Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hb9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N ASP 77.A OD1 no hydrogen 2.917 N/A LYS 4.A N ASP 77.A OD1 no hydrogen 3.046 N/A LYS 4.A NZ GLU 47.A OE1 no hydrogen 3.046 N/A LYS 4.A NZ ALA 74.A O no hydrogen 3.131 N/A LEU 5.A N SER 27.A O no hydrogen 2.713 N/A LEU 6.A N ALA 78.A O no hydrogen 2.970 N/A VAL 7.A N VAL 29.A O no hydrogen 3.088 N/A ALA 8.A N HIS 80.A O no hydrogen 2.950 N/A ASN 9.A ND2 ARG 10.A O no hydrogen 3.066 N/A ARG 10.A NE ASP 36.A OD2 no hydrogen 2.925 N/A ARG 10.A NH2 ASP 367.A OD1 no hydrogen 3.172 N/A ARG 10.A NH2 ASP 367.A OD2 no hydrogen 3.527 N/A ILE 15.A N GLY 11.A O no hydrogen 3.131 N/A ARG 16.A N GLU 12.A O no hydrogen 2.748 N/A ARG 16.A NH1 ARG 16.A O no hydrogen 3.188 N/A ARG 16.A NH2 GLU 290.A OE1 no hydrogen 2.904 N/A ARG 16.A NH2 ASP 296.A OD2 no hydrogen 2.601 N/A ILE 17.A N ILE 13.A O no hydrogen 2.881 N/A PHE 18.A N ALA 14.A O no hydrogen 2.940 N/A ARG 19.A N ILE 15.A O no hydrogen 3.217 N/A ALA 20.A N ARG 16.A O no hydrogen 3.188 N/A ALA 21.A N ILE 17.A O no hydrogen 2.919 N/A ALA 22.A N PHE 18.A O no hydrogen 2.855 N/A GLU 23.A N ARG 19.A O no hydrogen 3.292 N/A LEU 24.A N ALA 21.A O no hydrogen 3.260 N/A ASP 25.A N ALA 22.A O no hydrogen 3.098 N/A ILE 26.A N ALA 21.A O no hydrogen 2.798 N/A SER 27.A N LYS 3.A O no hydrogen 3.097 N/A THR 28.A N ASP 46.A OD2 no hydrogen 2.735 N/A THR 28.A OG1 ASP 46.A OD2 no hydrogen 2.882 N/A VAL 29.A N LEU 5.A O no hydrogen 2.755 N/A ALA 30.A N GLU 47.A O no hydrogen 2.851 N/A TYR 32.A N TYR 49.A O no hydrogen 3.248 N/A SER 33.A N TYR 61.A OH no hydrogen 3.412 N/A SER 33.A OG TYR 378.A OH no hydrogen 2.720 N/A ASP 36.A N SER 33.A O no hydrogen 3.224 N/A SER 39.A N ASP 36.A O no hydrogen 2.993 N/A SER 39.A OG HIS 41.A ND1 no hydrogen 3.007 N/A HIS 41.A ND1 SER 39.A OG no hydrogen 3.007 N/A HIS 41.A NE2 ILE 31.A O no hydrogen 2.993 N/A ARG 42.A N SER 39.A O no hydrogen 3.415 N/A TYR 43.A N LEU 40.A O no hydrogen 3.159 N/A LYS 44.A N HIS 41.A O no hydrogen 3.342 N/A ASP 46.A N THR 28.A OG1 no hydrogen 3.052 N/A GLU 47.A N THR 28.A O no hydrogen 3.009 N/A TYR 49.A N ALA 30.A O no hydrogen 3.029 N/A TYR 49.A OH GLU 47.A OE2 no hydrogen 2.604 N/A VAL 51.A N TYR 32.A O no hydrogen 3.107 N/A LEU 55.A N GLY 52.A O no hydrogen 3.456 N/A GLU 59.A N GLY 56.A O no hydrogen 3.165 N/A TYR 61.A OH ASP 36.A OD2 no hydrogen 2.772 N/A ARG 66.A N ASN 63.A OD1 no hydrogen 3.034 N/A ILE 67.A N ASN 63.A O no hydrogen 3.140 N/A ILE 68.A N ILE 64.A O no hydrogen 3.295 N/A ASP 69.A N GLU 65.A O no hydrogen 3.443 N/A VAL 70.A N ARG 66.A O no hydrogen 3.174 N/A ALA 71.A N ILE 67.A O no hydrogen 3.153 N/A LYS 72.A N ILE 68.A O no hydrogen 2.898 N/A LYS 72.A NZ GLU 99.A OE1 no hydrogen 3.250 N/A GLN 73.A N ASP 69.A O no hydrogen 2.925 N/A GLN 73.A NE2 VAL 70.A O no hydrogen 3.435 N/A ALA 74.A N VAL 70.A O no hydrogen 2.778 N/A ASN 75.A N LYS 72.A O no hydrogen 2.912 N/A VAL 76.A N ALA 71.A O no hydrogen 2.909 N/A ASP 77.A N LYS 4.A O no hydrogen 3.213 N/A ALA 78.A N LYS 4.A O no hydrogen 3.435 N/A ILE 79.A N LYS 102.A O no hydrogen 2.861 N/A HIS 80.A N LEU 6.A O no hydrogen 2.890 N/A HIS 80.A NE2 GLN 301.A OE1 no hydrogen 2.864 N/A GLY 82.A N HIS 80.A ND1 no hydrogen 3.182 N/A TYR 83.A OH GLU 12.A OE2 no hydrogen 2.613 N/A GLY 84.A N SER 87.A OG no hydrogen 2.957 N/A ASN 89.A N LEU 86.A O no hydrogen 2.764 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 2.822 N/A PHE 92.A N ASN 89.A OD1 no hydrogen 3.096 N/A ARG 94.A N GLU 90.A O no hydrogen 3.051 N/A ARG 95.A N GLN 91.A O no hydrogen 2.964 N/A ARG 95.A NE GLU 65.A OE1 no hydrogen 2.708 N/A ARG 95.A NH1 GLU 98.A OE1 no hydrogen 2.739 N/A ARG 95.A NH2 GLU 65.A OE2 no hydrogen 3.292 N/A CYS 96.A N PHE 92.A O no hydrogen 2.927 N/A CYS 96.A SG PHE 92.A O no hydrogen 3.270 N/A ALA 97.A N ALA 93.A O no hydrogen 3.295 N/A GLU 98.A N ARG 94.A O no hydrogen 3.420 N/A GLU 99.A N CYS 96.A O no hydrogen 3.006 N/A GLY 100.A N ALA 97.A O no hydrogen 3.183 N/A ILE 101.A N CYS 96.A O no hydrogen 2.852 N/A LYS 102.A N ASP 77.A O no hydrogen 3.023 N/A LYS 102.A NZ GLU 207.A OE2 no hydrogen 2.693 N/A ILE 104.A N ILE 79.A O no hydrogen 2.905 N/A GLU 109.A N GLU 109.A OE2 no hydrogen 2.970 N/A HIS 110.A N HIS 107.A O no hydrogen 2.990 N/A LEU 111.A N HIS 107.A O no hydrogen 3.221 N/A ASP 112.A N LEU 108.A O no hydrogen 3.186 N/A MET 113.A N GLU 109.A O no hydrogen 3.212 N/A PHE 114.A N HIS 110.A O no hydrogen 2.879 N/A LYS 119.A N ASP 116.A OD1 no hydrogen 3.413 N/A ARG 121.A NH1 THR 135.A O no hydrogen 2.947 N/A ARG 121.A NH2 GLY 134.A O no hydrogen 2.745 N/A THR 122.A N VAL 118.A O no hydrogen 2.839 N/A THR 122.A OG1 VAL 118.A O no hydrogen 2.662 N/A THR 123.A N LYS 119.A O no hydrogen 3.048 N/A THR 123.A OG1 LYS 119.A O no hydrogen 2.739 N/A ALA 124.A N ALA 120.A O no hydrogen 3.112 N/A ILE 125.A N ARG 121.A O no hydrogen 3.256 N/A LYS 126.A N THR 122.A O no hydrogen 2.791 N/A ALA 127.A N THR 123.A O no hydrogen 2.826 N/A ASP 128.A N ILE 125.A O no hydrogen 2.896 N/A LEU 129.A N ALA 124.A O no hydrogen 3.005 N/A THR 135.A N ILE 189.A O no hydrogen 3.020 N/A THR 135.A OG1 GLY 137.A O no hydrogen 2.607 N/A ILE 139.A N VAL 187.A O no hydrogen 3.018 N/A ALA 145.A N GLU 143.A O no hydrogen 2.590 N/A LYS 146.A NZ GLU 143.A OE1 no hydrogen 3.390 N/A GLU 147.A N LEU 144.A O no hydrogen 2.846 N/A ALA 152.A N PHE 148.A O no hydrogen 3.331 N/A LEU 156.A N VAL 165.A O no hydrogen 2.960 N/A MET 157.A N GLU 190.A O no hydrogen 2.614 N/A LYS 159.A N TYR 188.A O no hydrogen 3.015 N/A THR 161.A N GLU 186.A O no hydrogen 2.999 N/A THR 161.A OG1 GLU 186.A O no hydrogen 3.355 N/A ARG 163.A NH2 ALA 174.A O no hydrogen 3.219 N/A VAL 165.A N LEU 156.A O no hydrogen 2.838 N/A ASP 173.A N SER 169.A O no hydrogen 3.014 N/A LYS 179.A NZ PHE 175.A O no hydrogen 3.112 N/A GLU 183.A N SER 180.A O no hydrogen 3.079 N/A LYS 184.A N GLU 181.A O no hydrogen 3.451 N/A TYR 188.A N LYS 159.A O no hydrogen 3.090 N/A GLU 190.A N MET 157.A O no hydrogen 2.767 N/A ARG 191.A N PRO 133.A O no hydrogen 3.315 N/A LYS 197.A NZ ASP 218.A OD1 no hydrogen 2.701 N/A LYS 197.A NZ TYR 432.A O no hydrogen 3.156 N/A HIS 198.A N SER 220.A OG no hydrogen 3.074 N/A ILE 199.A N PHE 266.A O no hydrogen 3.117 N/A GLU 200.A N ARG 217.A O no hydrogen 3.035 N/A VAL 201.A N VAL 264.A O no hydrogen 2.836 N/A GLN 202.A N PHE 215.A O no hydrogen 3.072 N/A GLN 202.A NE2 VAL 203.A O no hydrogen 3.233 N/A VAL 203.A N GLY 262.A O no hydrogen 2.956 N/A ILE 204.A N VAL 212.A O no hydrogen 2.940 N/A GLY 205.A N ASN 260.A O no hydrogen 3.176 N/A ASP 206.A N ASN 210.A O no hydrogen 2.791 N/A HIS 208.A N ASP 206.A OD2 no hydrogen 2.877 N/A ASN 210.A N ASP 206.A OD2 no hydrogen 2.813 N/A VAL 212.A N ILE 204.A O no hydrogen 2.830 N/A HIS 213.A N GLN 320.A OE1 no hydrogen 2.911 N/A LEU 214.A N GLN 202.A O no hydrogen 2.587 N/A PHE 215.A N HIS 213.A ND1 no hydrogen 3.019 N/A GLU 216.A N GLU 216.A OE2 no hydrogen 2.640 N/A ARG 217.A N GLU 200.A O no hydrogen 2.705 N/A ARG 217.A NE GLU 200.A OE1 no hydrogen 2.989 N/A ARG 217.A NH1 GLN 202.A OE1 no hydrogen 2.904 N/A ARG 217.A NH1 THR 289.A OG1 no hydrogen 2.868 N/A ARG 217.A NH2 GLN 202.A OE1 no hydrogen 2.903 N/A ASP 218.A N VAL 231.A O no hydrogen 2.701 N/A CYS 219.A N HIS 198.A O no hydrogen 2.711 N/A CYS 219.A SG ARG 217.A O no hydrogen 3.665 N/A SER 220.A N ASP 218.A OD2 no hydrogen 3.066 N/A SER 220.A OG ASP 218.A OD2 no hydrogen 2.546 N/A GLN 222.A NE2 CYS 219.A O no hydrogen 2.996 N/A GLN 226.A NE2 GLU 337.A OE1 no hydrogen 3.556 N/A LYS 227.A NZ GLU 200.A OE2 no hydrogen 2.813 N/A LYS 227.A NZ GLU 285.A OE1 no hydrogen 2.761 N/A VAL 229.A N VAL 221.A O no hydrogen 2.864 N/A GLU 230.A N GLN 331.A O no hydrogen 3.092 N/A VAL 231.A N ASP 218.A O no hydrogen 2.758 N/A ALA 232.A N ALA 329.A O no hydrogen 2.907 N/A SER 234.A N GLU 216.A OE1 no hydrogen 2.955 N/A SER 234.A OG ASP 218.A OD1 no hydrogen 3.473 N/A LEU 241.A N SER 238.A OG no hydrogen 3.313 N/A ARG 242.A N SER 238.A O no hydrogen 3.176 N/A GLN 243.A N PRO 239.A O no hydrogen 3.300 N/A ARG 244.A N THR 240.A O no hydrogen 3.166 N/A ARG 244.A NH1 ASP 271.A O no hydrogen 3.111 N/A ARG 244.A NH2 ASP 271.A O no hydrogen 3.513 N/A ILE 245.A N LEU 241.A O no hydrogen 3.104 N/A CYS 246.A N ARG 242.A O no hydrogen 2.990 N/A CYS 246.A SG ARG 242.A O no hydrogen 3.328 N/A ASP 247.A N GLN 243.A O no hydrogen 2.737 N/A ALA 248.A N ARG 244.A O no hydrogen 3.127 N/A ALA 249.A N ILE 245.A O no hydrogen 3.156 N/A ILE 250.A N CYS 246.A O no hydrogen 2.998 N/A GLN 251.A N ASP 247.A O no hydrogen 2.666 N/A LEU 252.A N ALA 248.A O no hydrogen 2.971 N/A MET 253.A N ALA 249.A O no hydrogen 3.031 N/A GLU 254.A N ILE 250.A O no hydrogen 2.761 N/A ASN 255.A N GLN 251.A O no hydrogen 3.161 N/A ILE 256.A N LEU 252.A O no hydrogen 3.172 N/A LYS 257.A N GLU 254.A O no hydrogen 3.234 N/A TYR 258.A N MET 253.A O no hydrogen 2.825 N/A TYR 258.A OH ALA 261.A O no hydrogen 2.943 N/A ASN 260.A N GLY 205.A O no hydrogen 2.584 N/A ASN 260.A ND2 GLY 105.A O no hydrogen 3.282 N/A ASN 260.A ND2 GLN 301.A O no hydrogen 3.526 N/A ALA 261.A N ASN 260.A OD1 no hydrogen 3.032 N/A GLY 262.A N VAL 203.A O no hydrogen 2.861 N/A THR 263.A N ASN 279.A O no hydrogen 2.922 N/A VAL 264.A N VAL 201.A O no hydrogen 3.116 N/A GLU 265.A N GLU 277.A O no hydrogen 2.872 N/A PHE 266.A N ILE 199.A O no hydrogen 2.813 N/A LEU 267.A N PHE 274.A O no hydrogen 2.912 N/A VAL 268.A N LYS 197.A O no hydrogen 2.806 N/A SER 269.A N GLU 272.A O no hydrogen 3.189 N/A GLU 272.A N SER 269.A O no hydrogen 2.926 N/A PHE 274.A N LEU 267.A O no hydrogen 2.854 N/A PHE 275.A N PRO 130.A O no hydrogen 2.731 N/A ILE 276.A N GLU 265.A O no hydrogen 2.827 N/A ASN 279.A N THR 263.A O no hydrogen 2.801 N/A ARG 281.A NE GLU 88.A OE1 no hydrogen 2.885 N/A ARG 281.A NH1 VAL 282.A O no hydrogen 3.078 N/A ARG 281.A NH2 GLU 88.A OE1 no hydrogen 2.792 N/A GLN 283.A NE2 GLU 200.A OE1 no hydrogen 2.615 N/A GLU 285.A N GLU 285.A OE2 no hydrogen 2.706 N/A HIS 286.A N GLN 283.A O no hydrogen 3.114 N/A HIS 286.A ND1 GLN 283.A O no hydrogen 2.749 N/A THR 289.A N HIS 286.A O no hydrogen 3.245 N/A GLU 290.A N HIS 286.A O no hydrogen 3.336 N/A MET 291.A N THR 287.A O no hydrogen 2.985 N/A VAL 292.A N THR 289.A O no hydrogen 3.113 N/A THR 293.A N THR 289.A O no hydrogen 2.903 N/A THR 293.A OG1 THR 289.A O no hydrogen 2.626 N/A GLY 294.A N GLU 290.A O no hydrogen 2.851 N/A ILE 297.A N GLU 290.A OE1 no hydrogen 2.965 N/A LYS 299.A N ASP 296.A OD2 no hydrogen 2.983 N/A LYS 299.A NZ GLU 23.A OE1 no hydrogen 3.063 N/A THR 300.A N ASP 296.A O no hydrogen 2.894 N/A THR 300.A OG1 ASP 296.A O no hydrogen 2.666 N/A GLN 301.A N ILE 297.A O no hydrogen 2.823 N/A ILE 302.A N VAL 298.A O no hydrogen 3.153 N/A LEU 303.A N LYS 299.A O no hydrogen 3.051 N/A VAL 304.A N THR 300.A O no hydrogen 2.870 N/A ALA 305.A N GLN 301.A O no hydrogen 3.004 N/A ALA 306.A N ILE 302.A O no hydrogen 2.958 N/A ALA 306.A N LEU 303.A O no hydrogen 3.002 N/A GLY 307.A N VAL 304.A O no hydrogen 2.990 N/A ALA 308.A N LEU 303.A O no hydrogen 2.923 N/A LEU 310.A N ASP 206.A OD1 no hydrogen 3.104 N/A MET 317.A N LEU 310.A O no hydrogen 2.844 N/A GLN 320.A NE2 HIS 213.A O no hydrogen 3.161 N/A GLN 320.A NE2 GLN 320.A O no hydrogen 3.207 N/A ASP 322.A N GLN 319.A O no hydrogen 2.805 N/A ILE 323.A N GLN 320.A O no hydrogen 3.069 N/A LEU 326.A N VAL 292.A O no hydrogen 2.869 N/A TYR 328.A N ALA 389.A O no hydrogen 2.898 N/A ALA 329.A N ALA 232.A O no hydrogen 2.723 N/A ILE 330.A N THR 387.A O no hydrogen 2.951 N/A GLN 331.A N GLU 230.A O no hydrogen 2.958 N/A GLN 331.A NE2 SER 386.A OG no hydrogen 3.178 N/A CYS 332.A N LEU 385.A O no hydrogen 2.994 N/A ARG 333.A NH1 GLU 230.A OE1 no hydrogen 3.162 N/A ARG 333.A NH1 GLU 230.A OE2 no hydrogen 3.246 N/A ARG 333.A NH2 GLU 230.A OE2 no hydrogen 3.274 N/A ILE 334.A N VAL 383.A O no hydrogen 2.761 N/A THR 335.A N ASN 414.A OD1 no hydrogen 3.094 N/A THR 336.A OG1 SER 380.A OG no hydrogen 3.004 N/A GLU 337.A N THR 335.A OG1 no hydrogen 3.271 N/A ASP 338.A N MET 344.A O no hydrogen 3.312 N/A LEU 340.A N ASP 338.A OD1 no hydrogen 3.451 N/A ASN 341.A N ASP 338.A O no hydrogen 3.028 N/A PHE 343.A N ASP 338.A O no hydrogen 2.954 N/A ASP 346.A N THR 336.A OG1 no hydrogen 3.080 N/A ILE 351.A N ARG 409.A O no hydrogen 2.984 N/A ARG 354.A N ARG 407.A O no hydrogen 2.749 N/A ARG 354.A NH2 ALA 1039.A O no hydrogen 2.700 N/A SER 356.A OG GLU 405.A OE2 no hydrogen 2.809 N/A VAL 361.A N GLY 358.A O no hydrogen 3.022 N/A ARG 362.A N SER 386.A O no hydrogen 2.750 N/A ASP 364.A N LYS 384.A O no hydrogen 3.020 N/A GLY 366.A N LEU 382.A O no hydrogen 3.080 N/A ASP 367.A N LEU 381.A O no hydrogen 2.940 N/A ILE 374.A N GLY 348.A O no hydrogen 3.256 N/A TYR 378.A OH SER 33.A OG no hydrogen 2.720 N/A TYR 378.A OH PRO 57.A O no hydrogen 2.922 N/A SER 380.A OG THR 336.A OG1 no hydrogen 3.004 N/A LEU 382.A N ILE 334.A O no hydrogen 2.906 N/A VAL 383.A N ILE 334.A O no hydrogen 3.304 N/A LYS 384.A N ASP 364.A O no hydrogen 2.760 N/A LYS 384.A NZ GLU 12.A OE1 no hydrogen 3.005 N/A LYS 384.A NZ GLU 12.A OE2 no hydrogen 3.058 N/A LYS 384.A NZ VAL 284.A O no hydrogen 2.936 N/A LEU 385.A N CYS 332.A O no hydrogen 2.951 N/A SER 386.A N ARG 362.A O no hydrogen 2.902 N/A THR 387.A N ILE 330.A O no hydrogen 2.924 N/A THR 387.A OG1 ALA 395.A O no hydrogen 3.071 N/A HIS 388.A ND1 TYR 328.A O no hydrogen 3.339 N/A ALA 389.A N TYR 328.A O no hydrogen 3.193 N/A ALA 395.A N SER 391.A O no hydrogen 3.060 N/A GLU 396.A N PHE 392.A O no hydrogen 3.025 N/A GLU 397.A N LYS 393.A O no hydrogen 3.056 N/A LYS 398.A N GLN 394.A O no hydrogen 3.051 N/A LYS 398.A NZ PHE 359.A O no hydrogen 3.173 N/A MET 399.A N ALA 395.A O no hydrogen 2.753 N/A VAL 400.A N GLU 396.A O no hydrogen 2.749 N/A ARG 401.A N GLU 397.A O no hydrogen 3.352 N/A ARG 401.A NE ARG 401.A O no hydrogen 3.415 N/A SER 402.A N LYS 398.A O no hydrogen 3.063 N/A SER 402.A OG LYS 398.A O no hydrogen 3.257 N/A SER 402.A OG MET 399.A O no hydrogen 2.655 N/A LEU 403.A N MET 399.A O no hydrogen 3.012 N/A ARG 404.A N VAL 400.A O no hydrogen 3.141 N/A GLU 405.A N ARG 401.A O no hydrogen 3.044 N/A MET 406.A N SER 402.A O no hydrogen 2.972 N/A ARG 407.A N ARG 354.A O no hydrogen 3.025 N/A ARG 407.A NE GLU 405.A O no hydrogen 3.267 N/A ARG 407.A NH2 GLU 405.A O no hydrogen 3.294 N/A ARG 409.A NE ASP 451.A OD2 no hydrogen 3.047 N/A ARG 409.A NH2 ASP 451.A OD1 no hydrogen 2.676 N/A ARG 409.A NH2 ASP 451.A OD2 no hydrogen 3.309 N/A LYS 412.A N ASP 346.A OD2 no hydrogen 3.366 N/A ASN 414.A ND2 ARG 333.A O no hydrogen 2.975 N/A LEU 418.A N ASN 414.A O no hydrogen 2.888 N/A ILE 419.A N ILE 415.A O no hydrogen 3.063 N/A ASN 420.A N PRO 416.A O no hydrogen 3.309 N/A ASN 420.A ND2 GLU 442.A O no hydrogen 3.338 N/A ASN 420.A ND2 LEU 443.A O no hydrogen 2.959 N/A ASN 420.A ND2 ASP 445.A O no hydrogen 3.265 N/A VAL 421.A N PHE 417.A O no hydrogen 3.256 N/A MET 422.A N LEU 418.A O no hydrogen 3.295 N/A LYS 423.A N ILE 419.A O no hydrogen 2.961 N/A ASN 424.A N VAL 421.A O no hydrogen 3.229 N/A LYS 425.A NZ LYS 425.A O no hydrogen 3.530 N/A LYS 426.A N ASN 424.A OD1 no hydrogen 3.012 N/A THR 428.A N ASN 424.A O no hydrogen 2.991 N/A THR 428.A OG1 MET 422.A O no hydrogen 3.306 N/A THR 428.A OG1 ASN 424.A O no hydrogen 2.702 N/A SER 429.A N LYS 425.A O no hydrogen 2.948 N/A SER 429.A OG LYS 425.A O no hydrogen 3.198 N/A SER 429.A OG LYS 426.A O no hydrogen 3.006 N/A THR 440.A OG1 PHE 436.A O no hydrogen 3.194 N/A PHE 444.A N PRO 441.A O no hydrogen 3.348 N/A ASP 445.A N GLU 442.A O no hydrogen 3.379 N/A ARG 452.A N LEU 450.A O no hydrogen 2.848 N/A LYS 455.A N ASP 451.A O no hydrogen 2.992 N/A LYS 455.A NZ ASN 980.A O no hydrogen 2.732 N/A THR 456.A N ARG 452.A O no hydrogen 2.914 N/A THR 456.A OG1 ARG 452.A O no hydrogen 2.780 N/A LEU 457.A N GLY 453.A O no hydrogen 2.965 N/A GLU 458.A N THR 454.A O no hydrogen 2.893 N/A TYR 459.A N LYS 455.A O no hydrogen 3.260 N/A TYR 459.A OH PHE 993.A O no hydrogen 2.654 N/A ILE 460.A N THR 456.A O no hydrogen 3.171 N/A GLY 461.A N LEU 457.A O no hydrogen 3.304 N/A ASN 462.A N GLU 458.A O no hydrogen 3.020 N/A VAL 463.A N TYR 459.A O no hydrogen 2.992 N/A THR 464.A N ILE 460.A O no hydrogen 2.846 N/A THR 464.A OG1 ILE 460.A O no hydrogen 2.807 N/A THR 464.A OG1 MET 997.A O no hydrogen 3.437 N/A ILE 465.A N GLY 461.A O no hydrogen 2.913 N/A ASN 466.A N ASN 462.A O no hydrogen 2.730 N/A ASN 466.A ND2 ASN 462.A O no hydrogen 3.657 N/A ASN 466.A ND2 LYS 1045.A O no hydrogen 2.938 N/A GLY 467.A N VAL 463.A O no hydrogen 2.764 N/A VAL 471.A N PHE 468.A O no hydrogen 3.129 N/A GLU 472.A N ASP 804.A OD1 no hydrogen 2.801 N/A ARG 474.A NE GLU 472.A O no hydrogen 3.180 N/A ARG 474.A NH2 GLU 472.A O no hydrogen 3.366 N/A ARG 474.A NH2 ASP 804.A OD2 no hydrogen 2.579 N/A LYS 476.A NZ THR 992.A OG1 no hydrogen 3.213 N/A LYS 476.A NZ GLY 996.A O no hydrogen 2.790 N/A LYS 476.A NZ GLU 1001.A OE1 no hydrogen 2.780 N/A LYS 476.A NZ GLU 1001.A OE2 no hydrogen 3.197 N/A VAL 487.A N SER 549.A OG no hydrogen 3.118 N/A ILE 492.A N SER 488.A O no hydrogen 3.258 N/A ALA 493.A N SER 489.A O no hydrogen 3.204 N/A THR 498.A OG1 PHE 559.A O no hydrogen 2.833 N/A LYS 499.A N ASN 593.A O no hydrogen 2.902 N/A LYS 499.A NZ ASP 629.A OD2 no hydrogen 3.282 N/A GLN 500.A NE2 ASN 593.A O no hydrogen 3.492 N/A LEU 501.A N GLY 497.A O no hydrogen 3.288 N/A LEU 502.A N THR 498.A O no hydrogen 3.163 N/A ASP 503.A N LYS 499.A O no hydrogen 3.331 N/A GLU 504.A N LEU 501.A O no hydrogen 2.996 N/A VAL 505.A N LEU 501.A O no hydrogen 2.831 N/A GLY 506.A N LEU 502.A O no hydrogen 2.959 N/A VAL 510.A N GLY 506.A O no hydrogen 2.851 N/A ALA 511.A N PRO 507.A O no hydrogen 3.216 N/A GLU 512.A N LYS 508.A O no hydrogen 3.128 N/A TRP 513.A N GLY 509.A O no hydrogen 2.883 N/A VAL 514.A N VAL 510.A O no hydrogen 3.129 N/A LYS 515.A N ALA 511.A O no hydrogen 3.265 N/A LYS 515.A NZ GLU 512.A OE1 no hydrogen 2.795 N/A LYS 515.A NZ ASP 722.A O no hydrogen 3.211 N/A GLN 517.A N TRP 513.A O no hydrogen 3.327 N/A GLN 517.A NE2 TRP 513.A O no hydrogen 3.108 N/A VAL 520.A N HIS 780.A O no hydrogen 3.216 N/A LEU 521.A N ASP 749.A O no hydrogen 3.193 N/A THR 523.A N ILE 751.A O no hydrogen 2.861 N/A THR 523.A OG1 SER 560.A OG no hydrogen 2.898 N/A THR 523.A OG1 HIS 726.A NE2 no hydrogen 3.289 N/A ASP 524.A N SER 560.A O no hydrogen 3.297 N/A THR 525.A N THR 753.A O no hydrogen 2.982 N/A THR 525.A OG1 THR 753.A O no hydrogen 3.267 N/A THR 526.A N ASP 524.A OD2 no hydrogen 3.189 N/A THR 526.A OG1 ASP 524.A OD1 no hydrogen 2.673 N/A THR 526.A OG1 ASP 524.A OD2 no hydrogen 3.130 N/A ARG 528.A N THR 525.A O no hydrogen 3.077 N/A ARG 528.A NH2 GLU 562.A OE2 no hydrogen 2.650 N/A ASP 529.A N GLU 562.A OE1 no hydrogen 3.268 N/A ALA 530.A N THR 525.A O no hydrogen 2.906 N/A GLN 532.A N ARG 528.A O no hydrogen 2.978 N/A SER 533.A N ASP 529.A O no hydrogen 2.935 N/A SER 533.A OG ASP 529.A O no hydrogen 2.996 N/A SER 533.A OG THR 762.A O no hydrogen 3.261 N/A LEU 534.A N ALA 530.A O no hydrogen 2.987 N/A LEU 535.A N HIS 531.A O no hydrogen 2.950 N/A THR 537.A N HIS 531.A O no hydrogen 3.038 N/A THR 537.A OG1 THR 567.A OG1 no hydrogen 2.717 N/A ARG 538.A N LEU 535.A O no hydrogen 2.996 N/A ARG 538.A NE ALA 536.A O no hydrogen 3.039 N/A ARG 540.A N TYR 802.A OH no hydrogen 2.763 N/A ARG 540.A NH1 LEU 988.A O no hydrogen 2.817 N/A ARG 540.A NH1 THR 990.A OG1 no hydrogen 3.081 N/A ARG 540.A NH2 LEU 988.A O no hydrogen 3.030 N/A THR 541.A N GLU 578.A OE1 no hydrogen 2.978 N/A THR 541.A OG1 GLU 578.A OE1 no hydrogen 2.811 N/A ILE 545.A N THR 541.A O no hydrogen 2.763 N/A ASN 546.A N LYS 542.A O no hydrogen 3.200 N/A ALA 548.A N ILE 545.A O no hydrogen 3.247 N/A THR 551.A N ILE 547.A O no hydrogen 2.722 N/A THR 551.A OG1 ILE 547.A O no hydrogen 2.632 N/A ALA 552.A N ALA 548.A O no hydrogen 2.912 N/A ASP 553.A N LYS 550.A O no hydrogen 2.999 N/A VAL 554.A N LYS 550.A O no hydrogen 2.906 N/A PHE 555.A N THR 551.A O no hydrogen 3.044 N/A LYS 556.A N ASP 553.A O no hydrogen 3.359 N/A GLY 558.A N PHE 555.A O no hydrogen 2.812 N/A PHE 559.A N LEU 522.A O no hydrogen 2.897 N/A SER 560.A OG THR 523.A OG1 no hydrogen 2.898 N/A SER 560.A OG GLN 597.A OE1 no hydrogen 2.869 N/A LEU 561.A N LEU 595.A O no hydrogen 2.736 N/A GLU 562.A N ASP 524.A O no hydrogen 2.975 N/A MET 563.A N GLN 597.A O no hydrogen 3.131 N/A TRP 564.A NE1 PRO 580.A O no hydrogen 2.736 N/A THR 567.A OG1 THR 537.A OG1 no hydrogen 2.717 N/A THR 568.A N GLY 565.A O no hydrogen 3.209 N/A THR 568.A OG1 GLY 565.A O no hydrogen 2.686 N/A VAL 571.A N THR 567.A O no hydrogen 3.082 N/A ALA 572.A N THR 568.A O no hydrogen 2.786 N/A TYR 573.A N PHE 569.A O no hydrogen 3.428 N/A TYR 573.A OH SER 964.A OG no hydrogen 2.717 N/A ASN 574.A N ASP 570.A O no hydrogen 2.977 N/A PHE 575.A N VAL 571.A O no hydrogen 2.904 N/A LEU 576.A N VAL 571.A O no hydrogen 3.038 N/A LYS 577.A NZ ASN 574.A O no hydrogen 3.016 N/A GLU 578.A N ALA 572.A O no hydrogen 2.859 N/A TRP 581.A NE1 SER 964.A OG no hydrogen 2.921 N/A GLU 582.A N ASN 579.A O no hydrogen 2.969 N/A ARG 583.A N ASN 579.A O no hydrogen 3.212 N/A ARG 583.A NE THR 541.A OG1 no hydrogen 3.025 N/A ARG 583.A NH2 GLU 578.A OE1 no hydrogen 2.792 N/A LEU 584.A N PRO 580.A O no hydrogen 3.194 N/A GLU 585.A N TRP 581.A O no hydrogen 3.037 N/A ARG 586.A N GLU 582.A O no hydrogen 2.923 N/A LEU 587.A N ARG 583.A O no hydrogen 3.126 N/A ARG 588.A N LEU 584.A O no hydrogen 2.840 N/A ARG 588.A NE GLY 627.A O no hydrogen 3.301 N/A ARG 588.A NH1 VAL 594.A O no hydrogen 3.435 N/A ARG 588.A NH2 VAL 594.A O no hydrogen 3.520 N/A ARG 588.A NH2 GLY 627.A O no hydrogen 3.074 N/A LYS 589.A N GLU 585.A O no hydrogen 3.132 N/A ALA 590.A N ARG 586.A O no hydrogen 3.271 N/A ILE 591.A N LEU 587.A O no hydrogen 2.813 N/A ASN 593.A ND2 ALA 552.A O no hydrogen 3.176 N/A LEU 595.A N THR 498.A OG1 no hydrogen 3.136 N/A PHE 596.A N ASP 629.A OD1 no hydrogen 3.109 N/A GLN 597.A N LEU 561.A O no hydrogen 2.779 N/A MET 598.A N VAL 630.A O no hydrogen 2.958 N/A LEU 599.A N TRP 564.A O no hydrogen 3.348 N/A LEU 600.A N ARG 632.A O no hydrogen 2.891 N/A ARG 601.A N ALA 605.A O no hydrogen 2.915 N/A ALA 602.A N PHE 634.A O no hydrogen 2.781 N/A SER 603.A OG ASN 604.A OD1 no hydrogen 3.021 N/A ASN 604.A ND2 LYS 609.A O no hydrogen 3.025 N/A ALA 605.A N ARG 601.A O no hydrogen 3.055 N/A GLY 607.A N ASN 604.A O no hydrogen 2.722 N/A TYR 608.A N TYR 611.A OH no hydrogen 3.349 N/A LYS 609.A NZ TYR 608.A OH no hydrogen 3.500 N/A ASN 610.A ND2 GLU 906.A O no hydrogen 3.073 N/A TYR 611.A OH LEU 967.A O no hydrogen 2.645 N/A ASN 614.A ND2 VAL 940.A O no hydrogen 2.845 N/A VAL 615.A N PRO 612.A O no hydrogen 3.080 N/A HIS 617.A N ASP 613.A O no hydrogen 2.978 N/A LYS 618.A N ASN 614.A O no hydrogen 3.152 N/A LYS 618.A NZ GLU 959.A OE2 no hydrogen 2.624 N/A PHE 619.A N VAL 615.A O no hydrogen 3.030 N/A VAL 620.A N ILE 616.A O no hydrogen 2.902 N/A GLN 621.A N HIS 617.A O no hydrogen 2.793 N/A GLN 621.A NE2 HIS 617.A O no hydrogen 3.666 N/A GLN 621.A NE2 ALA 649.A O no hydrogen 2.952 N/A GLU 622.A N LYS 618.A O no hydrogen 2.938 N/A SER 623.A N PHE 619.A O no hydrogen 2.962 N/A SER 623.A OG PHE 619.A O no hydrogen 2.576 N/A ALA 624.A N VAL 620.A O no hydrogen 3.064 N/A LYS 625.A N GLN 621.A O no hydrogen 3.218 N/A LYS 625.A NZ GLU 622.A OE1 no hydrogen 3.091 N/A ALA 626.A N GLU 622.A O no hydrogen 3.070 N/A GLY 627.A N SER 623.A O no hydrogen 3.158 N/A GLY 627.A N ALA 624.A O no hydrogen 3.254 N/A ILE 628.A N SER 623.A O no hydrogen 3.035 N/A ASP 629.A N PHE 596.A O no hydrogen 2.861 N/A VAL 630.A N PHE 596.A O no hydrogen 2.913 N/A PHE 631.A N ILE 656.A O no hydrogen 2.714 N/A ARG 632.A N MET 598.A O no hydrogen 3.039 N/A ARG 632.A NE GLU 658.A OE1 no hydrogen 2.919 N/A ARG 632.A NH1 HIS 728.A ND1 no hydrogen 3.261 N/A ARG 632.A NH1 ASP 752.A OD2 no hydrogen 2.789 N/A ARG 632.A NH2 ASP 752.A OD1 no hydrogen 3.229 N/A ARG 632.A NH2 ASP 752.A OD2 no hydrogen 2.866 N/A ILE 633.A N GLU 658.A O no hydrogen 2.787 N/A PHE 634.A N LEU 600.A O no hydrogen 3.159 N/A SER 636.A OG THR 863.A O no hydrogen 2.649 N/A LEU 637.A N ASP 635.A OD1 no hydrogen 3.018 N/A ASN 638.A N ASP 635.A O no hydrogen 2.936 N/A ASN 638.A ND2 CYS 662.A O no hydrogen 3.064 N/A ASN 638.A ND2 TYR 680.A OH no hydrogen 3.039 N/A TRP 639.A N ASP 635.A OD1 no hydrogen 2.888 N/A GLN 642.A N TRP 639.A O no hydrogen 3.131 N/A GLN 642.A NE2 ASP 635.A OD2 no hydrogen 2.740 N/A GLN 642.A NE2 ILE 907.A O no hydrogen 3.272 N/A MET 643.A N VAL 640.A O no hydrogen 2.739 N/A LYS 644.A NZ ASP 641.A OD1 no hydrogen 3.222 N/A ASN 647.A N MET 643.A O no hydrogen 3.028 N/A ASN 647.A ND2 GLU 691.A O no hydrogen 3.264 N/A GLU 648.A N LYS 644.A O no hydrogen 2.958 N/A ALA 649.A N VAL 645.A O no hydrogen 3.095 N/A VAL 650.A N ALA 646.A O no hydrogen 3.089 N/A GLN 651.A N ASN 647.A O no hydrogen 2.884 N/A GLN 651.A NE2 ASN 647.A OD1 no hydrogen 3.284 N/A GLN 651.A NE2 GLY 692.A O no hydrogen 2.761 N/A GLN 651.A NE2 HIS 694.A NE2 no hydrogen 3.518 N/A GLU 652.A N GLU 648.A O no hydrogen 2.964 N/A ALA 653.A N ALA 649.A O no hydrogen 3.095 N/A GLY 654.A N GLN 651.A O no hydrogen 3.281 N/A LYS 655.A N VAL 650.A O no hydrogen 3.388 N/A LYS 655.A NZ ILE 628.A O no hydrogen 3.548 N/A LYS 655.A NZ ASP 629.A OD2 no hydrogen 2.868 N/A ILE 656.A N ASP 629.A O no hydrogen 2.817 N/A SER 657.A OG ASN 647.A OD1 no hydrogen 3.224 N/A GLU 658.A N PHE 631.A O no hydrogen 2.791 N/A GLY 659.A N ILE 695.A O no hydrogen 2.893 N/A THR 660.A N ILE 633.A O no hydrogen 2.958 N/A THR 660.A OG1 ILE 633.A O no hydrogen 2.576 N/A THR 660.A OG1 GLU 658.A O no hydrogen 3.388 N/A ILE 661.A N ALA 697.A O no hydrogen 2.704 N/A CYS 662.A N ASN 638.A OD1 no hydrogen 2.989 N/A CYS 662.A SG ASP 635.A O no hydrogen 3.875 N/A TYR 663.A N LYS 699.A O no hydrogen 2.927 N/A THR 664.A N TYR 681.A OH no hydrogen 3.155 N/A GLY 665.A N GLU 820.A OE2 no hydrogen 3.064 N/A ILE 667.A N TYR 663.A OH no hydrogen 3.146 N/A ASN 669.A N ASP 666.A O no hydrogen 2.745 N/A GLU 671.A N ASN 669.A OD1 no hydrogen 2.839 N/A ARG 672.A N ASN 669.A O no hydrogen 3.119 N/A ARG 672.A NE ARG 672.A O no hydrogen 2.868 N/A ARG 672.A NH1 GLU 820.A OE2 no hydrogen 2.539 N/A ARG 672.A NH2 ASP 858.A OD1 no hydrogen 3.048 N/A SER 673.A OG ASP 858.A OD1 no hydrogen 2.943 N/A TYR 676.A N SER 673.A OG no hydrogen 3.303 N/A TYR 676.A OH ASP 858.A O no hydrogen 2.723 N/A TYR 680.A N THR 677.A O no hydrogen 2.985 N/A TYR 681.A N THR 677.A O no hydrogen 3.276 N/A TYR 681.A OH THR 664.A O no hydrogen 2.641 N/A VAL 682.A N LEU 678.A O no hydrogen 3.167 N/A LYS 683.A N GLU 679.A O no hydrogen 3.185 N/A LEU 684.A N TYR 680.A O no hydrogen 3.044 N/A ALA 685.A N TYR 681.A O no hydrogen 2.892 N/A LYS 686.A N VAL 682.A O no hydrogen 2.974 N/A LYS 686.A NZ ALA 720.A O no hydrogen 3.305 N/A GLU 687.A N LYS 683.A O no hydrogen 3.095 N/A LEU 688.A N LEU 684.A O no hydrogen 2.923 N/A GLU 689.A N ALA 685.A O no hydrogen 2.869 N/A ARG 690.A N LYS 686.A O no hydrogen 3.285 N/A GLU 691.A N GLU 687.A O no hydrogen 3.391 N/A GLY 692.A N GLU 689.A O no hydrogen 2.848 N/A HIS 694.A N SER 657.A O no hydrogen 2.916 N/A ILE 695.A N SER 657.A O no hydrogen 3.371 N/A LEU 696.A N PRO 724.A O no hydrogen 3.110 N/A ALA 697.A N GLY 659.A O no hydrogen 2.796 N/A ILE 698.A N HIS 726.A O no hydrogen 3.027 N/A LYS 699.A N ILE 661.A O no hydrogen 2.896 N/A ASP 700.A N HIS 728.A O no hydrogen 2.642 N/A GLY 703.A N ASP 700.A O no hydrogen 3.035 N/A LEU 704.A N ASP 700.A OD1 no hydrogen 2.810 N/A LEU 705.A N ASP 700.A OD2 no hydrogen 2.699 N/A LYS 706.A NZ ASP 666.A OD1 no hydrogen 2.789 N/A ALA 710.A N LYS 706.A O no hydrogen 2.898 N/A TYR 711.A N PRO 707.A O no hydrogen 3.250 N/A GLU 712.A N LYS 708.A O no hydrogen 2.956 N/A LEU 713.A N ALA 709.A O no hydrogen 2.760 N/A ILE 714.A N ALA 710.A O no hydrogen 2.988 N/A GLY 715.A N TYR 711.A O no hydrogen 3.056 N/A GLU 716.A N GLU 712.A O no hydrogen 3.101 N/A LEU 717.A N LEU 713.A O no hydrogen 2.902 N/A LYS 718.A N ILE 714.A O no hydrogen 2.996 N/A LYS 718.A NZ ASP 749.A OD1 no hydrogen 2.859 N/A LYS 718.A NZ ASP 749.A OD2 no hydrogen 2.967 N/A SER 719.A OG GLY 715.A O no hydrogen 3.276 N/A ALA 720.A N GLU 716.A O no hydrogen 2.841 N/A VAL 721.A N LEU 717.A O no hydrogen 2.883 N/A ASP 722.A N GLU 689.A OE1 no hydrogen 2.862 N/A ILE 725.A N ASP 749.A OD2 no hydrogen 2.891 N/A HIS 726.A N LEU 696.A O no hydrogen 2.882 N/A HIS 726.A ND1 GLU 658.A OE2 no hydrogen 2.579 N/A HIS 726.A NE2 ASP 752.A OD1 no hydrogen 2.518 N/A LEU 727.A N ILE 750.A O no hydrogen 2.712 N/A HIS 728.A N ILE 698.A O no hydrogen 2.806 N/A HIS 728.A ND1 ASP 752.A OD2 no hydrogen 2.498 N/A THR 729.A N TYR 740.A OH no hydrogen 3.126 N/A THR 729.A OG1 ASP 700.A OD2 no hydrogen 3.061 N/A THR 729.A OG1 HIS 730.A O no hydrogen 3.223 N/A HIS 730.A ND1 THR 762.A O no hydrogen 2.618 N/A ASP 731.A N SER 763.A O no hydrogen 2.842 N/A SER 733.A OG TYR 817.A OH no hydrogen 3.139 N/A GLY 734.A N ASP 731.A O no hydrogen 2.967 N/A ASN 735.A N SER 733.A OG no hydrogen 2.874 N/A GLY 736.A N ASP 731.A OD2 no hydrogen 2.844 N/A THR 739.A N ASN 735.A O no hydrogen 2.825 N/A THR 739.A OG1 LEU 705.A O no hydrogen 2.757 N/A THR 739.A OG1 ASN 735.A O no hydrogen 3.033 N/A TYR 740.A N GLY 736.A O no hydrogen 2.898 N/A TYR 740.A OH ASP 752.A O no hydrogen 2.476 N/A LYS 741.A N LEU 737.A O no hydrogen 2.803 N/A LYS 741.A NZ ASP 745.A OD1 no hydrogen 2.810 N/A GLN 742.A N LEU 738.A O no hydrogen 2.916 N/A ALA 743.A N THR 739.A O no hydrogen 2.923 N/A ILE 744.A N TYR 740.A O no hydrogen 2.844 N/A ASP 745.A N LYS 741.A O no hydrogen 2.953 N/A ALA 746.A N GLN 742.A O no hydrogen 3.150 N/A ALA 746.A N ALA 743.A O no hydrogen 3.105 N/A GLY 747.A N ILE 744.A O no hydrogen 2.985 N/A VAL 748.A N ALA 743.A O no hydrogen 3.000 N/A ASP 749.A N ILE 725.A O no hydrogen 3.227 N/A ILE 750.A N ILE 725.A O no hydrogen 3.132 N/A ILE 751.A N LEU 521.A O no hydrogen 3.018 N/A ASP 752.A N LEU 727.A O no hydrogen 3.036 N/A THR 753.A N THR 523.A O no hydrogen 2.897 N/A ALA 754.A N PRO 765.A O no hydrogen 3.093 N/A VAL 755.A N THR 526.A OG1 no hydrogen 3.399 N/A SER 757.A N SER 792.A OG no hydrogen 3.235 N/A SER 757.A OG SER 792.A O no hydrogen 2.624 N/A MET 758.A N VAL 755.A O no hydrogen 2.879 N/A SER 759.A N ALA 756.A O no hydrogen 3.113 N/A SER 759.A OG ALA 756.A O no hydrogen 2.627 N/A GLY 760.A N GLN 764.A O no hydrogen 2.820 N/A SER 763.A N GLY 760.A O no hydrogen 2.920 N/A SER 763.A OG MET 758.A O no hydrogen 2.769 N/A SER 766.A OG SER 769.A OG no hydrogen 3.202 N/A ALA 767.A N ALA 754.A O no hydrogen 2.774 N/A SER 769.A N SER 766.A OG no hydrogen 3.173 N/A SER 769.A OG SER 766.A OG no hydrogen 3.202 N/A LEU 770.A N SER 766.A O no hydrogen 3.061 N/A TYR 771.A N ALA 767.A O no hydrogen 2.863 N/A ALA 773.A N SER 769.A O no hydrogen 2.872 N/A LEU 774.A N LEU 770.A O no hydrogen 3.239 N/A ASN 775.A N TYR 772.A O no hydrogen 3.123 N/A PHE 777.A N LEU 774.A O no hydrogen 2.897 N/A ARG 779.A NE ILE 744.A O no hydrogen 3.138 N/A ARG 779.A NH1 ASP 518.A O no hydrogen 2.845 N/A ARG 779.A NH2 ILE 744.A O no hydrogen 3.146 N/A ARG 779.A NH2 VAL 748.A O no hydrogen 2.364 N/A ARG 782.A N VAL 520.A O no hydrogen 2.965 N/A ARG 782.A NE ASP 519.A OD2 no hydrogen 3.156 N/A ARG 782.A NH1 GLN 517.A OE1 no hydrogen 2.907 N/A ARG 782.A NH2 GLN 517.A OE1 no hydrogen 2.915 N/A ASP 784.A N THR 783.A OG1 no hydrogen 2.697 N/A GLY 787.A N ASP 784.A OD2 no hydrogen 3.063 N/A MET 788.A N ASP 784.A O no hydrogen 2.715 N/A GLU 789.A N ILE 785.A O no hydrogen 2.708 N/A SER 790.A N GLU 786.A O no hydrogen 3.352 N/A LEU 791.A N GLY 787.A O no hydrogen 3.038 N/A SER 792.A N MET 788.A O no hydrogen 2.824 N/A HIS 793.A N GLU 789.A O no hydrogen 2.965 N/A TYR 794.A N SER 790.A O no hydrogen 3.025 N/A TYR 794.A OH ASP 543.A O no hydrogen 2.651 N/A TRP 795.A N LEU 791.A O no hydrogen 3.031 N/A SER 796.A N SER 792.A O no hydrogen 3.031 N/A THR 797.A N TYR 794.A O no hydrogen 2.944 N/A VAL 798.A N TYR 794.A O no hydrogen 3.128 N/A ARG 799.A N TRP 795.A O no hydrogen 2.797 N/A ARG 799.A NE GLU 806.A OE1 no hydrogen 3.495 N/A ARG 799.A NE GLU 806.A OE2 no hydrogen 3.261 N/A ARG 799.A NH1 SER 757.A O no hydrogen 2.692 N/A ARG 799.A NH2 GLU 806.A OE1 no hydrogen 3.210 N/A THR 800.A N THR 797.A O no hydrogen 3.000 N/A THR 800.A OG1 SER 796.A O no hydrogen 3.569 N/A TYR 801.A N VAL 798.A O no hydrogen 2.812 N/A TYR 802.A N ARG 799.A O no hydrogen 2.939 N/A TYR 802.A OH ASP 543.A OD1 no hydrogen 2.659 N/A SER 803.A OG THR 800.A O no hydrogen 3.562 N/A PHE 805.A N TYR 802.A O no hydrogen 3.124 N/A SER 807.A N LEU 534.A O no hydrogen 3.209 N/A ILE 809.A N SER 807.A OG no hydrogen 3.245 N/A ASN 813.A N THR 732.A O no hydrogen 2.981 N/A TYR 817.A N THR 814.A O no hydrogen 2.907 N/A TYR 817.A OH ASN 735.A OD1 no hydrogen 3.151 N/A GLN 818.A N GLU 815.A O no hydrogen 3.078 N/A HIS 819.A N GLU 815.A O no hydrogen 3.253 N/A GLU 820.A N ILE 816.A O no hydrogen 2.880 N/A GLY 823.A N MET 701.A O no hydrogen 3.396 N/A GLN 825.A N PRO 822.A O no hydrogen 3.083 N/A GLN 825.A NE2 SER 866.A O no hydrogen 3.278 N/A SER 827.A N GLY 824.A O no hydrogen 2.661 N/A SER 827.A OG ASP 808.A OD2 no hydrogen 3.562 N/A ASN 828.A N GLY 824.A O no hydrogen 3.039 N/A LEU 829.A N GLN 825.A O no hydrogen 2.641 N/A SER 830.A N SER 827.A O no hydrogen 3.040 N/A GLN 831.A N SER 827.A O no hydrogen 3.007 N/A GLN 832.A N ASN 828.A O no hydrogen 2.815 N/A ALA 833.A N LEU 829.A O no hydrogen 2.850 N/A LYS 834.A N SER 830.A O no hydrogen 3.026 N/A SER 835.A N GLN 831.A O no hydrogen 3.190 N/A SER 835.A OG GLN 831.A O no hydrogen 3.418 N/A LEU 836.A N GLN 832.A O no hydrogen 3.228 N/A GLY 837.A N LYS 834.A O no hydrogen 3.095 N/A LEU 838.A N ALA 833.A O no hydrogen 2.679 N/A ARG 841.A N LEU 838.A O no hydrogen 2.909 N/A ARG 841.A NE GLU 844.A OE2 no hydrogen 2.594 N/A ARG 841.A NH2 GLU 844.A OE1 no hydrogen 3.163 N/A ARG 841.A NH2 GLU 844.A OE2 no hydrogen 3.180 N/A GLU 844.A N ASP 843.A OD2 no hydrogen 2.876 N/A VAL 845.A N ARG 841.A O no hydrogen 3.400 N/A LYS 846.A N PHE 842.A O no hydrogen 2.879 N/A LYS 846.A NZ GLU 815.A OE1 no hydrogen 3.385 N/A LYS 846.A NZ GLU 815.A OE2 no hydrogen 2.723 N/A ASP 847.A N ASP 843.A O no hydrogen 2.965 N/A MET 848.A N GLU 844.A O no hydrogen 2.897 N/A TYR 849.A N VAL 845.A O no hydrogen 2.778 N/A TYR 849.A OH GLN 825.A OE1 no hydrogen 2.787 N/A TYR 849.A OH SER 866.A O no hydrogen 3.399 N/A ARG 850.A N LYS 846.A O no hydrogen 3.308 N/A ARG 851.A N ASP 847.A O no hydrogen 3.019 N/A ARG 851.A NH1 GLU 883.A OE2 no hydrogen 3.270 N/A VAL 852.A N MET 848.A O no hydrogen 2.650 N/A ASN 853.A N TYR 849.A O no hydrogen 3.186 N/A ASN 853.A ND2 ILE 859.A O no hydrogen 3.193 N/A LEU 855.A N ARG 851.A O no hydrogen 2.849 N/A PHE 856.A N VAL 852.A O no hydrogen 2.953 N/A PHE 856.A N ASN 853.A O no hydrogen 3.147 N/A GLY 857.A N PHE 854.A O no hydrogen 2.940 N/A ASP 858.A N ASN 853.A O no hydrogen 2.734 N/A LYS 861.A NZ GLU 820.A OE1 no hydrogen 2.792 N/A VAL 862.A N SER 865.A OG no hydrogen 2.928 N/A SER 865.A OG SER 636.A O no hydrogen 3.545 N/A SER 865.A OG VAL 860.A O no hydrogen 2.654 N/A SER 865.A OG VAL 862.A O no hydrogen 2.584 N/A SER 866.A N VAL 862.A O no hydrogen 2.737 N/A LYS 867.A NZ ASP 871.A OD1 no hydrogen 3.006 N/A VAL 868.A N PRO 864.A O no hydrogen 3.105 N/A VAL 869.A N SER 865.A O no hydrogen 3.191 N/A GLY 870.A N SER 866.A O no hydrogen 3.191 N/A ASP 871.A N LYS 867.A O no hydrogen 2.857 N/A MET 872.A N VAL 868.A O no hydrogen 3.266 N/A ALA 873.A N VAL 869.A O no hydrogen 2.919 N/A LEU 874.A N GLY 870.A O no hydrogen 2.927 N/A TYR 875.A N ASP 871.A O no hydrogen 3.017 N/A TYR 875.A OH ASP 894.A O no hydrogen 3.185 N/A MET 876.A N MET 872.A O no hydrogen 2.867 N/A VAL 877.A N ALA 873.A O no hydrogen 3.287 N/A GLN 878.A N LEU 874.A O no hydrogen 3.011 N/A ASN 879.A N TYR 875.A O no hydrogen 3.053 N/A ASN 879.A ND2 TYR 875.A O no hydrogen 2.858 N/A ASP 880.A N VAL 877.A O no hydrogen 3.443 N/A LEU 881.A N MET 876.A O no hydrogen 2.791 N/A ASP 882.A N SER 885.A OG no hydrogen 3.053 N/A GLU 883.A N GLU 883.A OE1 no hydrogen 2.953 N/A SER 885.A N ASP 882.A OD2 no hydrogen 2.678 N/A SER 885.A OG ASP 882.A OD2 no hydrogen 3.009 N/A VAL 886.A N ASP 882.A O no hydrogen 3.203 N/A THR 888.A N GLN 884.A O no hydrogen 3.346 N/A THR 888.A OG1 GLN 884.A O no hydrogen 3.289 N/A ASP 889.A N SER 885.A O no hydrogen 3.019 N/A LYS 892.A N ASP 889.A O no hydrogen 2.891 N/A LEU 893.A N GLY 890.A O no hydrogen 3.490 N/A SER 898.A OG ASP 871.A OD1 no hydrogen 2.672 N/A VAL 899.A N PRO 896.A O no hydrogen 2.864 N/A VAL 900.A N PRO 896.A O no hydrogen 3.305 N/A SER 901.A N GLU 897.A O no hydrogen 3.023 N/A SER 901.A OG GLU 906.A OE1 no hydrogen 2.531 N/A PHE 902.A N SER 898.A O no hydrogen 3.201 N/A PHE 903.A N VAL 899.A O no hydrogen 2.931 N/A LYS 904.A N SER 901.A O no hydrogen 3.231 N/A LYS 904.A NZ GLN 926.A OE1 no hydrogen 2.747 N/A GLY 905.A N PHE 902.A O no hydrogen 3.100 N/A GLU 906.A N SER 901.A O no hydrogen 3.116 N/A GLY 913.A N PRO 910.A O no hydrogen 2.916 N/A LEU 918.A N ASN 915.A OD1 no hydrogen 3.042 N/A GLN 919.A N ASN 915.A O no hydrogen 2.861 N/A GLN 919.A NE2 PHE 903.A O no hydrogen 3.256 N/A ALA 920.A N LYS 916.A O no hydrogen 2.968 N/A VAL 921.A N ASP 917.A O no hydrogen 3.190 N/A ILE 922.A N LEU 918.A O no hydrogen 3.268 N/A LEU 923.A N GLN 919.A O no hydrogen 2.987 N/A LYS 924.A N ALA 920.A O no hydrogen 3.121 N/A LYS 924.A NZ GLY 890.A O no hydrogen 2.727 N/A LYS 924.A NZ LEU 893.A O no hydrogen 2.598 N/A LYS 924.A NZ VAL 921.A O no hydrogen 3.137 N/A GLN 926.A N LEU 923.A O no hydrogen 3.105 N/A GLN 926.A NE2 LEU 923.A O no hydrogen 3.046 N/A LEU 929.A N LYS 904.A O no hydrogen 2.778 N/A THR 930.A N TYR 936.A OH no hydrogen 2.738 N/A THR 930.A OG1 TYR 936.A OH no hydrogen 2.847 N/A ARG 932.A NH2 ASP 613.A OD1 no hydrogen 2.929 N/A GLU 935.A N ARG 932.A O no hydrogen 3.284 N/A TYR 936.A N PRO 933.A O no hydrogen 3.323 N/A VAL 940.A N ASN 614.A OD1 no hydrogen 3.295 N/A GLU 943.A N ASP 941.A OD1 no hydrogen 3.012 N/A LYS 944.A NZ GLU 947.A OE2 no hydrogen 2.868 N/A VAL 945.A N ASP 941.A O no hydrogen 3.401 N/A ARG 946.A N PHE 942.A O no hydrogen 2.783 N/A ARG 946.A NH1 VAL 957.A O no hydrogen 2.555 N/A GLU 947.A N GLU 943.A O no hydrogen 3.126 N/A LEU 948.A N LYS 944.A O no hydrogen 3.104 N/A LEU 949.A N VAL 945.A O no hydrogen 3.115 N/A GLU 950.A N ARG 946.A O no hydrogen 3.267 N/A GLU 952.A N LEU 948.A O no hydrogen 3.215 N/A GLN 953.A N LEU 949.A O no hydrogen 2.891 N/A GLN 953.A NE2 TYR 972.A OH no hydrogen 3.176 N/A GLN 954.A NE2 PRO 956.A O no hydrogen 3.568 N/A THR 958.A N ASP 961.A OD2 no hydrogen 2.757 N/A THR 958.A OG1 ASP 961.A OD2 no hydrogen 2.749 N/A GLN 960.A NE2 GLU 585.A OE1 no hydrogen 3.444 N/A ASP 961.A N THR 958.A O no hydrogen 3.155 N/A ASP 961.A N THR 958.A OG1 no hydrogen 3.367 N/A ILE 962.A N THR 958.A O no hydrogen 3.335 N/A ILE 962.A N GLU 959.A O no hydrogen 3.162 N/A ILE 963.A N GLU 959.A O no hydrogen 3.400 N/A SER 964.A N GLN 960.A O no hydrogen 3.358 N/A SER 964.A OG TYR 573.A OH no hydrogen 2.717 N/A SER 964.A OG GLN 960.A O no hydrogen 2.643 N/A TYR 965.A N ASP 961.A O no hydrogen 2.987 N/A VAL 966.A N ILE 962.A O no hydrogen 3.017 N/A LEU 967.A N ILE 963.A O no hydrogen 2.811 N/A TYR 968.A N SER 964.A O no hydrogen 3.060 N/A TYR 968.A OH VAL 606.A O no hydrogen 2.886 N/A TYR 972.A N TYR 968.A O no hydrogen 2.691 N/A TYR 972.A OH ASP 961.A OD1 no hydrogen 2.951 N/A GLU 973.A N PRO 969.A O no hydrogen 3.026 N/A GLN 974.A N LYS 970.A O no hydrogen 2.913 N/A TYR 975.A N VAL 971.A O no hydrogen 2.867 N/A ILE 976.A N TYR 972.A O no hydrogen 3.071 N/A GLN 977.A N GLU 973.A O no hydrogen 3.223 N/A THR 978.A N GLN 974.A O no hydrogen 2.998 N/A THR 978.A OG1 GLN 974.A O no hydrogen 3.468 N/A ARG 979.A N TYR 975.A O no hydrogen 2.828 N/A ARG 979.A NH2 GLN 953.A OE1 no hydrogen 3.170 N/A ASN 980.A N ILE 976.A O no hydrogen 2.788 N/A GLN 981.A N GLN 977.A O no hydrogen 3.125 N/A GLN 981.A N THR 978.A O no hydrogen 2.964 N/A TYR 982.A N THR 978.A O no hydrogen 2.804 N/A GLY 983.A N ARG 979.A O no hydrogen 3.093 N/A ASN 984.A ND2 SER 986.A OG no hydrogen 2.765 N/A LEU 987.A N ASN 984.A O no hydrogen 3.495 N/A LEU 988.A N LEU 985.A O no hydrogen 2.975 N/A THR 990.A OG1 ASP 543.A OD1 no hydrogen 2.760 N/A THR 990.A OG1 TYR 802.A OH no hydrogen 3.276 N/A THR 992.A N ASP 989.A OD1 no hydrogen 3.147 N/A THR 992.A OG1 ASP 989.A OD1 no hydrogen 2.830 N/A THR 992.A OG1 ASP 989.A OD2 no hydrogen 2.852 N/A PHE 993.A N ASP 989.A O no hydrogen 2.962 N/A PHE 994.A N THR 990.A O no hydrogen 3.039 N/A PHE 995.A N PRO 991.A O no hydrogen 2.986 N/A GLY 996.A N THR 992.A O no hydrogen 2.848 N/A MET 997.A N THR 464.A OG1 no hydrogen 2.851 N/A ARG 998.A N GLU 1001.A OE2 no hydrogen 3.015 N/A GLY 1000.A N LEU 1017.A O no hydrogen 2.717 N/A GLU 1001.A N ARG 998.A O no hydrogen 3.056 N/A VAL 1003.A N ILE 1015.A O no hydrogen 2.840 N/A ILE 1005.A N LEU 1013.A O no hydrogen 2.961 N/A ILE 1007.A N LYS 1011.A O no hydrogen 2.776 N/A ASP 1008.A N LYS 1011.A O no hydrogen 3.010 N/A LYS 1009.A N ASP 1008.A OD2 no hydrogen 2.708 N/A LYS 1011.A N ASP 1008.A O no hydrogen 2.879 N/A LEU 1013.A N ILE 1005.A O no hydrogen 2.938 N/A ILE 1015.A N VAL 1003.A O no hydrogen 3.003 N/A LYS 1016.A N ALA 1034.A O no hydrogen 2.801 N/A LEU 1017.A N GLU 1001.A O no hydrogen 3.113 N/A GLU 1018.A N TYR 1032.A O no hydrogen 2.760 N/A SER 1021.A N THR 1030.A O no hydrogen 3.003 N/A SER 1021.A OG GLU 1022.A O no hydrogen 3.377 N/A SER 1021.A OG THR 1030.A O no hydrogen 3.218 N/A ASP 1024.A N ASN 1028.A O no hydrogen 3.128 N/A GLU 1025.A N GLU 1025.A OE2 no hydrogen 2.796 N/A ASN 1026.A N ASP 1024.A OD2 no hydrogen 3.147 N/A GLY 1027.A N ASP 1024.A O no hydrogen 2.871 N/A ASN 1028.A N ASP 1024.A OD2 no hydrogen 2.662 N/A ARG 1029.A N ILE 1044.A O no hydrogen 2.874 N/A ARG 1029.A NE SER 1021.A O no hydrogen 3.049 N/A ARG 1029.A NH1 ASP 1046.A OD2 no hydrogen 2.467 N/A THR 1030.A N SER 1021.A OG no hydrogen 2.707 N/A ILE 1031.A N ILE 1042.A O no hydrogen 2.750 N/A TYR 1032.A N THR 1019.A O no hydrogen 2.810 N/A TYR 1033.A N ARG 1040.A O no hydrogen 2.609 N/A TYR 1033.A OH LEU 457.A O no hydrogen 2.806 N/A ALA 1034.A N LYS 1016.A O no hydrogen 2.894 N/A MET 1035.A N GLN 1038.A O no hydrogen 2.967 N/A ASN 1036.A N ILE 1014.A O no hydrogen 2.923 N/A ASN 1036.A ND2 ARG 1012.A O no hydrogen 3.400 N/A GLN 1038.A N MET 1035.A O no hydrogen 2.740 N/A ARG 1040.A N TYR 1033.A O no hydrogen 2.923 N/A ARG 1040.A NH1 THR 454.A OG1 no hydrogen 3.132 N/A ARG 1040.A NH2 THR 454.A OG1 no hydrogen 3.029 N/A ILE 1042.A N ILE 1031.A O no hydrogen 3.013 N/A ILE 1044.A N ARG 1029.A O no hydrogen 3.042 N/A LYS 1045.A NZ ASN 1026.A O no hydrogen 3.501 N/A ASP 1046.A N GLY 1027.A O no hydrogen 2.841 N/A GLU 1047.A N ASN 466.A OD1 no hydrogen 2.877 N/A THR 1051.A OG1 ASP 1121.A OD1 no hydrogen 2.554 N/A VAL 1055.A N PRO 1023.A O no hydrogen 2.900 N/A LYS 1056.A NZ ASN 1054.A O no hydrogen 3.494 N/A LYS 1058.A NZ THR 1125.A O no hydrogen 3.120 N/A ALA 1059.A N GLY 1126.A O no hydrogen 2.919 N/A SER 1062.A OG ASP 1060.A OD1 no hydrogen 3.291 N/A SER 1062.A OG ASP 1060.A OD2 no hydrogen 3.505 N/A ASN 1063.A N ASP 1060.A O no hydrogen 3.225 N/A SER 1065.A N ASN 1063.A OD1 no hydrogen 3.032 N/A SER 1065.A OG ILE 1132.A O no hydrogen 2.752 N/A HIS 1066.A N ASN 1063.A O no hydrogen 3.309 N/A ILE 1067.A N ILE 1130.A O no hydrogen 2.909 N/A ALA 1069.A N ASP 1127.A O no hydrogen 2.812 N/A GLY 1073.A N ILE 1123.A O no hydrogen 3.139 N/A SER 1074.A N GLU 1096.A O no hydrogen 2.924 N/A VAL 1075.A N ASP 1121.A O no hydrogen 2.812 N/A THR 1076.A N ILE 1094.A O no hydrogen 2.735 N/A GLU 1077.A N ILE 1094.A O no hydrogen 3.010 N/A VAL 1078.A N ASN 1119.A OD1 no hydrogen 2.963 N/A SER 1081.A N GLU 1084.A OE2 no hydrogen 3.401 N/A GLY 1083.A N ILE 1112.A O no hydrogen 2.918 N/A VAL 1086.A N GLY 1110.A O no hydrogen 2.914 N/A LYS 1087.A N GLN 1090.A OE1 no hydrogen 2.876 N/A ASN 1089.A N ALA 1106.A O no hydrogen 2.799 N/A GLN 1090.A N LYS 1087.A O no hydrogen 3.355 N/A LEU 1092.A N ILE 1104.A O no hydrogen 2.839 N/A ILE 1094.A N GLU 1077.A O no hydrogen 2.721 N/A THR 1095.A N THR 1102.A O no hydrogen 3.484 N/A THR 1095.A OG1 THR 1102.A O no hydrogen 3.286 N/A GLU 1096.A N SER 1074.A O no hydrogen 2.808 N/A ALA 1097.A N MET 1100.A O no hydrogen 2.808 N/A THR 1102.A N THR 1095.A O no hydrogen 2.963 N/A ILE 1104.A N LEU 1093.A O no hydrogen 2.613 N/A ALA 1106.A N GLN 1090.A O no hydrogen 2.982 N/A GLY 1110.A N VAL 1086.A O no hydrogen 3.278 N/A ILE 1112.A N GLU 1084.A O no hydrogen 3.388 N/A LYS 1113.A N GLU 1131.A O no hydrogen 2.803 N/A GLN 1114.A NE2 GLU 1131.A OE1 no hydrogen 2.737 N/A THR 1116.A N LEU 1129.A O no hydrogen 3.305 N/A THR 1116.A OG1 LEU 1128.A O no hydrogen 2.585 N/A GLY 1120.A N VAL 1075.A O no hydrogen 2.752 N/A ASP 1121.A N ASN 1118.A O no hydrogen 3.322 N/A ILE 1123.A N GLY 1073.A O no hydrogen 2.897 N/A ALA 1124.A N ASP 1127.A OD1 no hydrogen 2.967 N/A GLY 1126.A N ALA 1069.A O no hydrogen 2.883 N/A ASP 1127.A N ALA 1124.A O no hydrogen 2.881 N/A LEU 1128.A N PRO 1057.A O no hydrogen 2.987 N/A LEU 1129.A N ILE 1067.A O no hydrogen 2.953 N/A GLU 1131.A N GLN 1114.A O no hydrogen 3.226 N/A ILE 1132.A N SER 1065.A O no hydrogen 3.068 N/A GLU 1133.A N VAL 1111.A O no hydrogen 3.097 N/A PHE 311A.A N ASP 309.A OD1 no hydrogen 2.725 N/A SER 494A.A N LYS 491.A O no hydrogen 3.263 N/A SER 494A.A OG LYS 491.A O no hydrogen 2.617 N/A ILE 675A.A N SER 673.A OG no hydrogen 2.963 N/A GLY 312B.A N ASP 309.A O no hydrogen 3.156 N/A PHE 495B.A N ILE 492.A O no hydrogen 3.036 N/A