Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8zdx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD1 no hydrogen 2.577 N/A ASP 1.A N HIS 496.A NE2 no hydrogen 3.328 N/A SER 2.A OG ASP 1.A O no hydrogen 3.389 N/A TYR 6.A N SER 532.A OG no hydrogen 2.864 N/A THR 7.A N ASP 10.A OD2 no hydrogen 2.887 N/A TYR 11.A OH HIS 711.A NE2 no hydrogen 2.940 N/A LEU 12.A N LEU 8.A O no hydrogen 3.025 N/A LYS 13.A N THR 9.A O no hydrogen 2.765 N/A LYS 13.A NZ GLN 712.A OE1 no hydrogen 3.003 N/A THR 15.A N ASP 10.A O no hydrogen 3.240 N/A LYS 19.A N ASN 460.A OD1 no hydrogen 3.137 N/A TYR 21.A OH TYR 31.A OH no hydrogen 2.616 N/A ARG 24.A N LEU 32.A O no hydrogen 2.916 N/A ARG 24.A NH1 TYR 68.A O no hydrogen 3.331 N/A TRP 25.A NE1 SER 423.A O no hydrogen 3.228 N/A ILE 26.A N GLU 30.A O no hydrogen 2.954 N/A SER 27.A N GLU 30.A O no hydrogen 3.202 N/A SER 27.A OG GLU 30.A OE1 no hydrogen 2.749 N/A HIS 29.A N SER 27.A OG no hydrogen 3.091 N/A HIS 29.A ND1 ASP 28.A OD1 no hydrogen 3.081 N/A GLU 30.A N SER 27.A OG no hydrogen 3.027 N/A TYR 31.A N PHE 42.A O no hydrogen 3.122 N/A TYR 31.A OH TYR 21.A OH no hydrogen 2.616 N/A LEU 32.A N ARG 24.A O no hydrogen 2.925 N/A TYR 33.A N LEU 40.A O no hydrogen 3.204 N/A GLN 35.A N ASN 38.A O no hydrogen 2.982 N/A ASN 38.A N GLN 35.A O no hydrogen 2.816 N/A ASN 38.A ND2 GLN 35.A O no hydrogen 3.613 N/A ASN 38.A ND2 ASN 55.A OD1 no hydrogen 2.857 N/A ILE 39.A N LEU 53.A O no hydrogen 2.588 N/A LEU 40.A N TYR 33.A O no hydrogen 2.751 N/A VAL 41.A N SER 50.A O no hydrogen 2.790 N/A PHE 42.A N TYR 31.A O no hydrogen 2.686 N/A ASN 43.A N ASN 48.A O no hydrogen 3.268 N/A ALA 44.A N HIS 29.A O no hydrogen 2.615 N/A GLU 45.A N ASN 43.A OD1 no hydrogen 3.194 N/A TYR 46.A N ASN 43.A OD1 no hydrogen 3.393 N/A GLY 47.A N ASN 43.A O no hydrogen 2.605 N/A SER 50.A OG SER 49.A O no hydrogen 2.798 N/A PHE 52.A N ILE 39.A O no hydrogen 2.947 N/A LEU 53.A N ILE 39.A O no hydrogen 2.709 N/A ASN 55.A N ASN 38.A OD1 no hydrogen 3.275 N/A SER 56.A N GLU 54.A OE1 no hydrogen 2.890 N/A PHE 58.A N ASN 55.A O no hydrogen 3.316 N/A ASP 59.A N SER 56.A O no hydrogen 3.476 N/A PHE 61.A N PHE 58.A O no hydrogen 3.487 N/A ASN 66.A N GLU 80.A O no hydrogen 2.748 N/A TYR 68.A N ASP 67.A OD1 no hydrogen 2.555 N/A SER 69.A N LEU 78.A O no hydrogen 2.974 N/A SER 71.A N PHE 76.A O no hydrogen 3.102 N/A SER 71.A OG ASP 73.A OD1 no hydrogen 2.633 N/A SER 71.A OG PHE 76.A O no hydrogen 3.158 N/A GLY 74.A N SER 71.A O no hydrogen 2.849 N/A GLN 75.A N ASP 73.A OD1 no hydrogen 3.535 N/A PHE 76.A N SER 71.A OG no hydrogen 3.265 N/A ILE 77.A N TYR 98.A O no hydrogen 3.263 N/A LEU 78.A N SER 69.A O no hydrogen 2.597 N/A LEU 79.A N ASP 96.A O no hydrogen 3.024 N/A GLU 80.A N ASP 67.A O no hydrogen 3.065 N/A TYR 81.A N SER 94.A O no hydrogen 2.995 N/A TYR 81.A OH ASP 96.A OD2 no hydrogen 2.963 N/A TYR 83.A N ASN 66.A OD1 no hydrogen 3.412 N/A VAL 84.A N THR 92.A O no hydrogen 3.053 N/A LYS 85.A NZ TRP 87.A O no hydrogen 3.267 N/A GLN 86.A N SER 90.A O no hydrogen 2.914 N/A TRP 87.A N SER 90.A OG no hydrogen 2.915 N/A ARG 88.A NH1 GLU 168.A OE2 no hydrogen 2.726 N/A HIS 89.A N GLU 167.A OE2 no hydrogen 3.134 N/A SER 90.A OG GLN 86.A OE1 no hydrogen 3.517 N/A SER 90.A OG GLU 167.A OE1 no hydrogen 3.299 N/A SER 90.A OG GLU 167.A OE2 no hydrogen 2.983 N/A TYR 91.A OH GLU 80.A OE1 no hydrogen 2.973 N/A THR 92.A N VAL 84.A O no hydrogen 3.252 N/A ALA 93.A N THR 115.A O no hydrogen 3.220 N/A SER 94.A N TYR 81.A O no hydrogen 2.830 N/A SER 94.A OG ASN 113.A OD1 no hydrogen 3.439 N/A ASP 96.A N LEU 79.A O no hydrogen 3.148 N/A TYR 98.A N ILE 77.A O no hydrogen 3.235 N/A ASP 99.A N GLN 104.A O no hydrogen 3.160 N/A LEU 100.A N GLN 75.A O no hydrogen 3.176 N/A ARG 103.A NH2 THR 57.A OG1 no hydrogen 3.385 N/A ILE 106.A N ILE 97.A O no hydrogen 2.918 N/A THR 107.A OG1 GLU 108.A OE2 no hydrogen 3.060 N/A THR 115.A N ALA 93.A O no hydrogen 3.002 N/A THR 115.A OG1 PRO 112.A O no hydrogen 2.583 N/A GLN 116.A N VAL 130.A O no hydrogen 2.957 N/A GLN 116.A NE2 ASN 133.A OD1 no hydrogen 2.648 N/A THR 119.A N ALA 128.A O no hydrogen 2.999 N/A THR 119.A OG1 TRP 120.A O no hydrogen 3.004 N/A SER 121.A N LYS 126.A O no hydrogen 3.074 N/A SER 121.A OG VAL 123.A O no hydrogen 3.275 N/A SER 121.A OG LYS 126.A O no hydrogen 3.476 N/A LYS 126.A N SER 121.A OG no hydrogen 3.398 N/A LYS 126.A NZ GLY 183.A O no hydrogen 2.721 N/A LYS 126.A NZ THR 236.A OG1 no hydrogen 3.060 N/A LYS 126.A NZ ASP 237.A OD1 no hydrogen 3.205 N/A LEU 127.A N LYS 138.A O no hydrogen 2.949 N/A ALA 128.A N THR 119.A O no hydrogen 3.169 N/A TYR 129.A N TYR 136.A O no hydrogen 2.812 N/A TYR 129.A OH SER 145.A OG no hydrogen 2.859 N/A VAL 130.A N TRP 117.A O no hydrogen 2.893 N/A TRP 131.A N ASP 134.A O no hydrogen 2.748 N/A TRP 131.A NE1 ASN 113.A O no hydrogen 2.868 N/A ASN 133.A N GLN 116.A OE1 no hydrogen 3.338 N/A ASN 133.A ND2 ILE 157.A O no hydrogen 3.230 N/A ASP 134.A N TRP 131.A O no hydrogen 3.125 N/A ILE 135.A N THR 149.A OG1 no hydrogen 2.987 N/A TYR 136.A N TYR 129.A O no hydrogen 2.727 N/A VAL 137.A N TYR 146.A O no hydrogen 2.700 N/A LYS 138.A N LEU 127.A O no hydrogen 2.792 N/A LYS 138.A NZ GLU 109.A O no hydrogen 2.761 N/A LYS 138.A NZ LEU 143.A O no hydrogen 2.535 N/A LEU 143.A N GLU 140.A O no hydrogen 3.035 N/A SER 145.A OG TYR 129.A OH no hydrogen 2.859 N/A TYR 146.A N VAL 137.A O no hydrogen 2.584 N/A ARG 147.A NE THR 149.A O no hydrogen 3.075 N/A ARG 147.A NH2 ASP 134.A OD2 no hydrogen 2.843 N/A ILE 148.A N ILE 135.A O no hydrogen 3.091 N/A THR 149.A OG1 ASP 134.A OD1 no hydrogen 2.739 N/A LYS 153.A N ILE 157.A O no hydrogen 3.474 N/A ILE 156.A N LYS 153.A O no hydrogen 3.126 N/A ILE 157.A N LYS 153.A O no hydrogen 3.080 N/A TYR 158.A N PHE 191.A O no hydrogen 2.910 N/A ASN 159.A ND2 ASN 133.A O no hydrogen 3.245 N/A ASN 159.A ND2 ASP 134.A OD1 no hydrogen 2.964 N/A ASN 159.A ND2 THR 151.A OG1 no hydrogen 3.198 N/A GLY 160.A N ALA 189.A O no hydrogen 3.167 N/A THR 162.A N TYR 174.A O no hydrogen 2.984 N/A THR 162.A OG1 ALA 173.A O no hydrogen 3.093 N/A THR 162.A OG1 TYR 174.A O no hydrogen 3.106 N/A TRP 164.A NE1 ASP 672.A OD2 no hydrogen 3.206 N/A TYR 166.A N ASP 163.A OD1 no hydrogen 2.831 N/A GLU 167.A N ASP 163.A O no hydrogen 3.446 N/A GLU 168.A N TRP 164.A O no hydrogen 3.039 N/A GLU 169.A N VAL 165.A O no hydrogen 3.177 N/A VAL 170.A N TYR 166.A O no hydrogen 3.273 N/A PHE 171.A N TYR 166.A O no hydrogen 2.805 N/A ALA 176.A N GLY 160.A O no hydrogen 2.716 N/A LEU 177.A N SER 175.A OG no hydrogen 3.256 N/A TRP 178.A N ALA 187.A O no hydrogen 2.664 N/A SER 180.A N PHE 185.A O no hydrogen 2.505 N/A SER 180.A OG PHE 185.A O no hydrogen 3.057 N/A GLY 183.A N SER 180.A O no hydrogen 2.912 N/A THR 184.A OG1 ASN 182.A OD1 no hydrogen 2.589 N/A THR 184.A OG1 ASP 237.A OD2 no hydrogen 3.351 N/A PHE 185.A N SER 180.A OG no hydrogen 2.472 N/A LEU 186.A N VAL 234.A O no hydrogen 2.969 N/A ALA 187.A N TRP 178.A O no hydrogen 2.661 N/A TYR 188.A N PHE 232.A O no hydrogen 2.795 N/A TYR 188.A OH SER 247.A OG no hydrogen 2.669 N/A ALA 189.A N ALA 176.A O no hydrogen 3.206 N/A GLN 190.A N LYS 230.A O no hydrogen 2.733 N/A GLN 190.A NE2 ASN 159.A OD1 no hydrogen 2.980 N/A PHE 191.A N TYR 158.A O no hydrogen 2.917 N/A ASN 192.A N THR 228.A O no hydrogen 2.883 N/A ASP 193.A N ILE 156.A O no hydrogen 2.719 N/A THR 194.A N ASN 192.A OD1 no hydrogen 3.234 N/A THR 194.A OG1 ASN 192.A OD1 no hydrogen 3.056 N/A ILE 199.A N VAL 217.A O no hydrogen 3.002 N/A TYR 201.A N VAL 215.A O no hydrogen 3.177 N/A PHE 203.A N LYS 213.A O no hydrogen 2.526 N/A TYR 204.A N ASP 700.A OD1 no hydrogen 3.042 N/A SER 205.A N ASP 700.A OD2 no hydrogen 2.709 N/A ASP 206.A N SER 205.A OG no hydrogen 2.633 N/A LEU 209.A N ASP 206.A O no hydrogen 2.984 N/A LYS 213.A N PHE 203.A O no hydrogen 2.801 N/A VAL 215.A N TYR 201.A O no hydrogen 2.801 N/A VAL 217.A N ILE 199.A O no hydrogen 3.237 N/A TYR 219.A N PRO 197.A O no hydrogen 2.952 N/A TYR 219.A OH ASN 673.A O no hydrogen 3.079 N/A LYS 221.A NZ TYR 624.A O no hydrogen 2.694 N/A LYS 221.A NZ HIS 675.A ND1 no hydrogen 3.126 N/A LYS 221.A NZ GLN 677.A OE1 no hydrogen 2.900 N/A GLY 223.A N GLU 631.A OE2 no hydrogen 2.823 N/A ALA 224.A N LYS 221.A O no hydrogen 3.012 N/A THR 228.A N ASN 192.A O no hydrogen 3.247 N/A LYS 230.A N GLN 190.A O no hydrogen 2.773 N/A PHE 232.A N TYR 188.A O no hydrogen 2.876 N/A VAL 233.A N ILE 248.A O no hydrogen 2.939 N/A VAL 234.A N LEU 186.A O no hydrogen 3.265 N/A ASN 235.A ND2 THR 184.A O no hydrogen 3.673 N/A THR 236.A N THR 184.A O no hydrogen 2.623 N/A THR 236.A OG1 GLY 183.A O no hydrogen 2.666 N/A THR 236.A OG1 THR 184.A O no hydrogen 2.371 N/A SER 238.A N ASN 235.A OD1 no hydrogen 3.068 N/A SER 238.A OG ASN 235.A OD1 no hydrogen 2.517 N/A SER 240.A OG THR 243.A OG1 no hydrogen 3.305 N/A VAL 242.A N SER 240.A OG no hydrogen 3.286 N/A THR 243.A N SER 240.A OG no hydrogen 3.234 N/A THR 243.A OG1 ASN 244.A O no hydrogen 3.455 N/A SER 247.A OG TYR 188.A OH no hydrogen 2.669 N/A ILE 248.A N VAL 233.A O no hydrogen 3.166 N/A ILE 250.A N PHE 231.A O no hydrogen 3.147 N/A SER 255.A OG TYR 285.A OH no hydrogen 3.053 N/A MET 256.A N PRO 253.A O no hydrogen 2.809 N/A HIS 261.A ND1 GLY 259.A O no hydrogen 3.143 N/A TYR 262.A N LEU 279.A O no hydrogen 2.691 N/A CYS 264.A N GLN 277.A O no hydrogen 3.173 N/A CYS 264.A SG GLN 277.A O no hydrogen 3.531 N/A THR 267.A N SER 275.A O no hydrogen 2.950 N/A THR 267.A OG1 ASP 265.A OD1 no hydrogen 2.736 N/A ALA 269.A N ARG 273.A O no hydrogen 3.034 N/A GLU 272.A N THR 270.A OG1 no hydrogen 2.852 N/A ILE 274.A N CYS 291.A O no hydrogen 2.984 N/A SER 275.A N THR 267.A O no hydrogen 2.839 N/A SER 275.A OG THR 267.A O no hydrogen 2.651 N/A LEU 276.A N ASP 289.A O no hydrogen 3.052 N/A GLN 277.A N ASP 265.A O no hydrogen 2.944 N/A TRP 278.A N VAL 287.A O no hydrogen 3.094 N/A LEU 279.A N TYR 262.A O no hydrogen 2.969 N/A ARG 280.A N TYR 285.A O no hydrogen 3.186 N/A ARG 280.A NE SER 255.A O no hydrogen 3.244 N/A ARG 280.A NH2 SER 255.A O no hydrogen 2.945 N/A ARG 281.A N ASP 260.A O no hydrogen 2.992 N/A ARG 281.A NE GLU 631.A OE1 no hydrogen 2.776 N/A ARG 281.A NE GLU 631.A OE2 no hydrogen 3.415 N/A ARG 281.A NH1 ALA 224.A O no hydrogen 3.210 N/A ARG 281.A NH1 ASP 260.A OD2 no hydrogen 2.974 N/A ARG 281.A NH2 ALA 224.A O no hydrogen 2.656 N/A ARG 281.A NH2 GLU 631.A OE2 no hydrogen 2.797 N/A GLN 283.A NE2 VAL 628.A O no hydrogen 2.750 N/A ASN 284.A N ILE 282.A O no hydrogen 2.716 N/A TYR 285.A OH SER 255.A OG no hydrogen 3.053 N/A SER 286.A N GLU 310.A O no hydrogen 3.068 N/A SER 286.A OG GLU 310.A O no hydrogen 3.035 N/A VAL 287.A N TRP 278.A O no hydrogen 3.165 N/A MET 288.A N HIS 308.A O no hydrogen 2.880 N/A ASP 289.A N LEU 276.A O no hydrogen 2.756 N/A CYS 291.A N ILE 274.A O no hydrogen 2.934 N/A ASP 292.A N ASN 301.A O no hydrogen 2.905 N/A TYR 293.A N GLU 272.A O no hydrogen 2.830 N/A TYR 293.A OH GLU 295.A OE1 no hydrogen 3.111 N/A ASP 294.A N ARG 299.A O no hydrogen 2.940 N/A SER 296.A N ASP 294.A OD1 no hydrogen 3.133 N/A GLY 298.A N ASP 294.A O no hydrogen 2.763 N/A ASN 301.A N ASP 292.A O no hydrogen 2.884 N/A ARG 306.A N LEU 303.A O no hydrogen 3.056 N/A GLN 307.A N VAL 304.A O no hydrogen 3.009 N/A GLN 307.A NE2 ASP 289.A OD1 no hydrogen 3.262 N/A HIS 308.A N MET 288.A O no hydrogen 3.166 N/A HIS 308.A NE2 GLN 351.A O no hydrogen 3.178 N/A GLU 310.A N SER 286.A O no hydrogen 2.689 N/A SER 312.A N ASN 284.A O no hydrogen 3.150 N/A TRP 316.A NE1 ARG 319.A O no hydrogen 3.110 N/A ARG 319.A NH1 GLU 366.A OE1 no hydrogen 2.659 N/A ARG 319.A NH2 GLU 366.A OE1 no hydrogen 2.894 N/A ARG 319.A NH2 VAL 367.A O no hydrogen 2.937 N/A ARG 321.A NH1 CYS 264.A O no hydrogen 2.827 N/A SER 323.A OG GLU 324.A O no hydrogen 3.372 N/A GLU 324.A N GLU 324.A OE1 no hydrogen 2.615 N/A HIS 326.A N TYR 335.A O no hydrogen 3.007 N/A HIS 326.A NE2 GLU 324.A OE2 no hydrogen 3.130 N/A THR 328.A N SER 333.A O no hydrogen 3.035 N/A THR 328.A OG1 ASP 330.A OD1 no hydrogen 2.644 N/A THR 328.A OG1 SER 333.A O no hydrogen 3.399 N/A THR 328.A OG1 SER 333.A OG no hydrogen 3.349 N/A GLY 331.A N THR 328.A O no hydrogen 3.093 N/A ASN 332.A ND2 ASP 330.A OD2 no hydrogen 2.652 N/A SER 333.A OG THR 328.A OG1 no hydrogen 3.349 N/A SER 333.A OG TYR 349.A OH no hydrogen 2.935 N/A PHE 334.A N PHE 350.A O no hydrogen 3.437 N/A TYR 335.A N HIS 326.A O no hydrogen 2.919 N/A LYS 336.A N CYS 348.A O no hydrogen 3.250 N/A LYS 336.A NZ GLU 310.A OE1 no hydrogen 2.682 N/A LYS 336.A NZ SER 323.A O no hydrogen 3.361 N/A ILE 338.A N HIS 346.A O no hydrogen 3.074 N/A SER 339.A OG ASP 551.A OD2 no hydrogen 2.894 N/A GLU 342.A N ASN 340.A O no hydrogen 2.617 N/A TYR 344.A N ASN 340.A OD1 no hydrogen 2.666 N/A ARG 345.A NH1 ASP 551.A OD1 no hydrogen 2.966 N/A HIS 346.A N ILE 338.A O no hydrogen 3.084 N/A HIS 346.A NE2 GLY 363.A O no hydrogen 2.926 N/A CYS 348.A N LYS 336.A O no hydrogen 2.821 N/A TYR 349.A N THR 358.A O no hydrogen 3.042 N/A TYR 349.A OH SER 333.A OG no hydrogen 2.935 N/A PHE 350.A N PHE 334.A O no hydrogen 2.999 N/A LYS 354.A N GLN 351.A O no hydrogen 2.866 N/A THR 358.A N TYR 349.A O no hydrogen 3.318 N/A ILE 360.A N ILE 347.A O no hydrogen 3.173 N/A GLU 366.A N ASN 383.A OD1 no hydrogen 3.013 N/A VAL 367.A N ARG 345.A O no hydrogen 2.901 N/A ILE 368.A N ILE 381.A O no hydrogen 2.781 N/A GLU 371.A N TYR 379.A O no hydrogen 3.022 N/A THR 374.A N TYR 377.A O no hydrogen 3.019 N/A THR 374.A OG1 TYR 377.A O no hydrogen 3.499 N/A SER 375.A OG ASP 376.A OD1 no hydrogen 3.035 N/A ASP 376.A N THR 374.A OG1 no hydrogen 2.932 N/A TYR 377.A N THR 374.A OG1 no hydrogen 2.631 N/A LEU 378.A N ILE 397.A O no hydrogen 3.277 N/A TYR 379.A N ALA 372.A O no hydrogen 3.059 N/A TYR 380.A N TYR 395.A O no hydrogen 3.120 N/A ILE 381.A N GLY 369.A O no hydrogen 3.044 N/A SER 382.A N ASN 393.A O no hydrogen 2.943 N/A ASN 383.A ND2 TYR 548.A O no hydrogen 3.312 N/A GLU 384.A N SER 382.A OG no hydrogen 2.828 N/A GLY 387.A N GLU 384.A O no hydrogen 3.062 N/A GLY 391.A N MET 388.A O no hydrogen 3.284 N/A ARG 392.A N GLN 418.A O no hydrogen 2.953 N/A ASN 393.A N SER 382.A O no hydrogen 2.916 N/A ASN 393.A ND2 SER 409.A OG no hydrogen 2.876 N/A LEU 394.A N SER 409.A OG no hydrogen 2.865 N/A TYR 395.A N TYR 380.A O no hydrogen 2.689 N/A LYS 396.A N THR 406.A O no hydrogen 3.131 N/A LYS 396.A NZ ASP 451.A OD1 no hydrogen 2.908 N/A ILE 397.A N LEU 378.A O no hydrogen 3.314 N/A LEU 399.A N ASP 376.A O no hydrogen 3.170 N/A TYR 402.A N GLN 398.A O no hydrogen 3.258 N/A THR 403.A OG1 ASP 401.A OD2 no hydrogen 2.562 N/A THR 406.A N LYS 396.A O no hydrogen 2.892 N/A THR 406.A OG1 LYS 396.A O no hydrogen 3.361 N/A CYS 407.A SG TYR 395.A OH no hydrogen 3.404 N/A LEU 408.A N LEU 394.A O no hydrogen 3.070 N/A LEU 412.A N SER 409.A O no hydrogen 3.122 N/A ASN 413.A ND2 GLU 415.A OE1 no hydrogen 3.512 N/A ASN 413.A ND2 GLU 415.A OE2 no hydrogen 2.775 N/A GLU 415.A N GLU 415.A OE1 no hydrogen 2.617 N/A ARG 416.A N ASN 413.A O no hydrogen 2.978 N/A ARG 416.A NE LEU 440.A O no hydrogen 3.182 N/A ARG 416.A NH2 LEU 440.A O no hydrogen 3.182 N/A ARG 416.A NH2 ASP 459.A O no hydrogen 2.778 N/A CYS 417.A N ASN 413.A O no hydrogen 2.772 N/A GLN 418.A N GLY 437.A O no hydrogen 2.665 N/A GLN 418.A NE2 PRO 414.A O no hydrogen 3.620 N/A SER 421.A N ARG 434.A O no hydrogen 2.654 N/A SER 423.A N GLN 432.A O no hydrogen 2.771 N/A SER 425.A N TYR 430.A O no hydrogen 3.053 N/A SER 425.A OG LYS 426.A O no hydrogen 3.506 N/A SER 425.A OG TYR 430.A O no hydrogen 3.110 N/A LYS 426.A N SER 27.A O no hydrogen 3.285 N/A ALA 428.A N SER 425.A O no hydrogen 3.019 N/A LYS 429.A N LYS 426.A O no hydrogen 3.425 N/A TYR 430.A N SER 425.A OG no hydrogen 2.883 N/A TYR 430.A OH GLU 45.A OE1 no hydrogen 2.309 N/A GLN 432.A N SER 423.A O no hydrogen 2.901 N/A GLN 432.A NE2 TYR 21.A O no hydrogen 3.121 N/A LEU 433.A N THR 444.A O no hydrogen 2.938 N/A ARG 434.A N SER 421.A O no hydrogen 2.483 N/A CYS 435.A N LEU 442.A O no hydrogen 2.946 N/A CYS 435.A SG GLY 437.A O no hydrogen 3.919 N/A SER 436.A N TYR 419.A O no hydrogen 2.786 N/A GLY 439.A N ARG 416.A O no hydrogen 2.851 N/A LEU 442.A N CYS 435.A O no hydrogen 3.136 N/A TYR 443.A N GLU 458.A O no hydrogen 2.972 N/A THR 444.A N LEU 433.A O no hydrogen 3.096 N/A THR 444.A OG1 HIS 446.A NE2 no hydrogen 2.808 N/A LEU 445.A N ARG 455.A O no hydrogen 3.053 N/A HIS 446.A N TYR 431.A O no hydrogen 3.015 N/A HIS 446.A NE2 THR 444.A OG1 no hydrogen 2.808 N/A SER 448.A N LYS 429.A O no hydrogen 2.903 N/A SER 448.A OG ALA 428.A O no hydrogen 2.680 N/A SER 448.A OG LYS 429.A O no hydrogen 2.741 N/A LYS 452.A N SER 447.A O no hydrogen 3.342 N/A ARG 455.A N LEU 445.A O no hydrogen 3.513 N/A LEU 457.A N TYR 443.A O no hydrogen 2.864 N/A GLU 458.A N TYR 443.A O no hydrogen 3.448 N/A ASN 460.A N GLU 458.A OE2 no hydrogen 3.041 N/A ASN 460.A ND2 LYS 19.A O no hydrogen 2.912 N/A SER 461.A OG ASP 459.A OD1 no hydrogen 3.528 N/A SER 461.A OG ASP 459.A OD2 no hydrogen 3.338 N/A ASP 464.A N ASN 460.A O no hydrogen 3.259 N/A ASP 464.A N SER 461.A O no hydrogen 3.115 N/A LYS 465.A N SER 461.A O no hydrogen 3.136 N/A LEU 467.A N LEU 463.A O no hydrogen 3.206 N/A ASN 469.A N ASN 469.A OD1 no hydrogen 2.460 N/A GLN 471.A N LYS 4.A O no hydrogen 3.106 N/A GLN 471.A NE2 ARG 3.A O no hydrogen 2.863 N/A MET 472.A N VAL 470.A O no hydrogen 3.189 N/A SER 474.A N LEU 493.A O no hydrogen 3.197 N/A LYS 475.A NZ ASP 519.A OD1 no hydrogen 3.543 N/A LYS 475.A NZ VAL 521.A O no hydrogen 2.515 N/A LYS 476.A N MET 491.A O no hydrogen 2.882 N/A LYS 476.A NZ ASP 478.A OD2 no hydrogen 2.930 N/A ASP 478.A N TYR 489.A O no hydrogen 3.363 N/A ILE 480.A N PHE 487.A O no hydrogen 2.823 N/A LEU 482.A N THR 485.A O no hydrogen 2.928 N/A THR 485.A N LEU 482.A O no hydrogen 3.011 N/A THR 485.A OG1 ASN 483.A O no hydrogen 3.132 N/A PHE 487.A N ILE 480.A O no hydrogen 2.825 N/A TYR 489.A N ASP 478.A O no hydrogen 3.133 N/A GLN 490.A N SER 540.A O no hydrogen 3.106 N/A MET 491.A N LYS 476.A O no hydrogen 2.953 N/A ILE 492.A N VAL 538.A O no hydrogen 2.633 N/A LEU 493.A N SER 474.A O no hydrogen 2.946 N/A HIS 496.A NE2 ASP 1.A O no hydrogen 3.031 N/A ASP 498.A N TYR 503.A OH no hydrogen 3.232 N/A LYS 499.A NZ PHE 497.A O no hydrogen 2.921 N/A SER 500.A N ASP 498.A OD1 no hydrogen 3.368 N/A SER 500.A OG ASP 498.A OD1 no hydrogen 3.223 N/A SER 500.A OG ASP 498.A OD2 no hydrogen 3.103 N/A LYS 501.A NZ LYS 502.A O no hydrogen 3.343 N/A LEU 505.A N ARG 586.A O no hydrogen 3.100 N/A LEU 506.A N ILE 537.A O no hydrogen 2.792 N/A LEU 507.A N ALA 588.A O no hydrogen 2.936 N/A VAL 509.A N TRP 590.A O no hydrogen 3.162 N/A CYS 514.A N GLY 545.A O no hydrogen 2.765 N/A SER 515.A OG GLY 512.A O no hydrogen 2.819 N/A GLN 516.A NE2 PRO 389.A O no hydrogen 2.661 N/A LYS 517.A N ASP 542.A OD1 no hydrogen 2.684 N/A ALA 518.A N ASP 542.A OD2 no hydrogen 2.977 N/A THR 520.A N GLY 390.A O no hydrogen 3.264 N/A VAL 521.A N ASP 519.A OD1 no hydrogen 2.954 N/A PHE 522.A N SER 436.A O no hydrogen 2.990 N/A ARG 523.A NH1 ASP 519.A OD1 no hydrogen 3.136 N/A ARG 523.A NH2 ASP 519.A OD1 no hydrogen 3.299 N/A ARG 523.A NH2 ASP 519.A OD2 no hydrogen 2.956 N/A ASN 525.A N THR 528.A OG1 no hydrogen 3.099 N/A TRP 526.A NE1 SER 719.A OG no hydrogen 3.028 N/A THR 528.A N ASN 525.A OD1 no hydrogen 2.825 N/A THR 528.A OG1 ARG 523.A O no hydrogen 3.215 N/A THR 528.A OG1 ASN 525.A OD1 no hydrogen 2.667 N/A TYR 529.A OH GLU 534.A OE2 no hydrogen 2.977 N/A LEU 530.A N TRP 526.A O no hydrogen 3.027 N/A ALA 531.A N ALA 527.A O no hydrogen 3.086 N/A SER 532.A N THR 528.A O no hydrogen 2.914 N/A SER 532.A OG GLN 471.A O no hydrogen 2.967 N/A THR 533.A N TYR 529.A O no hydrogen 2.860 N/A THR 533.A OG1 TYR 6.A O no hydrogen 2.551 N/A ILE 536.A N LEU 530.A O no hydrogen 2.789 N/A ILE 537.A N PRO 504.A O no hydrogen 2.787 N/A VAL 538.A N ILE 492.A O no hydrogen 3.224 N/A ALA 539.A N LEU 506.A O no hydrogen 2.929 N/A SER 540.A N GLN 490.A O no hydrogen 2.844 N/A SER 540.A OG ASP 508.A O no hydrogen 3.279 N/A ASP 542.A N TRP 488.A O no hydrogen 2.884 N/A ARG 544.A N ASP 568.A OD2 no hydrogen 2.847 N/A GLY 545.A N ILE 553.A O no hydrogen 2.930 N/A SER 546.A N GLY 543.A O no hydrogen 2.985 N/A SER 546.A OG GLY 543.A O no hydrogen 2.684 N/A GLY 547.A N SER 515.A O no hydrogen 3.027 N/A GLY 550.A N GLU 366.A OE2 no hydrogen 2.979 N/A ASP 551.A N GLY 343.A O no hydrogen 2.505 N/A MET 554.A N GLY 550.A O no hydrogen 3.354 N/A HIS 555.A N ASP 551.A O no hydrogen 3.233 N/A ALA 556.A N ILE 553.A O no hydrogen 3.361 N/A ASN 558.A N HIS 555.A O no hydrogen 3.421 N/A ARG 559.A N TYR 633.A O no hydrogen 2.712 N/A ARG 559.A NE ASP 641.A OD1 no hydrogen 3.402 N/A ARG 559.A NH2 ASP 641.A OD1 no hydrogen 2.541 N/A ARG 560.A N ILE 557.A O no hydrogen 3.106 N/A GLY 562.A N GLU 565.A OE1 no hydrogen 3.165 N/A GLY 562.A N GLU 565.A OE2 no hydrogen 2.664 N/A THR 563.A N ARG 560.A O no hydrogen 3.315 N/A THR 563.A OG1 ARG 560.A O no hydrogen 2.629 N/A PHE 564.A N THR 563.A OG1 no hydrogen 2.643 N/A GLU 565.A N GLU 565.A OE1 no hydrogen 2.581 N/A GLU 567.A N THR 563.A O no hydrogen 3.230 N/A ASP 568.A N PHE 564.A O no hydrogen 2.920 N/A GLN 569.A NE2 PHE 541.A O no hydrogen 3.137 N/A ILE 570.A N VAL 566.A O no hydrogen 3.276 N/A GLU 571.A N GLU 567.A O no hydrogen 2.920 N/A ALA 572.A N ASP 568.A O no hydrogen 2.866 N/A ALA 573.A N GLN 569.A O no hydrogen 3.292 N/A ARG 574.A N ILE 570.A O no hydrogen 3.389 N/A GLN 575.A N GLU 571.A O no hydrogen 3.048 N/A GLN 575.A NE2 GLU 571.A OE1 no hydrogen 3.512 N/A GLN 575.A NE2 GLU 571.A OE2 no hydrogen 2.891 N/A PHE 576.A N ALA 572.A O no hydrogen 2.451 N/A SER 577.A N ALA 573.A O no hydrogen 2.798 N/A SER 577.A OG ALA 573.A O no hydrogen 3.237 N/A SER 577.A OG ARG 574.A O no hydrogen 3.520 N/A LYS 578.A N ARG 574.A O no hydrogen 3.122 N/A MET 579.A N PHE 576.A O no hydrogen 3.227 N/A GLY 580.A N SER 577.A O no hydrogen 3.349 N/A ASP 583.A N TYR 503.A O no hydrogen 2.716 N/A LYS 585.A N ASP 583.A OD1 no hydrogen 3.319 N/A ARG 586.A N ASP 583.A O no hydrogen 2.928 N/A ARG 586.A NH1 PHE 726.A O no hydrogen 2.916 N/A ALA 588.A N LEU 505.A O no hydrogen 2.793 N/A TRP 590.A N LEU 507.A O no hydrogen 3.222 N/A GLY 591.A N ILE 614.A O no hydrogen 3.250 N/A TRP 592.A NE1 HIS 703.A O no hydrogen 2.802 N/A SER 593.A N VAL 616.A O no hydrogen 3.174 N/A SER 593.A OG HIS 703.A NE2 no hydrogen 3.286 N/A TYR 594.A OH GLU 565.A OE2 no hydrogen 2.522 N/A TYR 597.A N SER 593.A O no hydrogen 3.134 N/A TYR 597.A OH SER 649.A O no hydrogen 2.847 N/A VAL 598.A N TYR 594.A O no hydrogen 2.905 N/A THR 599.A N GLY 595.A O no hydrogen 2.851 N/A THR 599.A OG1 GLY 595.A O no hydrogen 2.951 N/A SER 600.A N GLY 596.A O no hydrogen 2.901 N/A SER 600.A OG GLY 596.A O no hydrogen 2.783 N/A SER 600.A OG TYR 663.A OH no hydrogen 2.950 N/A MET 601.A N TYR 597.A O no hydrogen 2.957 N/A VAL 602.A N VAL 598.A O no hydrogen 2.862 N/A LEU 603.A N THR 599.A O no hydrogen 3.021 N/A GLY 604.A N SER 600.A O no hydrogen 3.179 N/A SER 605.A N VAL 602.A O no hydrogen 3.070 N/A SER 605.A OG VAL 602.A O no hydrogen 2.301 N/A LYS 611.A N ILE 587.A O no hydrogen 2.867 N/A LYS 611.A NZ CYS 725.A O no hydrogen 3.110 N/A ILE 614.A N ILE 589.A O no hydrogen 3.042 N/A ALA 615.A N LEU 664.A O no hydrogen 2.874 N/A VAL 616.A N GLY 591.A O no hydrogen 3.015 N/A ALA 617.A N ILE 666.A O no hydrogen 2.616 N/A SER 620.A N GLN 678.A OE1 no hydrogen 2.680 N/A SER 620.A OG GLN 678.A O no hydrogen 3.105 N/A SER 620.A OG GLN 678.A OE1 no hydrogen 3.320 N/A ARG 621.A N GLN 678.A OE1 no hydrogen 3.432 N/A TYR 624.A N ARG 621.A O no hydrogen 2.746 N/A TYR 625.A N TRP 622.A O no hydrogen 3.376 N/A TYR 625.A OH ASN 673.A OD1 no hydrogen 2.589 N/A SER 627.A N PRO 220.A O no hydrogen 2.703 N/A SER 627.A OG PRO 220.A O no hydrogen 3.439 N/A SER 627.A OG ASN 226.A OD1 no hydrogen 2.425 N/A TYR 629.A N ASP 626.A OD1 no hydrogen 3.010 N/A THR 630.A N ASP 626.A O no hydrogen 3.355 N/A THR 630.A OG1 ASP 626.A O no hydrogen 2.812 N/A GLU 631.A N SER 627.A O no hydrogen 2.871 N/A ARG 632.A N TYR 629.A O no hydrogen 3.303 N/A ARG 632.A NE GLN 283.A OE1 no hydrogen 3.072 N/A ARG 632.A NH1 TYR 633.A OH no hydrogen 2.804 N/A ARG 632.A NH2 GLU 169.A O no hydrogen 3.306 N/A TYR 633.A N THR 630.A O no hydrogen 2.985 N/A MET 634.A N THR 630.A O no hydrogen 2.720 N/A GLY 635.A N GLU 631.A O no hydrogen 3.038 N/A LEU 636.A N ASP 641.A OD2 no hydrogen 2.944 N/A THR 638.A N LEU 636.A O no hydrogen 2.785 N/A THR 638.A OG1 GLU 640.A OE1 no hydrogen 3.219 N/A ASP 641.A N THR 638.A O no hydrogen 2.952 N/A ASN 642.A N LEU 636.A O no hydrogen 3.387 N/A ASN 642.A ND2 ARG 559.A O no hydrogen 3.114 N/A ASN 642.A ND2 MET 634.A O no hydrogen 3.480 N/A LEU 643.A N THR 638.A O no hydrogen 3.281 N/A TYR 646.A N ASN 642.A O no hydrogen 2.954 N/A TYR 646.A OH GLY 635.A O no hydrogen 2.951 N/A ARG 647.A N LEU 643.A O no hydrogen 2.977 N/A ARG 647.A NE GLU 623.A OE2 no hydrogen 2.514 N/A ASN 648.A N ASP 644.A O no hydrogen 3.177 N/A SER 649.A OG HIS 645.A O no hydrogen 2.882 N/A SER 649.A OG TYR 646.A O no hydrogen 3.279 N/A THR 650.A OG1 SER 653.A OG no hydrogen 2.502 N/A VAL 651.A N SER 620.A O no hydrogen 2.879 N/A SER 653.A N THR 650.A OG1 no hydrogen 3.289 N/A SER 653.A OG THR 650.A O no hydrogen 3.372 N/A SER 653.A OG THR 650.A OG1 no hydrogen 2.502 N/A ARG 654.A N VAL 651.A O no hydrogen 2.946 N/A ASN 657.A ND2 GLY 604.A O no hydrogen 3.326 N/A PHE 658.A N ALA 655.A O no hydrogen 3.220 N/A VAL 661.A N PHE 658.A O no hydrogen 3.460 N/A GLU 662.A N LYS 611.A O no hydrogen 3.172 N/A TYR 663.A OH SER 600.A OG no hydrogen 2.950 N/A LEU 664.A N GLY 613.A O no hydrogen 2.973 N/A LEU 665.A N GLN 694.A O no hydrogen 2.999 N/A ILE 666.A N ALA 615.A O no hydrogen 2.953 N/A HIS 667.A N MET 696.A O no hydrogen 3.293 N/A HIS 667.A ND1 SER 679.A OG no hydrogen 2.510 N/A HIS 667.A NE2 VAL 674.A O no hydrogen 2.604 N/A THR 669.A N TYR 698.A O no hydrogen 3.073 N/A ALA 670.A N GLU 701.A O no hydrogen 3.019 N/A ASP 671.A N GLY 668.A O no hydrogen 3.362 N/A ASN 673.A N ASP 671.A OD1 no hydrogen 2.917 N/A ASN 673.A ND2 GLU 168.A OE1 no hydrogen 3.267 N/A GLN 678.A N HIS 675.A O no hydrogen 2.935 N/A SER 679.A OG HIS 667.A ND1 no hydrogen 2.510 N/A ALA 680.A N PHE 676.A O no hydrogen 2.879 N/A GLN 681.A N GLN 677.A O no hydrogen 3.011 N/A ILE 682.A N GLN 678.A O no hydrogen 3.278 N/A SER 683.A N SER 679.A O no hydrogen 3.086 N/A SER 683.A OG SER 679.A O no hydrogen 3.459 N/A SER 683.A OG ALA 680.A O no hydrogen 3.083 N/A LYS 684.A N ALA 680.A O no hydrogen 3.191 N/A ALA 685.A N GLN 681.A O no hydrogen 3.267 N/A ALA 685.A N ILE 682.A O no hydrogen 3.188 N/A LEU 686.A N ILE 682.A O no hydrogen 3.046 N/A VAL 687.A N SER 683.A O no hydrogen 2.886 N/A ASP 688.A N LYS 684.A O no hydrogen 3.206 N/A GLY 690.A N LEU 686.A O no hydrogen 3.075 N/A VAL 691.A N LEU 686.A O no hydrogen 2.961 N/A PHE 693.A N ASP 692.A OD1 no hydrogen 2.723 N/A GLN 694.A N TYR 663.A O no hydrogen 2.909 N/A MET 696.A N LEU 665.A O no hydrogen 2.913 N/A TYR 698.A N HIS 667.A O no hydrogen 3.289 N/A TYR 698.A OH HIS 713.A ND1 no hydrogen 2.599 N/A ASP 700.A N THR 669.A OG1 no hydrogen 2.891 N/A GLU 701.A N TYR 698.A O no hydrogen 3.325 N/A HIS 703.A ND1 ASP 671.A OD2 no hydrogen 2.959 N/A GLY 704.A N ASP 702.A OD1 no hydrogen 3.149 N/A ILE 705.A N ASP 702.A O no hydrogen 3.246 N/A SER 707.A N GLU 701.A OE1 no hydrogen 3.455 N/A SER 707.A OG GLU 701.A OE2 no hydrogen 3.400 N/A ALA 710.A N SER 707.A OG no hydrogen 3.019 N/A HIS 711.A N SER 707.A O no hydrogen 2.763 N/A HIS 711.A NE2 TYR 11.A OH no hydrogen 2.940 N/A GLN 712.A NE2 SER 708.A O no hydrogen 3.225 N/A HIS 713.A N THR 709.A O no hydrogen 3.121 N/A HIS 713.A ND1 TYR 698.A OH no hydrogen 2.599 N/A ILE 714.A N ALA 710.A O no hydrogen 3.047 N/A TYR 715.A N HIS 711.A O no hydrogen 3.439 N/A THR 716.A N GLN 712.A O no hydrogen 3.043 N/A THR 716.A OG1 GLN 712.A O no hydrogen 2.798 N/A HIS 717.A N HIS 713.A O no hydrogen 2.890 N/A MET 718.A N ILE 714.A O no hydrogen 2.939 N/A SER 719.A N TYR 715.A O no hydrogen 3.032 N/A SER 719.A OG TYR 715.A O no hydrogen 2.550 N/A HIS 720.A N THR 716.A O no hydrogen 3.173 N/A PHE 721.A N HIS 717.A O no hydrogen 3.110 N/A ILE 722.A N MET 718.A O no hydrogen 3.003 N/A LYS 723.A N SER 719.A O no hydrogen 2.961 N/A GLN 724.A N HIS 720.A O no hydrogen 2.982 N/A CYS 725.A N PHE 721.A O no hydrogen 3.006 N/A PHE 726.A N ILE 722.A O no hydrogen 3.035 N/A SER 727.A N GLN 724.A O no hydrogen 2.981 N/A LEU 728.A N LYS 723.A O no hydrogen 2.855 N/A