Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8oki_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 12.A N LYS 204.A O no hydrogen 3.279 N/A SER 14.A N GLU 17.A OE1 no hydrogen 3.166 N/A SER 14.A OG GLU 17.A OE1 no hydrogen 2.672 N/A ILE 18.A N SER 14.A O no hydrogen 3.222 N/A ARG 19.A N PRO 15.A O no hydrogen 2.912 N/A ARG 19.A NH1 GLU 75.A OE1 no hydrogen 3.112 N/A LYS 20.A N GLN 16.A O no hydrogen 2.903 N/A LYS 20.A N GLU 17.A O no hydrogen 3.258 N/A MET 21.A N GLU 17.A O no hydrogen 2.904 N/A SER 22.A N ILE 18.A O no hydrogen 3.196 N/A SER 22.A OG ILE 18.A O no hydrogen 3.124 N/A SER 22.A OG ARG 19.A O no hydrogen 3.116 N/A ALA 23.A N PHE 71.A O no hydrogen 3.035 N/A VAL 26.A N HIS 73.A O no hydrogen 3.368 N/A THR 27.A N GLY 41.A O no hydrogen 3.215 N/A VAL 28.A N GLY 41.A O no hydrogen 3.354 N/A THR 31.A N ASP 30.A OD1 no hydrogen 3.054 N/A THR 31.A OG1 GLU 235.A OE2 no hydrogen 2.879 N/A TYR 32.A OH ASP 52.A OD1 no hydrogen 3.168 N/A ASP 33.A N TYR 37.A O no hydrogen 3.143 N/A ASP 35.A N ASP 33.A OD1 no hydrogen 2.510 N/A ILE 39.A N THR 31.A O no hydrogen 3.145 N/A GLY 41.A N ASP 45.A OD2 no hydrogen 2.736 N/A GLY 42.A N ILE 39.A O no hydrogen 3.027 N/A VAL 43.A N ASP 30.A O no hydrogen 3.378 N/A ASP 45.A N GLY 42.A O no hydrogen 3.296 N/A ARG 47.A N ASP 45.A OD1 no hydrogen 2.819 N/A ARG 47.A NE ASP 45.A OD1 no hydrogen 3.127 N/A ARG 47.A NH2 ASP 45.A OD2 no hydrogen 3.100 N/A MET 48.A N ASP 45.A O no hydrogen 3.161 N/A GLY 49.A N LYS 46.A O no hydrogen 3.055 N/A ARG 56.A NE GLY 62.A O no hydrogen 2.648 N/A ARG 56.A NH2 GLY 62.A O no hydrogen 3.049 N/A CYS 57.A SG LYS 46.A O no hydrogen 3.992 N/A CYS 57.A SG HIS 70.A NE2 no hydrogen 3.160 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.459 N/A THR 59.A OG1 ARG 47.A O no hydrogen 2.936 N/A CYS 60.A N CYS 57.A O no hydrogen 3.332 N/A CYS 60.A SG HIS 70.A NE2 no hydrogen 3.471 N/A CYS 67.A SG HIS 70.A NE2 no hydrogen 3.880 N/A HIS 70.A N MET 48.A O no hydrogen 3.236 N/A GLY 72.A N VAL 217.A O no hydrogen 3.117 N/A HIS 73.A N VAL 24.A O no hydrogen 3.305 N/A HIS 73.A ND1 GLU 75.A OE2 no hydrogen 2.918 N/A ILE 74.A N LEU 215.A O no hydrogen 2.833 N/A LEU 76.A N THR 213.A O no hydrogen 3.274 N/A ALA 77.A N ASN 249.A OD1 no hydrogen 2.842 N/A VAL 80.A N LEU 212.A O no hydrogen 3.359 N/A HIS 82.A N MET 210.A O no hydrogen 3.457 N/A GLY 84.A N HIS 82.A ND1 no hydrogen 2.873 N/A ALA 86.A N VAL 83.A O no hydrogen 3.320 N/A ILE 89.A N PHE 85.A O no hydrogen 3.265 N/A TYR 90.A N ALA 86.A O no hydrogen 3.350 N/A ARG 91.A N LYS 87.A O no hydrogen 2.937 N/A ARG 91.A NH2 LEU 198.A O no hydrogen 2.982 N/A ILE 92.A N THR 88.A O no hydrogen 2.888 N/A LEU 93.A N ILE 89.A O no hydrogen 2.863 N/A GLU 94.A N TYR 90.A O no hydrogen 2.969 N/A SER 95.A N ILE 92.A O no hydrogen 3.201 N/A SER 95.A OG ARG 91.A O no hydrogen 2.784 N/A SER 95.A OG ILE 92.A O no hydrogen 3.316 N/A THR 96.A OG1 ARG 102.A O no hydrogen 2.756 N/A CYS 97.A N ARG 102.A O no hydrogen 2.910 N/A LYS 104.A NZ THR 96.A O no hydrogen 2.656 N/A THR 106.A N GLU 109.A OE1 no hydrogen 2.878 N/A ILE 110.A N THR 106.A O no hydrogen 3.005 N/A GLU 111.A N ASP 107.A O no hydrogen 2.919 N/A GLU 112.A N GLU 108.A O no hydrogen 2.913 N/A TYR 113.A N GLU 109.A O no hydrogen 2.905 N/A MET 114.A N ILE 110.A O no hydrogen 2.877 N/A LYS 115.A N GLU 111.A O no hydrogen 2.954 N/A LYS 115.A NZ GLU 111.A OE2 no hydrogen 2.685 N/A LYS 116.A N TYR 113.A O no hydrogen 3.241 N/A ILE 117.A N TYR 113.A O no hydrogen 2.877 N/A GLU 118.A N MET 114.A O no hydrogen 2.921 N/A ARG 121.A NH1 ARG 121.A O no hydrogen 2.539 N/A ARG 123.A NH1 GLU 126.A OE1 no hydrogen 2.454 N/A ASN 128.A N ARG 124.A O no hydrogen 2.905 N/A GLU 129.A N SER 125.A O no hydrogen 2.882 N/A ILE 130.A N GLU 126.A O no hydrogen 2.954 N/A ILE 131.A N PHE 127.A O no hydrogen 3.335 N/A LYS 132.A N ASN 128.A O no hydrogen 3.282 N/A LYS 132.A NZ GLU 129.A OE1 no hydrogen 3.521 N/A HIS 135.A N ILE 131.A O no hydrogen 3.154 N/A HIS 135.A NE2 GLU 94.A OE2 no hydrogen 2.390 N/A LYS 136.A N LYS 132.A O no hydrogen 2.882 N/A LYS 137.A N GLU 133.A O no hydrogen 2.919 N/A LYS 137.A NZ TYR 113.A OH no hydrogen 2.821 N/A ALA 138.A N ILE 134.A O no hydrogen 2.903 N/A LYS 139.A N HIS 135.A O no hydrogen 2.910 N/A LYS 139.A NZ GLU 94.A OE2 no hydrogen 3.255 N/A ARG 141.A NH1 LYS 104.A O no hydrogen 2.876 N/A ARG 141.A NH1 GLU 109.A OE1 no hydrogen 3.020 N/A ARG 141.A NH2 GLU 109.A OE1 no hydrogen 3.316 N/A ARG 141.A NH2 GLU 109.A OE2 no hydrogen 2.346 N/A HIS 146.A NE2 LEU 105.A O no hydrogen 2.367 N/A LYS 155.A N TRP 163.A O no hydrogen 2.740 N/A GLU 157.A N ILE 161.A O no hydrogen 2.936 N/A THR 160.A OG1 GLN 273.A OE1 no hydrogen 2.695 N/A ILE 161.A N GLU 157.A O no hydrogen 3.213 N/A TYR 162.A OH ALA 86.A O no hydrogen 2.702 N/A TRP 163.A N LYS 155.A O no hydrogen 2.552 N/A TRP 163.A NE1 GLU 157.A OE1 no hydrogen 2.903 N/A GLU 164.A N HIS 176.A O no hydrogen 2.663 N/A ILE 165.A N PRO 153.A O no hydrogen 3.291 N/A ARG 166.A N TYR 174.A O no hydrogen 3.041 N/A ARG 166.A NH1 HIS 176.A ND1 no hydrogen 3.389 N/A GLU 169.A N ASN 172.A O no hydrogen 2.525 N/A TYR 174.A N ARG 166.A O no hydrogen 2.845 N/A HIS 176.A N GLU 164.A O no hydrogen 2.600 N/A ARG 177.A NH1 ASP 270.A OD1 no hydrogen 3.438 N/A ARG 177.A NH1 ASP 270.A OD2 no hydrogen 3.502 N/A ARG 177.A NH2 ASP 270.A OD1 no hydrogen 3.213 N/A LEU 178.A N TYR 162.A O no hydrogen 3.426 N/A MET 179.A N GLU 182.A OE1 no hydrogen 2.849 N/A GLU 182.A N MET 179.A O no hydrogen 2.896 N/A VAL 183.A N MET 179.A O no hydrogen 3.253 N/A ARG 184.A N PRO 180.A O no hydrogen 2.942 N/A ARG 184.A NE VAL 211.A O no hydrogen 3.351 N/A TRP 186.A N GLU 182.A O no hydrogen 2.919 N/A LEU 187.A N VAL 183.A O no hydrogen 2.884 N/A GLU 188.A N ARG 184.A O no hydrogen 2.888 N/A LYS 189.A N TRP 186.A O no hydrogen 3.423 N/A ILE 190.A N LEU 187.A O no hydrogen 3.517 N/A LEU 197.A N ASP 194.A O no hydrogen 3.173 N/A LEU 198.A N LEU 195.A O no hydrogen 2.885 N/A GLY 199.A N PRO 196.A O no hydrogen 3.141 N/A LEU 200.A N LEU 195.A O no hydrogen 3.358 N/A ASP 201.A N SER 205.A OG no hydrogen 2.737 N/A GLU 203.A N GLU 203.A OE1 no hydrogen 2.450 N/A LYS 204.A NZ ASP 201.A OD2 no hydrogen 2.642 N/A SER 205.A N ASP 201.A O no hydrogen 2.846 N/A SER 205.A OG ASP 201.A O no hydrogen 2.666 N/A ARG 206.A NH1 ILE 190.A O no hydrogen 3.401 N/A ARG 206.A NH2 ILE 190.A O no hydrogen 3.166 N/A GLU 208.A N GLU 208.A OE1 no hydrogen 3.039 N/A TRP 209.A N ARG 206.A O no hydrogen 3.098 N/A MET 210.A N PRO 207.A O no hydrogen 3.217 N/A LEU 212.A N VAL 80.A O no hydrogen 2.954 N/A LEU 215.A N ILE 74.A O no hydrogen 3.020 N/A VAL 217.A N GLY 72.A O no hydrogen 2.530 N/A VAL 220.A N MET 48.A O no hydrogen 3.357 N/A THR 221.A OG1 PRO 68.A O no hydrogen 3.341 N/A ALA 222.A N PRO 219.A O no hydrogen 3.340 N/A ARG 223.A N VAL 220.A O no hydrogen 3.042 N/A ARG 223.A NE PRO 218.A O no hydrogen 3.330 N/A ARG 223.A NH1 VAL 43.A O no hydrogen 3.047 N/A ARG 223.A NH2 VAL 43.A O no hydrogen 2.995 N/A ARG 223.A NH2 PRO 218.A O no hydrogen 3.127 N/A SER 225.A OG ALA 234.A O no hydrogen 3.004 N/A ILE 226.A N ALA 234.A O no hydrogen 3.010 N/A LEU 228.A N ILE 232.A O no hydrogen 3.123 N/A THR 230.A OG1 GLU 229.A OE2 no hydrogen 2.487 N/A GLY 231.A N LEU 228.A O no hydrogen 3.073 N/A ARG 233.A NH1 ASP 52.A OD2 no hydrogen 3.010 N/A ARG 233.A NH1 SER 225.A OG no hydrogen 3.426 N/A ARG 233.A NH2 ASP 52.A OD2 no hydrogen 2.924 N/A ALA 234.A N ILE 226.A O no hydrogen 2.865 N/A ASP 237.A N ASP 236.A OD1 no hydrogen 2.850 N/A THR 239.A N ASP 236.A O no hydrogen 3.247 N/A LYS 241.A N ASP 237.A O no hydrogen 2.981 N/A LYS 241.A NZ THR 278.A OG1 no hydrogen 3.293 N/A LEU 242.A N LEU 238.A O no hydrogen 2.894 N/A VAL 243.A N THR 239.A O no hydrogen 2.918 N/A ASP 244.A N HIS 240.A O no hydrogen 2.976 N/A ILE 245.A N LYS 241.A O no hydrogen 2.945 N/A ILE 246.A N LEU 242.A O no hydrogen 2.884 N/A ARG 247.A N VAL 243.A O no hydrogen 2.948 N/A ILE 248.A N ASP 244.A O no hydrogen 2.981 N/A ASN 249.A N ILE 245.A O no hydrogen 2.907 N/A ASN 249.A ND2 GLU 75.A O no hydrogen 3.450 N/A ASN 250.A N ILE 246.A O no hydrogen 2.908 N/A ASN 250.A ND2 THR 27.A O no hydrogen 3.224 N/A ASN 250.A ND2 ILE 246.A O no hydrogen 3.043 N/A ARG 251.A N ARG 247.A O no hydrogen 2.994 N/A LEU 252.A N ILE 248.A O no hydrogen 2.932 N/A LYS 253.A N ASN 249.A O no hydrogen 2.906 N/A GLN 254.A N ASN 250.A O no hydrogen 2.946 N/A ASN 255.A N ARG 251.A O no hydrogen 2.938 N/A ASN 255.A ND2 GLN 254.A OE1 no hydrogen 2.624 N/A ILE 256.A N LEU 252.A O no hydrogen 2.919 N/A GLU 257.A N LYS 253.A O no hydrogen 2.920 N/A ALA 258.A N GLN 254.A O no hydrogen 2.923 N/A GLY 259.A N ILE 256.A O no hydrogen 3.356 N/A ILE 264.A N PRO 261.A O no hydrogen 3.080 N/A GLU 266.A N GLN 262.A O no hydrogen 2.930 N/A ASP 267.A N ILE 264.A O no hydrogen 3.212 N/A LEU 268.A N ILE 264.A O no hydrogen 2.976 N/A TRP 269.A N ILE 265.A O no hydrogen 2.888 N/A TRP 269.A NE1 PRO 79.A O no hydrogen 3.036 N/A LEU 271.A N ASP 267.A O no hydrogen 2.963 N/A LEU 272.A N LEU 268.A O no hydrogen 2.906 N/A GLN 273.A N TRP 269.A O no hydrogen 2.912 N/A GLN 273.A NE2 ILE 81.A O no hydrogen 3.600 N/A TYR 274.A N ASP 270.A O no hydrogen 2.901 N/A TYR 274.A OH PRO 288.A O no hydrogen 3.245 N/A HIS 275.A N LEU 271.A O no hydrogen 2.945 N/A VAL 276.A N LEU 272.A O no hydrogen 2.938 N/A THR 277.A N GLN 273.A O no hydrogen 2.899 N/A THR 277.A OG1 GLN 273.A O no hydrogen 2.890 N/A THR 277.A OG1 GLN 273.A OE1 no hydrogen 2.776 N/A THR 278.A N TYR 274.A O no hydrogen 2.930 N/A THR 278.A OG1 TYR 274.A O no hydrogen 2.716 N/A THR 278.A OG1 HIS 275.A O no hydrogen 2.701 N/A TYR 279.A N HIS 275.A O no hydrogen 2.897 N/A ILE 280.A N VAL 276.A O no hydrogen 2.958 N/A ASN 281.A N THR 277.A O no hydrogen 3.108 N/A ASN 282.A ND2 LEU 298.A O no hydrogen 2.686 N/A GLU 283.A N ASN 281.A OD1 no hydrogen 3.018 N/A ALA 290.A N ASN 282.A OD1 no hydrogen 3.163 N/A HIS 292.A N ARG 296.A O no hydrogen 2.944 N/A GLY 295.A N HIS 292.A O no hydrogen 3.118 N/A LEU 298.A N ALA 290.A O no hydrogen 3.330 N/A LYS 299.A N ASP 237.A OD2 no hydrogen 3.266 N/A THR 300.A OG1 GLN 303.A OE1 no hydrogen 2.684 N/A GLN 303.A NE2 ASN 281.A OD1 no hydrogen 3.448 N/A GLN 303.A NE2 GLU 283.A OE1 no hydrogen 2.451 N/A ARG 304.A N THR 300.A O no hydrogen 3.143 N/A ARG 304.A N LEU 301.A O no hydrogen 3.315 N/A ARG 304.A NH1 ALA 222.A O no hydrogen 3.116 N/A LEU 305.A N ALA 302.A O no hydrogen 3.357 N/A ARG 311.A N ARG 304.A O no hydrogen 2.685 N/A GLY 314.A N GLY 310.A O no hydrogen 2.895 N/A LEU 316.A N ARG 311.A O no hydrogen 3.340 N/A SER 317.A N PHE 312.A O no hydrogen 3.056 N/A SER 317.A OG PHE 312.A O no hydrogen 3.051 N/A ALA 325.A N LEU 466.A O no hydrogen 3.138 N/A ARG 326.A NE ASN 465.A OD1 no hydrogen 3.148 N/A ARG 326.A NH1 GLU 463.A OE1 no hydrogen 2.900 N/A THR 327.A OG1 ARG 443.A O no hydrogen 3.432 N/A SER 330.A N PHE 445.A O no hydrogen 2.983 N/A SER 330.A OG THR 444.A OG1 no hydrogen 2.688 N/A ASP 332.A N LEU 447.A O no hydrogen 3.114 N/A SER 336.A N GLU 339.A OE2 no hydrogen 3.188 N/A SER 336.A OG ASN 338.A OD1 no hydrogen 2.773 N/A SER 336.A OG GLU 339.A OE2 no hydrogen 2.262 N/A ASN 338.A ND2 GLN 485.A OE1 no hydrogen 3.269 N/A GLU 339.A N SER 336.A O no hydrogen 3.173 N/A VAL 340.A N ARG 436.A O no hydrogen 2.945 N/A GLY 341.A N ARG 446.A O no hydrogen 3.051 N/A VAL 342.A N ARG 438.A O no hydrogen 3.025 N/A VAL 344.A N MET 440.A O no hydrogen 3.160 N/A GLU 345.A N GLU 345.A OE1 no hydrogen 2.949 N/A ALA 347.A N PRO 343.A O no hydrogen 3.047 N/A MET 348.A N VAL 344.A O no hydrogen 3.320 N/A GLU 349.A N VAL 346.A O no hydrogen 2.891 N/A LEU 350.A N VAL 346.A O no hydrogen 3.147 N/A VAL 352.A N ARG 411.A O no hydrogen 3.352 N/A GLU 354.A N VAL 409.A O no hydrogen 3.035 N/A VAL 356.A N TRP 407.A O no hydrogen 3.290 N/A THR 357.A N ASN 360.A OD1 no hydrogen 2.683 N/A THR 357.A OG1 LYS 355.A O no hydrogen 3.351 N/A GLU 358.A N GLU 358.A OE1 no hydrogen 3.163 N/A ASN 360.A ND2 GLU 354.A OE2 no hydrogen 3.336 N/A ASN 360.A ND2 LYS 355.A O no hydrogen 3.516 N/A ARG 363.A NH2 GLU 354.A OE2 no hydrogen 3.094 N/A LEU 364.A N ASN 360.A O no hydrogen 3.207 N/A ARG 365.A N ILE 361.A O no hydrogen 2.904 N/A LYS 366.A N GLU 362.A O no hydrogen 2.923 N/A MET 367.A N ARG 363.A O no hydrogen 2.888 N/A VAL 368.A N LEU 364.A O no hydrogen 2.940 N/A LEU 369.A N ARG 365.A O no hydrogen 3.426 N/A ASN 370.A N MET 367.A O no hydrogen 3.163 N/A ASN 370.A ND2 PRO 376.A O no hydrogen 2.710 N/A GLY 371.A N VAL 368.A O no hydrogen 3.189 N/A TYR 375.A OH LEU 413.A O no hydrogen 3.120 N/A ASN 379.A N GLU 410.A O no hydrogen 3.184 N/A VAL 381.A N ARG 389.A O no hydrogen 3.060 N/A ILE 382.A N THR 408.A O no hydrogen 2.680 N/A ASP 383.A N ARG 387.A O no hydrogen 3.358 N/A GLY 386.A N ASP 383.A OD1 no hydrogen 3.001 N/A ARG 388.A NH1 GLU 410.A OE1 no hydrogen 3.230 N/A ARG 388.A NH1 GLU 410.A OE2 no hydrogen 3.042 N/A ARG 388.A NH2 GLU 410.A OE2 no hydrogen 2.948 N/A ARG 389.A N VAL 381.A O no hydrogen 3.050 N/A ILE 391.A N ASN 379.A O no hydrogen 3.056 N/A ASN 395.A N MET 392.A O no hydrogen 3.109 N/A LYS 396.A N MET 392.A O no hydrogen 3.191 N/A LYS 396.A NZ ASP 393.A O no hydrogen 3.248 N/A LYS 396.A NZ ASP 393.A OD1 no hydrogen 2.497 N/A GLU 397.A N GLU 397.A OE1 no hydrogen 2.835 N/A LEU 399.A N ASN 395.A O no hydrogen 2.814 N/A ALA 400.A N LYS 396.A O no hydrogen 2.906 N/A ILE 405.A N ASP 404.A OD1 no hydrogen 2.755 N/A TRP 407.A N ASP 404.A O no hydrogen 3.374 N/A THR 408.A N ILE 382.A O no hydrogen 3.020 N/A VAL 409.A N GLU 354.A O no hydrogen 3.054 N/A GLU 410.A N TYR 380.A O no hydrogen 3.068 N/A ARG 411.A NE GLU 354.A OE1 no hydrogen 2.355 N/A ARG 411.A NH1 HIS 412.A O no hydrogen 2.915 N/A ARG 411.A NH1 ASP 417.A OD2 no hydrogen 3.255 N/A ARG 411.A NH2 ASP 417.A OD1 no hydrogen 3.460 N/A HIS 412.A N GLY 377.A O no hydrogen 2.779 N/A HIS 412.A ND1 TYR 375.A O no hydrogen 2.477 N/A HIS 412.A NE2 ASN 379.A OD1 no hydrogen 3.023 N/A LEU 413.A N ALA 347.A O no hydrogen 3.482 N/A MET 414.A N ASP 417.A OD2 no hydrogen 2.747 N/A VAL 419.A N HIS 435.A O no hydrogen 3.103 N/A LEU 420.A N HIS 467.A O no hydrogen 2.750 N/A PHE 421.A N MET 433.A O no hydrogen 2.988 N/A ASN 422.A N ASN 465.A O no hydrogen 3.082 N/A ARG 423.A NE ASP 462.A OD2 no hydrogen 3.459 N/A ARG 423.A NH1 TYR 455.A O no hydrogen 3.561 N/A ARG 423.A NH2 ASP 462.A OD2 no hydrogen 3.232 N/A SER 426.A OG ASN 422.A OD1 no hydrogen 3.467 N/A MET 430.A N HIS 428.A ND1 no hydrogen 3.204 N/A SER 431.A N HIS 428.A O no hydrogen 3.471 N/A SER 431.A OG HIS 428.A O no hydrogen 3.292 N/A MET 433.A N PHE 421.A O no hydrogen 3.371 N/A ALA 434.A N MET 482.A O no hydrogen 2.852 N/A HIS 435.A N VAL 419.A O no hydrogen 3.064 N/A HIS 435.A NE2 TYR 455.A OH no hydrogen 3.123 N/A ARG 436.A N ASN 338.A O no hydrogen 2.737 N/A ARG 436.A NE GLY 416.A O no hydrogen 3.395 N/A ARG 436.A NH2 GLY 416.A O no hydrogen 3.542 N/A VAL 437.A N ASP 417.A O no hydrogen 2.938 N/A MET 440.A N VAL 342.A O no hydrogen 2.954 N/A THR 444.A OG1 SER 330.A OG no hydrogen 2.688 N/A PHE 445.A N VAL 328.A O no hydrogen 3.062 N/A ARG 446.A N GLY 341.A O no hydrogen 3.337 N/A ARG 446.A NH1 THR 444.A O no hydrogen 2.423 N/A LEU 447.A N SER 330.A O no hydrogen 3.402 N/A ASN 448.A ND2 ILE 335.A O no hydrogen 2.534 N/A ALA 450.A N ASN 448.A OD1 no hydrogen 2.965 N/A CYS 452.A N LEU 449.A O no hydrogen 3.255 N/A CYS 452.A SG LEU 449.A O no hydrogen 3.551 N/A TYR 455.A OH PHE 421.A O no hydrogen 3.290 N/A TYR 455.A OH HIS 435.A NE2 no hydrogen 3.123 N/A ASN 456.A N PRO 453.A O no hydrogen 2.911 N/A ALA 457.A N CYS 452.A O no hydrogen 3.368 N/A ASP 458.A N ASP 462.A OD2 no hydrogen 3.425 N/A ASP 460.A N ASP 458.A O no hydrogen 2.993 N/A MET 464.A N THR 327.A O no hydrogen 3.334 N/A ASN 465.A N ASN 422.A O no hydrogen 2.942 N/A LEU 466.A N ALA 325.A O no hydrogen 3.084 N/A HIS 467.A N LEU 420.A O no hydrogen 2.874 N/A GLN 470.A NE2 THR 351.A O no hydrogen 3.293 N/A GLN 470.A NE2 VAL 468.A O no hydrogen 3.620 N/A GLU 472.A N GLU 472.A OE1 no hydrogen 2.536 N/A GLN 475.A N THR 471.A O no hydrogen 3.002 N/A ALA 476.A N GLU 472.A O no hydrogen 2.895 N/A GLU 477.A N GLU 473.A O no hydrogen 2.914 N/A ALA 478.A N ALA 474.A O no hydrogen 2.908 N/A ARG 479.A N GLN 475.A O no hydrogen 2.878 N/A ILE 480.A N ALA 476.A O no hydrogen 2.926 N/A LEU 481.A N GLU 477.A O no hydrogen 2.890 N/A MET 482.A N ALA 478.A O no hydrogen 3.234 N/A GLN 485.A N GLN 485.A OE1 no hydrogen 3.077 N/A GLN 485.A NE2 GLU 483.A OE2 no hydrogen 2.688 N/A ASN 486.A N GLU 483.A O no hydrogen 3.309 N/A HIS 487.A N VAL 484.A O no hydrogen 3.059 N/A SER 490.A N GLY 495.A O no hydrogen 2.776 N/A ARG 492.A N SER 490.A OG no hydrogen 3.389 N/A GLY 494.A N SER 490.A O no hydrogen 2.951 N/A ILE 497.A N ILE 488.A O no hydrogen 2.947 N/A GLY 500.A N TYR 624.A O no hydrogen 3.227 N/A ILE 501.A N HIS 504.A ND1 no hydrogen 3.421 N/A HIS 504.A N ILE 501.A O no hydrogen 3.347 N/A ILE 505.A N GLN 502.A O no hydrogen 3.109 N/A GLY 507.A N ASP 503.A O no hydrogen 2.899 N/A TYR 509.A N ILE 505.A O no hydrogen 2.929 N/A LEU 510.A N SER 506.A O no hydrogen 2.914 N/A LEU 511.A N GLY 507.A O no hydrogen 2.888 N/A THR 512.A N GLY 508.A O no hydrogen 2.920 N/A THR 512.A OG1 GLY 508.A O no hydrogen 2.597 N/A PHE 518.A N TRP 551.A O no hydrogen 2.883 N/A THR 519.A N GLU 522.A OE1 no hydrogen 3.117 N/A THR 519.A OG1 ASP 521.A OD1 no hydrogen 2.622 N/A THR 519.A OG1 GLU 522.A OE1 no hydrogen 2.942 N/A ARG 520.A NE GLU 524.A OE2 no hydrogen 2.737 N/A ARG 520.A NH2 GLU 524.A OE2 no hydrogen 3.486 N/A VAL 523.A N THR 519.A O no hydrogen 3.210 N/A GLU 524.A N ARG 520.A O no hydrogen 2.937 N/A GLN 525.A N ASP 521.A O no hydrogen 2.890 N/A MET 526.A N GLU 522.A O no hydrogen 2.890 N/A LEU 527.A N VAL 523.A O no hydrogen 2.952 N/A MET 528.A N GLU 524.A O no hydrogen 2.932 N/A PHE 529.A N GLN 525.A O no hydrogen 2.868 N/A ALA 530.A N MET 526.A O no hydrogen 2.924 N/A GLY 531.A N MET 528.A O no hydrogen 3.301 N/A ASP 541.A N LEU 550.A O no hydrogen 2.941 N/A LYS 542.A N LEU 550.A O no hydrogen 3.339 N/A ASP 544.A N ASN 548.A O no hydrogen 2.885 N/A GLY 547.A N ASP 544.A O no hydrogen 3.159 N/A LEU 550.A N LYS 542.A O no hydrogen 2.834 N/A TRP 551.A N PHE 518.A O no hydrogen 3.035 N/A TRP 551.A NE1 PRO 538.A O no hydrogen 3.170 N/A SER 552.A N ASP 541.A OD2 no hydrogen 3.262 N/A SER 552.A OG ASP 541.A OD2 no hydrogen 2.884 N/A SER 552.A OG THR 555.A OG1 no hydrogen 3.074 N/A LYS 554.A NZ THR 512.A O no hydrogen 3.382 N/A LYS 554.A NZ GLU 514.A OE2 no hydrogen 3.212 N/A LYS 554.A NZ GLY 617.A O no hydrogen 2.863 N/A THR 555.A OG1 ASP 541.A OD2 no hydrogen 3.052 N/A THR 555.A OG1 SER 552.A OG no hydrogen 3.074 N/A ILE 556.A N SER 552.A O no hydrogen 3.369 N/A PHE 557.A N GLY 553.A O no hydrogen 2.907 N/A SER 558.A N LYS 554.A O no hydrogen 2.907 N/A SER 558.A OG LYS 554.A O no hydrogen 2.800 N/A LEU 559.A N ILE 556.A O no hydrogen 3.355 N/A LEU 560.A N PHE 557.A O no hydrogen 3.287 N/A THR 566.A OG1 LEU 565.A O no hydrogen 2.668 N/A VAL 567.A N ILE 609.A O no hydrogen 3.202 N/A TYR 569.A N VAL 607.A O no hydrogen 3.164 N/A ASN 571.A N GLY 605.A O no hydrogen 3.472 N/A ASN 571.A ND2 ASP 604.A O no hydrogen 3.203 N/A ASN 571.A ND2 ALA 618.A O no hydrogen 3.143 N/A LYS 572.A N ASP 620.A OD2 no hydrogen 3.235 N/A ASP 575.A N TYR 603.A OH no hydrogen 3.468 N/A GLU 576.A N TYR 603.A OH no hydrogen 3.475 N/A GLU 584.A N CYS 580.A O no hydrogen 2.927 N/A LYS 585.A N GLU 581.A O no hydrogen 2.876 N/A LEU 586.A N ALA 582.A O no hydrogen 2.895 N/A ILE 587.A N LEU 583.A O no hydrogen 2.934 N/A GLU 588.A N GLU 584.A O no hydrogen 2.876 N/A GLU 589.A N LYS 585.A O no hydrogen 2.914 N/A LYS 590.A N LEU 586.A O no hydrogen 3.394 N/A VAL 598.A N ASP 594.A O no hydrogen 3.297 N/A ARG 599.A N PRO 595.A O no hydrogen 2.898 N/A LYS 600.A N GLU 596.A O no hydrogen 2.916 N/A LYS 600.A NZ GLU 597.A OE1 no hydrogen 2.859 N/A LEU 601.A N VAL 598.A O no hydrogen 3.041 N/A TYR 603.A N SER 616.A OG no hydrogen 3.069 N/A PHE 606.A N TYR 603.A O no hydrogen 3.429 N/A VAL 607.A N TYR 569.A O no hydrogen 3.037 N/A TYR 608.A N SER 616.A O no hydrogen 3.235 N/A ILE 609.A N VAL 567.A O no hydrogen 2.918 N/A GLN 610.A N LYS 613.A O no hydrogen 2.965 N/A GLN 610.A NE2 PRO 593.A O no hydrogen 3.610 N/A ASN 611.A N THR 566.A OG1 no hydrogen 3.215 N/A GLY 612.A N LEU 565.A O no hydrogen 3.139 N/A LYS 613.A N GLN 610.A O no hydrogen 3.032 N/A LEU 614.A N SER 558.A OG no hydrogen 3.058 N/A LEU 615.A N TYR 608.A O no hydrogen 3.035 N/A SER 616.A OG TYR 603.A O no hydrogen 2.954 N/A SER 616.A OG PHE 606.A O no hydrogen 3.052 N/A ILE 619.A N THR 512.A OG1 no hydrogen 2.918 N/A ALA 623.A N ASP 620.A O no hydrogen 3.144 N/A TYR 624.A OH HIS 504.A O no hydrogen 2.265 N/A GLY 625.A N LYS 621.A O no hydrogen 2.949 N/A GLU 627.A N PRO 496.A O no hydrogen 2.714 N/A GLY 629.A N GLY 625.A O no hydrogen 2.896 N/A ILE 630.A N LYS 622.A O no hydrogen 3.139 N/A ILE 630.A N ALA 623.A O no hydrogen 3.171 N/A ILE 631.A N ALA 623.A O no hydrogen 3.245 N/A LEU 634.A N ILE 630.A O no hydrogen 2.896 N/A ILE 635.A N ILE 631.A O no hydrogen 2.900 N/A VAL 636.A N LEU 632.A O no hydrogen 2.921 N/A ARG 637.A N LEU 634.A O no hydrogen 3.314 N/A ARG 637.A NE ASP 633.A OD1 no hydrogen 2.630 N/A GLU 638.A N ILE 635.A O no hydrogen 3.367 N/A TYR 639.A N ILE 635.A O no hydrogen 3.152 N/A TYR 639.A OH ASP 564.A OD1 no hydrogen 2.225 N/A ARG 643.A NH1 ARG 643.A O no hydrogen 3.455 N/A ARG 643.A NH2 LEU 560.A O no hydrogen 3.113 N/A ALA 644.A N GLY 640.A O no hydrogen 3.470 N/A ARG 645.A N VAL 641.A O no hydrogen 2.915 N/A ARG 645.A NH2 GLU 642.A OE1 no hydrogen 2.798 N/A GLN 646.A N GLU 642.A O no hydrogen 2.969 N/A PHE 647.A N ARG 643.A O no hydrogen 2.912 N/A LEU 648.A N ALA 644.A O no hydrogen 2.868 N/A ASP 649.A N ARG 645.A O no hydrogen 2.971 N/A GLN 650.A N GLN 646.A O no hydrogen 2.993 N/A VAL 651.A N PHE 647.A O no hydrogen 2.915 N/A THR 652.A N LEU 648.A O no hydrogen 2.958 N/A THR 652.A OG1 LEU 648.A O no hydrogen 2.873 N/A THR 652.A OG1 ASP 649.A O no hydrogen 2.689 N/A LYS 653.A N ASP 649.A O no hydrogen 3.019 N/A LEU 654.A N GLN 650.A O no hydrogen 2.930 N/A THR 655.A N VAL 651.A O no hydrogen 2.942 N/A THR 655.A OG1 VAL 651.A O no hydrogen 2.675 N/A THR 655.A OG1 THR 652.A O no hydrogen 2.788 N/A ILE 656.A N THR 652.A O no hydrogen 2.949 N/A TRP 657.A N LYS 653.A O no hydrogen 2.960 N/A VAL 658.A N LEU 654.A O no hydrogen 2.931 N/A ILE 659.A N THR 655.A O no hydrogen 2.945 N/A THR 660.A N ILE 656.A O no hydrogen 2.946 N/A THR 660.A N TRP 657.A O no hydrogen 3.188 N/A THR 660.A OG1 ILE 656.A O no hydrogen 2.585 N/A HIS 661.A N TRP 657.A O no hydrogen 3.388 N/A LYS 662.A N VAL 658.A O no hydrogen 3.380 N/A LYS 662.A NZ GLU 522.A OE2 no hydrogen 3.095 N/A THR 666.A OG1 ASP 670.A OD2 no hydrogen 2.480 N/A THR 666.A OG1 THR 745.A OG1 no hydrogen 3.331 N/A GLY 667.A N ASP 670.A OD2 no hydrogen 2.733 N/A GLU 676.A N GLU 676.A OE1 no hydrogen 2.614 N/A ARG 678.A N PRO 674.A O no hydrogen 3.402 N/A ARG 678.A NH1 LEU 673.A O no hydrogen 2.316 N/A ASP 679.A N GLU 675.A O no hydrogen 2.926 N/A ARG 680.A N GLU 676.A O no hydrogen 2.906 N/A ILE 681.A N ALA 677.A O no hydrogen 2.927 N/A ARG 682.A N ARG 678.A O no hydrogen 2.885 N/A ARG 682.A NH2 ASP 679.A OD1 no hydrogen 2.790 N/A GLU 683.A N ASP 679.A O no hydrogen 2.929 N/A ILE 684.A N ARG 680.A O no hydrogen 2.923 N/A ILE 685.A N ILE 681.A O no hydrogen 2.942 N/A ARG 686.A N ARG 682.A O no hydrogen 2.875 N/A GLU 687.A N GLU 683.A O no hydrogen 2.945 N/A ALA 688.A N ILE 684.A O no hydrogen 2.941 N/A GLU 689.A N ILE 685.A O no hydrogen 2.920 N/A GLU 690.A N ARG 686.A O no hydrogen 2.894 N/A ARG 691.A N GLU 687.A O no hydrogen 2.963 N/A VAL 692.A N GLU 689.A O no hydrogen 3.351 N/A ILE 696.A N VAL 692.A O no hydrogen 2.943 N/A GLU 697.A N ASN 693.A O no hydrogen 2.893 N/A ALA 698.A N LYS 694.A O no hydrogen 2.879 N/A TYR 699.A N LEU 695.A O no hydrogen 2.930 N/A LYS 700.A N ILE 696.A O no hydrogen 2.887 N/A ARG 701.A N GLU 697.A O no hydrogen 2.958 N/A ARG 701.A N ALA 698.A O no hydrogen 3.032 N/A ARG 701.A NE GLU 697.A OE1 no hydrogen 2.672 N/A ARG 701.A NH1 GLU 703.A OE1 no hydrogen 3.547 N/A ARG 701.A NH2 GLU 697.A OE1 no hydrogen 3.259 N/A ARG 701.A NH2 GLU 697.A OE2 no hydrogen 2.548 N/A ARG 701.A NH2 GLU 703.A OE1 no hydrogen 3.358 N/A GLU 713.A N SER 711.A OG no hydrogen 3.378 N/A THR 715.A N SER 711.A O no hydrogen 3.428 N/A THR 715.A OG1 LEU 712.A O no hydrogen 2.511 N/A LEU 716.A N LEU 712.A O no hydrogen 2.950 N/A GLU 717.A N GLU 713.A O no hydrogen 2.938 N/A SER 718.A N ASP 714.A O no hydrogen 2.905 N/A SER 718.A OG ASP 714.A O no hydrogen 3.548 N/A SER 718.A OG THR 715.A O no hydrogen 2.698 N/A LEU 719.A N THR 715.A O no hydrogen 2.941 N/A ILE 720.A N LEU 716.A O no hydrogen 2.970 N/A MET 721.A N GLU 717.A O no hydrogen 2.936 N/A ALA 722.A N SER 718.A O no hydrogen 2.945 N/A VAL 723.A N LEU 719.A O no hydrogen 2.979 N/A LEU 724.A N ILE 720.A O no hydrogen 2.951 N/A ALA 725.A N MET 721.A O no hydrogen 2.936 N/A GLU 726.A N ALA 722.A O no hydrogen 2.979 N/A ALA 727.A N VAL 723.A O no hydrogen 2.914 N/A ARG 728.A N LEU 724.A O no hydrogen 2.950 N/A ARG 728.A NH1 LEU 767.A O no hydrogen 3.254 N/A ASP 729.A N ALA 725.A O no hydrogen 3.014 N/A ASN 730.A N GLU 726.A O no hydrogen 2.921 N/A ASN 730.A ND2 GLU 726.A OE2 no hydrogen 3.230 N/A ALA 731.A N ALA 727.A O no hydrogen 2.925 N/A GLY 732.A N ARG 728.A O no hydrogen 2.932 N/A ALA 733.A N ASP 729.A O no hydrogen 2.993 N/A ALA 733.A N ASN 730.A O no hydrogen 3.256 N/A GLU 736.A N GLY 732.A O no hydrogen 2.955 N/A LYS 737.A N ALA 733.A O no hydrogen 2.924 N/A TYR 738.A N VAL 734.A O no hydrogen 2.930 N/A HIS 744.A ND1 THR 665.A O no hydrogen 2.645 N/A THR 745.A N ASN 743.A OD1 no hydrogen 3.420 N/A THR 745.A OG1 THR 666.A OG1 no hydrogen 3.331 N/A ILE 747.A N ASN 743.A O no hydrogen 3.128 N/A MET 748.A N HIS 744.A O no hydrogen 2.880 N/A ALA 749.A N THR 745.A O no hydrogen 2.901 N/A ALA 749.A N VAL 746.A O no hydrogen 3.340 N/A LYS 750.A N VAL 746.A O no hydrogen 2.896 N/A THR 751.A OG1 ILE 747.A O no hydrogen 2.840 N/A GLY 752.A N ALA 749.A O no hydrogen 3.398 N/A ARG 754.A N MET 748.A O no hydrogen 3.089 N/A LYS 756.A N ASN 759.A OD1 no hydrogen 3.228 N/A ASN 759.A N LYS 756.A O no hydrogen 3.218 N/A THR 761.A N ILE 757.A O no hydrogen 2.927 N/A GLN 762.A N LEU 758.A O no hydrogen 2.906 N/A GLN 762.A NE2 LEU 767.A O no hydrogen 3.415 N/A MET 763.A N ASN 759.A O no hydrogen 2.911 N/A ALA 764.A N ILE 760.A O no hydrogen 2.915 N/A LEU 767.A N ASN 804.A O no hydrogen 2.914 N/A GLY 768.A N VAL 802.A O no hydrogen 3.364 N/A GLN 769.A NE2 GLN 770.A O no hydrogen 2.315 N/A GLN 770.A NE2 GLY 768.A O no hydrogen 2.598 N/A ILE 772.A N LYS 775.A O no hydrogen 3.030 N/A LYS 775.A N ILE 772.A O no hydrogen 3.143 N/A ARG 776.A NE GLU 717.A OE1 no hydrogen 2.761 N/A ARG 784.A N PHE 781.A O no hydrogen 3.323 N/A ARG 784.A NH1 PHE 789.A O no hydrogen 2.747 N/A GLY 792.A N GLY 783.A O no hydrogen 3.216 N/A GLY 795.A N ASP 793.A OD1 no hydrogen 3.136 N/A PHE 801.A N ALA 796.A O no hydrogen 3.402 N/A ASN 804.A ND2 GLU 814.A OE1 no hydrogen 2.712 N/A SER 805.A N SER 808.A OG no hydrogen 3.070 N/A SER 805.A OG SER 808.A OG no hydrogen 2.840 N/A TYR 806.A OH HIS 818.A NE2 no hydrogen 2.431 N/A LYS 807.A NZ ILE 668.A O no hydrogen 3.201 N/A SER 808.A N SER 805.A OG no hydrogen 3.159 N/A SER 808.A OG SER 805.A O no hydrogen 3.228 N/A SER 808.A OG SER 805.A OG no hydrogen 2.840 N/A THR 811.A N GLU 814.A OE1 no hydrogen 2.801 N/A THR 811.A OG1 GLN 813.A OE1 no hydrogen 3.346 N/A THR 811.A OG1 GLU 814.A OE1 no hydrogen 2.606 N/A TYR 815.A N THR 811.A O no hydrogen 2.857 N/A PHE 816.A N PRO 812.A O no hydrogen 2.926 N/A PHE 817.A N GLN 813.A O no hydrogen 2.944 N/A HIS 818.A N GLU 814.A O no hydrogen 2.863 N/A ALA 819.A N TYR 815.A O no hydrogen 2.965 N/A MET 820.A N PHE 816.A O no hydrogen 2.943 N/A GLY 821.A N PHE 817.A O no hydrogen 2.921 N/A GLY 822.A N HIS 818.A O no hydrogen 2.876 N/A ARG 823.A N ALA 819.A O no hydrogen 3.024 N/A VAL 827.A N ARG 823.A O no hydrogen 3.048 N/A ASP 828.A N GLU 824.A O no hydrogen 2.898 N/A THR 829.A N GLY 825.A O no hydrogen 2.955 N/A THR 829.A OG1 GLY 825.A O no hydrogen 3.164 N/A THR 829.A OG1 LEU 826.A O no hydrogen 2.837 N/A ALA 830.A N LEU 826.A O no hydrogen 2.954 N/A VAL 831.A N VAL 827.A O no hydrogen 2.942 N/A VAL 831.A N ASP 828.A O no hydrogen 3.166 N/A ARG 832.A N ASP 828.A O no hydrogen 2.962 N/A SER 836.A N ARG 832.A O no hydrogen 3.062 N/A GLY 837.A N THR 833.A O no hydrogen 2.862 N/A TYR 838.A N ALA 834.A O no hydrogen 2.952 N/A MET 839.A N GLN 835.A O no hydrogen 2.952 N/A GLN 840.A N SER 836.A O no hydrogen 2.984 N/A GLN 840.A NE2 LEU 427.A O no hydrogen 3.020 N/A ARG 841.A N GLY 837.A O no hydrogen 2.863 N/A ARG 842.A N TYR 838.A O no hydrogen 2.980 N/A LEU 843.A N MET 839.A O no hydrogen 2.945 N/A ILE 844.A N GLN 840.A O no hydrogen 2.884 N/A ASN 845.A N ARG 841.A O no hydrogen 2.917 N/A ALA 846.A N LEU 843.A O no hydrogen 3.281 N/A LEU 847.A N LEU 843.A O no hydrogen 3.172 N/A LYS 851.A NZ GLU 853.A OE2 no hydrogen 3.256 N/A GLU 853.A N THR 857.A O no hydrogen 2.923 N/A GLY 856.A N GLU 853.A O no hydrogen 3.179 N/A VAL 858.A N GLN 867.A O no hydrogen 3.134 N/A ARG 859.A NE THR 857.A OG1 no hydrogen 3.399 N/A SER 860.A N ILE 864.A O no hydrogen 3.062 N/A SER 860.A OG GLU 862.A OE1 no hydrogen 2.766 N/A GLY 863.A N SER 860.A O no hydrogen 2.957 N/A ILE 864.A N SER 860.A OG no hydrogen 3.280 N/A VAL 866.A N VAL 858.A O no hydrogen 2.979 N/A GLY 874.A N TYR 870.A O no hydrogen 2.863 N/A MET 878.A N ASP 876.A OD1 no hydrogen 3.434 N/A LYS 879.A N ASP 876.A O no hydrogen 3.029 N/A SER 880.A N PRO 877.A O no hydrogen 3.320 N/A SER 880.A OG PRO 877.A O no hydrogen 2.895 N/A TRP 881.A N LYS 884.A O no hydrogen 3.039 N/A ARG 882.A NH1 GLU 627.A O no hydrogen 3.119 N/A GLY 883.A N SER 880.A OG no hydrogen 3.160 N/A LYS 884.A N TRP 881.A O no hydrogen 3.173 N/A THR 885.A OG1 ASP 873.A OD2 no hydrogen 3.426 N/A ARG 890.A NH1 THR 566.A O no hydrogen 2.898 N/A ARG 890.A NH2 THR 566.A O no hydrogen 3.446 N/A ILE 892.A N VAL 888.A O no hydrogen 2.951 N/A VAL 893.A N ASP 889.A O no hydrogen 2.893 N/A ARG 894.A N ARG 890.A O no hydrogen 2.926 N/A THR 895.A N ILE 891.A O no hydrogen 2.934 N/A THR 895.A OG1 ILE 891.A O no hydrogen 2.843 N/A LEU 896.A N ILE 892.A O no hydrogen 2.943 N/A LEU 897.A N VAL 893.A O no hydrogen 2.899 N/A LYS 898.A N ARG 894.A O no hydrogen 2.905 N/A MET 899.A N THR 895.A O no hydrogen 2.966 N/A ARG 900.A N LEU 896.A O no hydrogen 2.849 N/A