASN 419.A O no hydrogen 2.955 N/A LYS 424.A N LEU 420.A O no hydrogen 3.066 N/A ASP 425.A N LEU 421.A O no hydrogen 2.967 N/A GLU 426.A N LYS 422.A O no hydrogen 2.843 N/A VAL 427.A N LEU 423.A O no hydrogen 2.803 N/A ASP 434.A N SER 431.A OG no hydrogen 3.346 N/A THR 435.A N SER 431.A O no hydrogen 2.842 N/A THR 435.A N ALA 432.A O no hydrogen 3.236 N/A THR 435.A OG1 SER 431.A O no hydrogen 2.661 N/A LYS 436.A N ALA 432.A O no hydrogen 3.173 N/A ARG 437.A N SER 433.A O no hydrogen 3.195 N/A PHE 438.A N ASP 434.A O no hydrogen 2.751 N/A VAL 439.A N THR 435.A O no hydrogen 2.861 N/A LYS 440.A N LYS 436.A O no hydrogen 3.258 N/A LEU 441.A N ARG 437.A O no hydrogen 3.196 N/A VAL 442.A N PHE 438.A O no hydrogen 2.963 N/A ARG 443.A N VAL 439.A O no hydrogen 3.132 N/A LYS 444.A N LYS 440.A O no hydrogen 3.178 N/A THR 445.A N LEU 441.A O no hydrogen 3.000 N/A THR 445.A OG1 LEU 441.A O no hydrogen 2.950 N/A GLU 446.A N VAL 442.A O no hydrogen 2.701 N/A ALA 447.A N ARG 443.A O no hydrogen 2.966 N/A GLU 448.A N LYS 444.A O no hydrogen 3.192 N/A ILE 449.A N THR 445.A O no hydrogen 3.030 N/A LEU 450.A N GLU 446.A O no hydrogen 2.900 N/A ASN 451.A N ALA 447.A O no hydrogen 2.843 N/A LYS 452.A N GLU 448.A O no hydrogen 3.317 N/A LYS 452.A N ILE 449.A O no hydrogen 3.313 N/A ASP 454.A N LYS 384.A O no hydrogen 2.981 N/A VAL 455.A N LYS 384.A O no hydrogen 3.107 N/A VAL 456.A N ILE 361.A O no hydrogen 2.893 N/A CYS 457.A N VAL 386.A O no hydrogen 2.843 N/A CYS 458.A N VAL 363.A O no hydrogen 3.076 N/A CYS 458.A SG THR 459.A O no hydrogen 3.369 N/A CYS 460.A N ALA 365.A O no hydrogen 3.134 N/A GLY 462.A N THR 459.A OG1 no hydrogen 3.011 N/A ALA 463.A N THR 459.A O no hydrogen 2.920 N/A ALA 463.A N CYS 460.A O no hydrogen 3.172 N/A GLY 464.A N VAL 461.A O no hydrogen 2.835 N/A ASP 465.A N GLY 462.A O no hydrogen 2.953 N/A ARG 467.A N ASP 465.A OD1 no hydrogen 2.711 N/A ARG 467.A NE GLU 446.A OE2 no hydrogen 3.075 N/A ARG 467.A NH1 ASP 465.A OD1 no hydrogen 3.184 N/A ARG 467.A NH1 ASP 465.A OD2 no hydrogen 2.689 N/A LEU 468.A N ASP 465.A O no hydrogen 3.139 N/A PHE 472.A N LYS 494.A O no hydrogen 2.813 N/A VAL 475.A N GLN 498.A O no hydrogen 2.935 N/A LEU 476.A N LEU 362.A O no hydrogen 3.000 N/A ILE 477.A N ILE 500.A O no hydrogen 2.872 N/A ASP 478.A N CYS 364.A O no hydrogen 2.860 N/A GLU 479.A N ASP 478.A OD1 no hydrogen 2.687 N/A SER 480.A N VAL 502.A O no hydrogen 2.833 N/A SER 480.A OG VAL 502.A O no hydrogen 2.634 N/A THR 481.A OG1 ASP 504.A O no hydrogen 3.454 N/A GLN 482.A N GLU 479.A O no hydrogen 2.998 N/A GLN 482.A NE2 ASP 669.A O no hydrogen 3.398 N/A ALA 483.A N SER 480.A O no hydrogen 3.119 N/A GLU 487.A N SER 484.A O no hydrogen 3.177 N/A CYS 488.A N SER 484.A O no hydrogen 3.237 N/A CYS 488.A SG SER 480.A O no hydrogen 3.754 N/A LEU 489.A N GLU 485.A O no hydrogen 3.098 N/A LEU 489.A N PRO 486.A O no hydrogen 3.252 N/A ILE 490.A N GLU 487.A O no hydrogen 3.339 N/A ILE 492.A N LEU 489.A O no hydrogen 3.080 N/A VAL 493.A N LEU 489.A O no hydrogen 3.043 N/A LYS 494.A NZ LEU 468.A O no hydrogen 2.732 N/A GLY 495.A N SER 280.A O no hydrogen 2.709 N/A LYS 497.A N ARG 473.A O no hydrogen 2.621 N/A GLN 498.A N ARG 473.A O no hydrogen 3.029 N/A GLN 498.A NE2 VAL 326.A O no hydrogen 3.168 N/A GLN 498.A NE2 ARG 329.A O no hydrogen 3.084 N/A VAL 499.A N PRO 330.A O no hydrogen 2.639 N/A ILE 500.A N VAL 475.A O no hydrogen 2.884 N/A LEU 501.A N SER 332.A O no hydrogen 2.809 N/A VAL 502.A N ILE 477.A O no hydrogen 2.992 N/A GLY 503.A N ILE 334.A O no hydrogen 3.012 N/A ASP 504.A N THR 481.A OG1 no hydrogen 2.951 N/A GLN 506.A N ASP 504.A OD1 no hydrogen 2.989 N/A GLN 506.A NE2 PHE 558.A O no hydrogen 3.181 N/A GLN 507.A N ASP 504.A O no hydrogen 2.989 N/A GLN 507.A NE2 ASP 504.A OD2 no hydrogen 2.901 N/A LEU 508.A N GLN 672.A OE1 no hydrogen 3.171 N/A GLU 514.A N GLU 169.A OE2 no hydrogen 2.542 N/A LYS 516.A N GLU 514.A OE2 no hydrogen 2.702 N/A ALA 518.A N GLU 514.A O no hydrogen 2.987 N/A ASP 519.A N ARG 515.A O no hydrogen 2.649 N/A ALA 520.A N LYS 516.A O no hydrogen 2.981 N/A GLY 521.A N ALA 518.A O no hydrogen 3.105 N/A LEU 522.A N ALA 517.A O no hydrogen 3.101 N/A GLN 524.A N GLY 521.A O no hydrogen 3.272 N/A SER 525.A N GLU 528.A OE1 no hydrogen 2.852 N/A SER 525.A OG GLU 528.A OE1 no hydrogen 2.842 N/A GLU 528.A N SER 525.A OG no hydrogen 3.326 N/A ARG 529.A N SER 525.A O no hydrogen 3.121 N/A ARG 529.A NE GLU 485.A OE1 no hydrogen 2.793 N/A ARG 529.A NH1 ILE 289.A O no hydrogen 3.073 N/A ARG 529.A NH2 ILE 289.A O no hydrogen 2.640 N/A ARG 529.A NH2 GLU 485.A OE2 no hydrogen 2.568 N/A LEU 530.A N LEU 526.A O no hydrogen 3.022 N/A ILE 531.A N PHE 527.A O no hydrogen 3.349 N/A SER 532.A N GLU 528.A O no hydrogen 2.889 N/A SER 532.A OG ARG 529.A O no hydrogen 2.943 N/A GLY 534.A N ILE 531.A O no hydrogen 2.915 N/A HIS 535.A N LEU 530.A O no hydrogen 3.125 N/A ILE 538.A N LEU 333.A O no hydrogen 2.824 N/A LEU 540.A N GLN 335.A O no hydrogen 2.809 N/A GLN 543.A N GLN 564.A O no hydrogen 2.904 N/A GLN 543.A NE2 MET 546.A O no hydrogen 3.419 N/A TYR 544.A N GLY 339.A O no hydrogen 2.897 N/A ARG 545.A NE GLU 675.A OE1 no hydrogen 2.755 N/A ARG 545.A NH1 THR 706.A O no hydrogen 2.824 N/A ASN 547.A N LYS 709.A O no hydrogen 2.979 N/A ASN 547.A ND2 ARG 572.A O no hydrogen 3.146 N/A TYR 549.A N ASN 547.A OD1 no hydrogen 2.825 N/A LEU 550.A N ASN 547.A O no hydrogen 2.726 N/A SER 551.A OG PRO 548.A O no hydrogen 3.046 N/A SER 555.A N SER 551.A O no hydrogen 2.965 N/A SER 555.A OG LEU 563.A O no hydrogen 3.356 N/A ASN 556.A N GLU 552.A O no hydrogen 3.005 N/A MET 557.A N PHE 553.A O no hydrogen 2.795 N/A PHE 558.A N PRO 554.A O no hydrogen 2.990 N/A TYR 559.A N SER 555.A O no hydrogen 3.167 N/A TYR 559.A OH ASP 504.A OD2 no hydrogen 2.449 N/A GLY 561.A N SER 555.A O no hydrogen 2.817 N/A SER 562.A N TYR 559.A O no hydrogen 2.827 N/A SER 562.A OG TYR 559.A O no hydrogen 2.631 N/A GLN 564.A N GLU 541.A O no hydrogen 2.982 N/A ASN 565.A ND2 GLN 543.A OE1 no hydrogen 3.111 N/A ASN 565.A ND2 SER 551.A OG no hydrogen 2.767 N/A GLY 566.A N GLN 543.A O no hydrogen 2.680 N/A THR 568.A N GLN 571.A OE1 no hydrogen 2.924 N/A THR 568.A OG1 GLN 571.A OE1 no hydrogen 3.546 N/A GLN 571.A N THR 568.A OG1 no hydrogen 3.324 N/A ARG 572.A N THR 568.A O no hydrogen 3.064 N/A ARG 572.A N ILE 569.A O no hydrogen 3.185 N/A ARG 572.A NE ARG 545.A O no hydrogen 2.711 N/A ARG 572.A NH1 GLN 571.A O no hydrogen 3.085 N/A ARG 572.A NH2 TYR 544.A O no hydrogen 2.891 N/A ARG 572.A NH2 ARG 545.A O no hydrogen 3.569 N/A SER 577.A N VAL 574.A O no hydrogen 3.157 N/A SER 577.A OG ASP 625.A OD2 no hydrogen 2.766 N/A LYS 578.A N ASP 625.A OD1 no hydrogen 3.083 N/A LYS 578.A N ASP 625.A OD2 no hydrogen 3.407 N/A TRP 581.A N PHE 579.A O no hydrogen 2.711 N/A ILE 586.A N ILE 583.A O no hydrogen 3.151 N/A MET 589.A N LEU 712.A O no hydrogen 3.111 N/A PHE 590.A N CYS 739.A O no hydrogen 2.946 N/A TRP 591.A N ILE 714.A O no hydrogen 2.777 N/A TRP 591.A NE1 GLY 743.A O no hydrogen 2.963 N/A ALA 592.A N VAL 741.A O no hydrogen 2.766 N/A ASN 593.A N GLY 716.A O no hydrogen 2.739 N/A TYR 594.A OH GLU 742.A OE1 no hydrogen 2.548 N/A GLU 597.A N ALA 686.A O no hydrogen 2.918 N/A GLU 598.A N LEU 607.A O no hydrogen 2.822 N/A SER 600.A N SER 605.A O no hydrogen 2.969 N/A SER 600.A OG ASN 602.A OD1 no hydrogen 2.793 N/A GLY 603.A N SER 600.A O no hydrogen 2.987 N/A THR 604.A N ASN 602.A OD1 no hydrogen 3.191 N/A PHE 606.A N SER 605.A OG no hydrogen 2.741 N/A LEU 607.A N GLU 598.A O no hydrogen 2.900 N/A ASN 608.A N GLN 641.A OE1 no hydrogen 2.803 N/A ASN 608.A ND2 VAL 684.A O no hydrogen 2.948 N/A ARG 609.A NE GLU 598.A OE2 no hydrogen 2.667 N/A ARG 609.A NH2 GLU 598.A OE2 no hydrogen 3.197 N/A GLU 611.A N ASN 608.A OD1 no hydrogen 3.094 N/A ALA 612.A N ASN 608.A O no hydrogen 2.923 N/A MET 613.A N ARG 609.A O no hydrogen 2.850 N/A ASN 614.A N ILE 610.A O no hydrogen 3.023 N/A ASN 614.A ND2 ASN 593.A OD1 no hydrogen 2.855 N/A CYS 615.A N GLU 611.A O no hydrogen 3.010 N/A GLU 616.A N ALA 612.A O no hydrogen 3.269 N/A GLU 616.A N MET 613.A O no hydrogen 3.063 N/A ARG 617.A N MET 613.A O no hydrogen 3.287 N/A ARG 617.A NH1 ASN 614.A OD1 no hydrogen 3.419 N/A ILE 618.A N ASN 614.A O no hydrogen 2.932 N/A ILE 619.A N CYS 615.A O no hydrogen 3.102 N/A THR 620.A N GLU 616.A O no hydrogen 2.931 N/A THR 620.A OG1 GLU 616.A O no hydrogen 2.913 N/A THR 620.A OG1 GLU 616.A OE2 no hydrogen 2.636 N/A THR 620.A OG1 TYR 660.A OH no hydrogen 2.833 N/A LYS 621.A N ARG 617.A O no hydrogen 2.915 N/A LEU 622.A N ILE 618.A O no hydrogen 2.859 N/A PHE 623.A N ILE 619.A O no hydrogen 2.727 N/A ARG 624.A N THR 620.A O no hydrogen 2.896 N/A ASP 625.A N LYS 621.A O no hydrogen 3.019 N/A GLY 626.A N PHE 623.A O no hydrogen 2.861 N/A VAL 627.A N LEU 622.A O no hydrogen 2.912 N/A LYS 628.A N GLN 631.A OE1 no hydrogen 2.918 N/A GLN 631.A N LYS 628.A O no hydrogen 2.785 N/A GLN 631.A NE2 ASP 677.A OD2 no hydrogen 3.008 N/A ILE 632.A N PRO 629.A O no hydrogen 3.160 N/A GLY 633.A N TYR 678.A O no hydrogen 2.876 N/A VAL 634.A N GLU 664.A O no hydrogen 2.690 N/A ILE 635.A N ILE 680.A O no hydrogen 2.951 N/A THR 636.A N ALA 666.A O no hydrogen 2.922 N/A THR 636.A OG1 SER 682.A O no hydrogen 2.996 N/A GLY 640.A N SER 605.A OG no hydrogen 3.130 N/A GLN 641.A NE2 ASN 608.A O no hydrogen 3.281 N/A GLN 641.A NE2 SER 682.A OG no hydrogen 2.945 N/A ARG 642.A N TYR 638.A O no hydrogen 2.964 N/A ALA 643.A N GLU 639.A O no hydrogen 3.018 N/A TYR 644.A N GLY 640.A O no hydrogen 3.134 N/A ILE 645.A N GLN 641.A O no hydrogen 2.895 N/A LEU 646.A N ARG 642.A O no hydrogen 3.220 N/A GLN 647.A N ALA 643.A O no hydrogen 3.068 N/A TYR 648.A N TYR 644.A O no hydrogen 2.748 N/A MET 649.A N ILE 645.A O no hydrogen 3.209 N/A GLN 650.A N LEU 646.A O no hydrogen 3.351 N/A GLN 650.A NE2 LYS 657.A O no hydrogen 3.112 N/A MET 651.A N TYR 648.A O no hydrogen 3.168 N/A ASN 652.A N TYR 648.A O no hydrogen 2.798 N/A ASN 652.A ND2 GLN 89.A OE1 no hydrogen 3.281 N/A ASN 652.A ND2 TYR 648.A O no hydrogen 3.551 N/A GLY 653.A N MET 649.A O no hydrogen 2.835 N/A SER 654.A N GLU 616.A OE2 no hydrogen 3.009 N/A SER 654.A OG GLU 616.A OE2 no hydrogen 3.022 N/A LEU 655.A N TYR 660.A OH no hydrogen 2.981 N/A LYS 657.A NZ GLY 653.A O no hydrogen 2.770 N/A ASP 658.A N ASP 656.A OD1 no hydrogen 2.932 N/A LEU 659.A N ASP 656.A O no hydrogen 2.887 N/A TYR 660.A N LYS 657.A O no hydrogen 3.142 N/A TYR 660.A OH THR 620.A OG1 no hydrogen 2.833 N/A VAL 663.A N TYR 660.A O no hydrogen 3.212 N/A ALA 666.A N VAL 634.A O no hydrogen 2.800 N/A VAL 668.A N THR 636.A O no hydrogen 2.981 N/A ALA 670.A N SER 667.A OG no hydrogen 2.956 N/A PHE 671.A N SER 667.A O no hydrogen 2.934 N/A PHE 671.A N VAL 668.A O no hydrogen 2.958 N/A GLN 672.A N ASP 669.A O no hydrogen 3.437 N/A ARG 674.A N PHE 671.A O no hydrogen 3.013 N/A LYS 676.A N ARG 707.A O no hydrogen 2.993 N/A LYS 676.A NZ GLU 630.A O no hydrogen 3.329 N/A LYS 676.A NZ GLU 664.A OE1 no hydrogen 2.715 N/A TYR 678.A N GLN 631.A O no hydrogen 2.921 N/A ILE 679.A N GLY 711.A O no hydrogen 2.991 N/A ILE 680.A N GLY 633.A O no hydrogen 2.949 N/A LEU 681.A N VAL 713.A O no hydrogen 2.755 N/A SER 682.A N ILE 635.A O no hydrogen 3.118 N/A SER 682.A OG GLU 611.A OE1 no hydrogen 2.681 N/A CYS 683.A N LEU 715.A O no hydrogen 2.927 N/A CYS 683.A SG LEU 715.A O no hydrogen 3.321 N/A VAL 684.A N GLU 611.A OE1 no hydrogen 2.673 N/A VAL 684.A N GLU 611.A OE2 no hydrogen 3.242 N/A ARG 685.A N CYS 683.A O no hydrogen 2.738 N/A ARG 685.A NE TYR 638.A OH no hydrogen 2.917 N/A ARG 685.A NH1 GLU 597.A OE1 no hydrogen 3.135 N/A ALA 686.A N GLU 597.A OE1 no hydrogen 2.991 N/A ASN 687.A ND2 GLU 597.A OE1 no hydrogen 2.987 N/A ASN 687.A ND2 GLU 597.A OE2 no hydrogen 3.235 N/A ASN 687.A ND2 ALA 691.A O no hydrogen 2.859 N/A GLN 690.A N ASN 687.A O no hydrogen 3.114 N/A GLN 690.A NE2 ARG 719.A O no hydrogen 2.576 N/A ALA 691.A N ASN 687.A OD1 no hydrogen 2.981 N/A LEU 695.A N ILE 692.A O no hydrogen 3.162 N/A ARG 696.A N GLY 693.A O no hydrogen 3.197 N/A ASP 697.A N PHE 694.A O no hydrogen 3.280 N/A ARG 699.A N ASP 697.A OD1 no hydrogen 3.039 N/A ARG 699.A NH1 HIS 505.A O no hydrogen 2.992 N/A ARG 700.A N ASP 697.A O no hydrogen 2.926 N/A ARG 700.A NE ASP 669.A OD1 no hydrogen 3.117 N/A ARG 700.A NH1 PHE 694.A O no hydrogen 2.800 N/A ARG 700.A NH2 ASP 669.A OD1 no hydrogen 3.456 N/A ARG 700.A NH2 ASP 669.A OD2 no hydrogen 3.211 N/A LEU 701.A N ASP 697.A O no hydrogen 3.448 N/A ASN 702.A N PRO 698.A O no hydrogen 3.001 N/A ASN 702.A ND2 GLN 506.A O no hydrogen 2.982 N/A ASN 702.A ND2 TYR 559.A OH no hydrogen 2.878 N/A VAL 703.A N ARG 699.A O no hydrogen 3.274 N/A GLY 704.A N ARG 700.A O no hydrogen 3.074 N/A LEU 705.A N LEU 701.A O no hydrogen 2.982 N/A LEU 705.A N ASN 702.A O no hydrogen 3.216 N/A THR 706.A N VAL 703.A O no hydrogen 3.228 N/A THR 706.A OG1 ASN 702.A O no hydrogen 3.050 N/A THR 706.A OG1 VAL 703.A O no hydrogen 3.308 N/A ARG 707.A NE VAL 703.A O no hydrogen 3.012 N/A ARG 707.A NH1 ARG 674.A O no hydrogen 2.828 N/A ARG 707.A NH2 THR 706.A OG1 no hydrogen 2.793 N/A LYS 709.A N LYS 676.A O no hydrogen 2.975 N/A LYS 709.A NZ ASP 677.A OD1 no hydrogen 3.270 N/A TYR 710.A N ASP 677.A O no hydrogen 2.789 N/A GLY 711.A N ASP 677.A O no hydrogen 3.119 N/A LEU 712.A N PRO 587.A O no hydrogen 3.085 N/A VAL 713.A N ILE 679.A O no hydrogen 2.897 N/A ILE 714.A N MET 589.A O no hydrogen 2.883 N/A LEU 715.A N LEU 681.A O no hydrogen 2.735 N/A GLY 716.A N TRP 591.A O no hydrogen 3.423 N/A ASN 717.A ND2 GLY 595.A O no hydrogen 3.196 N/A ARG 719.A N ASN 717.A OD1 no hydrogen 3.054 N/A SER 720.A N ASN 717.A O no hydrogen 3.283 N/A SER 720.A OG ARG 685.A O no hydrogen 3.228 N/A SER 720.A OG ASN 717.A O no hydrogen 3.298 N/A LEU 721.A N ASN 717.A O no hydrogen 3.170 N/A ALA 722.A N PRO 718.A O no hydrogen 2.919 N/A ASN 724.A N LEU 721.A O no hydrogen 3.110 N/A TRP 727.A N ASN 724.A OD1 no hydrogen 3.116 N/A TRP 727.A NE1 LEU 695.A O no hydrogen 2.821 N/A ASN 728.A N ASN 724.A O no hydrogen 2.961 N/A HIS 729.A N THR 725.A O no hydrogen 3.079 N/A LEU 730.A N LEU 726.A O no hydrogen 3.178 N/A LEU 731.A N TRP 727.A O no hydrogen 3.010 N/A ILE 732.A N ASN 728.A O no hydrogen 3.015 N/A HIS 733.A N HIS 729.A O no hydrogen 2.954 N/A PHE 734.A N LEU 730.A O no hydrogen 2.970 N/A ARG 735.A N LEU 731.A O no hydrogen 2.813 N/A ARG 735.A NH1 LEU 755.A O no hydrogen 3.441 N/A GLU 736.A N ILE 732.A O no hydrogen 2.913 N/A LYS 737.A N PHE 734.A O no hydrogen 3.153 N/A LYS 737.A NZ GLU 552.A OE1 no hydrogen 3.424 N/A LYS 737.A NZ GLU 552.A OE2 no hydrogen 3.509 N/A GLY 738.A N ARG 735.A O no hydrogen 3.107 N/A CYS 739.A N PHE 734.A O no hydrogen 2.800 N/A CYS 739.A SG MET 588.A O no hydrogen 3.484 N/A CYS 739.A SG LYS 737.A O no hydrogen 3.909 N/A VAL 741.A N PHE 590.A O no hydrogen 2.961 N/A GLU 742.A N GLN 749.A O no hydrogen 2.682 N/A ASN 747.A N THR 744.A O no hydrogen 2.834 N/A GLN 749.A N GLU 742.A O no hydrogen 2.823 N/A GLN 749.A NE2 ASN 747.A O no hydrogen 3.434 N/A GLN 749.A NE2 ASN 747.A OD1 no hydrogen 3.283 N/A CYS 751.A N LEU 740.A O no hydrogen 2.923 N/A CYS 751.A SG TYR 594.A OH no hydrogen 3.349 N/A CYS 751.A SG GLU 742.A OE1 no hydrogen 3.512 N/A THR 752.A N GLU 742.A OE1 no hydrogen 2.987 N/A THR 752.A OG1 GLU 742.A OE1 no hydrogen 3.362 N/A THR 752.A OG1 GLU 742.A OE2 no hydrogen 2.939 N/A