Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jgu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LYS 21.A O no hydrogen 2.716 N/A LEU 3.A N PHE 19.A O no hydrogen 2.884 N/A ASP 6.A N ARG 17.A O no hydrogen 3.452 N/A ILE 8.A N VAL 15.A O no hydrogen 2.700 N/A GLU 10.A N LYS 13.A O no hydrogen 2.900 N/A LYS 13.A NZ GLU 88.A OE1 no hydrogen 3.565 N/A LYS 13.A NZ GLU 88.A OE2 no hydrogen 3.119 N/A VAL 15.A N ILE 8.A O no hydrogen 2.650 N/A ILE 16.A N ASP 31.A O no hydrogen 3.174 N/A ARG 17.A N ASP 6.A O no hydrogen 2.710 N/A ARG 17.A NH2 ASP 6.A OD2 no hydrogen 2.812 N/A LEU 18.A N GLU 29.A O no hydrogen 2.760 N/A PHE 19.A N ASP 4.A O no hydrogen 3.358 N/A LYS 20.A N LYS 27.A O no hydrogen 2.700 N/A LYS 21.A N MET 1.A O no hydrogen 2.655 N/A LYS 21.A NZ ASP 204.A OD1 no hydrogen 3.319 N/A LYS 21.A NZ ASP 204.A OD2 no hydrogen 3.436 N/A GLU 22.A N LYS 25.A O no hydrogen 2.573 N/A LYS 25.A N GLU 22.A O no hydrogen 2.983 N/A LYS 27.A N LYS 20.A O no hydrogen 3.106 N/A GLU 29.A N LEU 18.A O no hydrogen 3.420 N/A ASP 31.A N ILE 16.A O no hydrogen 2.904 N/A ARG 32.A NH1 GLU 10.A OE1 no hydrogen 2.601 N/A THR 33.A N ASP 31.A OD1 no hydrogen 2.477 N/A TYR 37.A OH ASP 123.A OD2 no hydrogen 2.918 N/A ILE 38.A N LEU 85.A O no hydrogen 3.336 N/A TYR 39.A N PHE 110.A O no hydrogen 3.139 N/A ALA 40.A N TRP 83.A O no hydrogen 3.073 N/A LEU 41.A N ASP 108.A O no hydrogen 2.665 N/A ARG 43.A N ALA 105.A O no hydrogen 2.823 N/A SER 46.A OG ASP 44.A OD1 no hydrogen 3.331 N/A LYS 47.A N ASP 44.A O no hydrogen 2.699 N/A ILE 48.A N ASP 45.A O no hydrogen 2.992 N/A GLU 50.A N LYS 47.A O no hydrogen 2.178 N/A LYS 52.A N GLU 50.A O no hydrogen 2.984 N/A THR 55.A OG1 GLY 56.A O no hydrogen 2.789 N/A THR 55.A OG1 VAL 63.A O no hydrogen 3.465 N/A GLY 56.A N VAL 63.A O no hydrogen 2.838 N/A ARG 58.A N LYS 61.A O no hydrogen 2.356 N/A GLY 60.A N ARG 58.A O no hydrogen 2.085 N/A LYS 61.A N ARG 58.A O no hydrogen 2.990 N/A LYS 61.A NZ ILE 62.A O no hydrogen 3.504 N/A VAL 71.A N VAL 82.A O no hydrogen 2.740 N/A LYS 73.A N ILE 80.A O no hydrogen 2.854 N/A LYS 73.A NZ ASN 365.A OD1 no hydrogen 2.279 N/A LYS 74.A NZ ARG 364.A O no hydrogen 3.477 N/A PHE 75.A N LYS 78.A O no hydrogen 2.667 N/A ILE 80.A N LYS 73.A O no hydrogen 3.251 N/A VAL 82.A N VAL 71.A O no hydrogen 2.539 N/A TRP 83.A N ALA 40.A O no hydrogen 2.675 N/A LYS 84.A NZ TYR 86.A OH no hydrogen 2.991 N/A LEU 85.A N ILE 38.A O no hydrogen 2.958 N/A TYR 86.A N ASP 67.A O no hydrogen 3.212 N/A LEU 87.A N PRO 36.A O no hydrogen 3.008 N/A HIS 89.A N ASP 92.A OD2 no hydrogen 3.128 N/A ASP 92.A N HIS 89.A O no hydrogen 2.653 N/A LEU 96.A N VAL 93.A O no hydrogen 2.920 N/A ARG 97.A N VAL 93.A O no hydrogen 3.082 N/A ARG 97.A NH1 TYR 112.A O no hydrogen 3.231 N/A VAL 100.A N ARG 97.A O no hydrogen 2.577 N/A ARG 101.A N ARG 97.A O no hydrogen 2.944 N/A ARG 101.A NE GLU 98.A OE1 no hydrogen 3.033 N/A ARG 101.A NE GLU 98.A OE2 no hydrogen 2.770 N/A ARG 101.A NH1 TYR 112.A OH no hydrogen 3.137 N/A ARG 101.A NH2 GLU 98.A OE2 no hydrogen 2.790 N/A GLU 102.A N GLU 98.A O no hydrogen 2.992 N/A HIS 103.A N VAL 100.A O no hydrogen 2.870 N/A ALA 105.A N HIS 103.A ND1 no hydrogen 2.889 N/A VAL 106.A N HIS 103.A O no hydrogen 2.975 N/A VAL 107.A N LEU 41.A O no hydrogen 2.962 N/A ILE 109.A N ASP 108.A OD1 no hydrogen 3.072 N/A PHE 110.A N TYR 39.A O no hydrogen 2.798 N/A LYS 118.A N PRO 115.A O no hydrogen 3.152 N/A ARG 119.A N PRO 115.A O no hydrogen 2.880 N/A ARG 119.A NH1 ASP 123.A OD1 no hydrogen 2.261 N/A TYR 120.A N PHE 116.A O no hydrogen 2.701 N/A TYR 120.A OH ASP 31.A OD2 no hydrogen 2.994 N/A LEU 121.A N ALA 117.A O no hydrogen 3.289 N/A ILE 122.A N LYS 118.A O no hydrogen 3.246 N/A ASP 123.A N ARG 119.A O no hydrogen 2.933 N/A LYS 124.A N TYR 120.A O no hydrogen 3.044 N/A LYS 124.A NZ ASP 31.A OD2 no hydrogen 3.110 N/A GLY 125.A N ILE 122.A O no hydrogen 3.165 N/A LEU 126.A N LEU 121.A O no hydrogen 2.870 N/A MET 129.A N ILE 2.A O no hydrogen 3.198 N/A LYS 136.A N ASP 204.A OD2 no hydrogen 3.322 N/A LEU 138.A N ILE 205.A O no hydrogen 3.315 N/A ALA 139.A N ALA 163.A O no hydrogen 3.036 N/A PHE 140.A N VAL 207.A O no hydrogen 3.386 N/A ASP 141.A N SER 161.A O no hydrogen 3.067 N/A ILE 142.A N ASP 141.A OD2 no hydrogen 2.567 N/A GLU 143.A N MET 159.A O no hydrogen 3.070 N/A ILE 157.A N GLU 187.A OE1 no hydrogen 3.069 N/A MET 159.A N GLU 143.A O no hydrogen 3.017 N/A ILE 160.A N ILE 171.A O no hydrogen 3.150 N/A SER 161.A N ASP 141.A O no hydrogen 2.986 N/A SER 161.A OG SER 312.A O no hydrogen 3.132 N/A SER 161.A OG SER 312.A OG no hydrogen 2.778 N/A TYR 162.A N ARG 169.A O no hydrogen 3.027 N/A ALA 163.A N ALA 139.A O no hydrogen 2.727 N/A ASP 164.A N GLU 167.A O no hydrogen 3.174 N/A ASN 166.A N ASP 164.A OD1 no hydrogen 3.015 N/A GLU 167.A N ASP 164.A OD1 no hydrogen 3.088 N/A ILE 171.A N ILE 160.A O no hydrogen 2.556 N/A THR 172.A N GLU 182.A O no hydrogen 2.782 N/A THR 172.A OG1 ILE 158.A O no hydrogen 2.766 N/A TRP 173.A NE1 ILE 157.A O no hydrogen 2.964 N/A LEU 178.A N ILE 176.A O no hydrogen 2.445 N/A VAL 181.A N LEU 178.A O no hydrogen 2.987 N/A GLU 182.A N VAL 170.A O no hydrogen 3.078 N/A SER 183.A OG LYS 174.A O no hydrogen 2.931 N/A VAL 184.A N THR 172.A O no hydrogen 2.634 N/A LYS 188.A N THR 186.A OG1 no hydrogen 2.505 N/A GLU 189.A N THR 186.A OG1 no hydrogen 3.362 N/A MET 190.A N THR 186.A O no hydrogen 3.289 N/A ILE 191.A N GLU 187.A O no hydrogen 3.266 N/A LYS 192.A N LYS 188.A O no hydrogen 3.226 N/A ARG 193.A N GLU 189.A O no hydrogen 3.016 N/A ARG 193.A NH1 GLU 182.A OE2 no hydrogen 3.274 N/A PHE 194.A N MET 190.A O no hydrogen 3.062 N/A LEU 195.A N ILE 191.A O no hydrogen 2.881 N/A ARG 196.A N LYS 192.A O no hydrogen 2.608 N/A ARG 196.A NH2 GLU 200.A OE2 no hydrogen 3.293 N/A ILE 197.A N ARG 193.A O no hydrogen 2.639 N/A ILE 198.A N PHE 194.A O no hydrogen 2.918 N/A ARG 199.A N LEU 195.A O no hydrogen 3.019 N/A GLU 200.A N ARG 196.A O no hydrogen 2.839 N/A LYS 201.A N ILE 197.A O no hydrogen 2.788 N/A LYS 201.A NZ ASP 164.A OD2 no hydrogen 3.360 N/A ASP 202.A N ILE 198.A O no hydrogen 2.723 N/A ASP 204.A N LYS 136.A O no hydrogen 2.885 N/A ILE 205.A N LYS 136.A O no hydrogen 3.117 N/A ILE 206.A N ILE 256.A O no hydrogen 2.848 N/A VAL 207.A N LEU 138.A O no hydrogen 2.937 N/A THR 208.A N PHE 258.A O no hydrogen 3.196 N/A ASN 210.A N ASP 259.A OD1 no hydrogen 2.282 N/A ASP 212.A N ASP 259.A OD2 no hydrogen 2.675 N/A PHE 214.A N ASN 210.A O no hydrogen 2.576 N/A PHE 216.A N GLY 211.A O no hydrogen 2.935 N/A TYR 218.A N PHE 214.A O no hydrogen 2.934 N/A TYR 218.A OH GLY 155.A O no hydrogen 2.316 N/A LEU 219.A N ASP 215.A O no hydrogen 3.322 N/A ALA 220.A N PHE 216.A O no hydrogen 3.338 N/A LYS 221.A N PRO 217.A O no hydrogen 3.119 N/A LYS 221.A NZ PHE 152.A O no hydrogen 3.464 N/A ARG 222.A N TYR 218.A O no hydrogen 3.088 N/A ARG 222.A NE GLU 187.A OE2 no hydrogen 3.111 N/A ARG 222.A NH1 GLY 153.A O no hydrogen 3.318 N/A ARG 222.A NH2 GLU 187.A OE2 no hydrogen 2.681 N/A ALA 223.A N ALA 220.A O no hydrogen 2.923 N/A GLU 224.A N ALA 220.A O no hydrogen 2.924 N/A LEU 226.A N ALA 223.A O no hydrogen 3.022 N/A LEU 230.A N GLU 238.A OE1 no hydrogen 3.054 N/A GLY 233.A N SER 237.A O no hydrogen 2.659 N/A ARG 234.A N LYS 253.A O no hydrogen 2.588 N/A ARG 234.A NE ASP 202.A OD1 no hydrogen 2.974 N/A ARG 234.A NH1 ASP 204.A OD1 no hydrogen 2.834 N/A ARG 234.A NH1 GLY 254.A O no hydrogen 2.923 N/A ARG 234.A NH2 ASP 202.A OD1 no hydrogen 3.198 N/A ARG 234.A NH2 ASP 202.A OD2 no hydrogen 3.330 N/A ARG 234.A NH2 ASP 204.A OD1 no hydrogen 2.436 N/A GLY 236.A N GLY 233.A O no hydrogen 3.306 N/A SER 237.A OG ASP 235.A OD1 no hydrogen 2.371 N/A SER 237.A OG ASP 235.A OD2 no hydrogen 3.513 N/A LYS 240.A N GLU 251.A O no hydrogen 3.266 N/A GLN 242.A N ALA 249.A O no hydrogen 2.639 N/A GLN 242.A NE2 GLU 251.A OE1 no hydrogen 3.275 N/A ALA 249.A N GLN 242.A O no hydrogen 3.102 N/A VAL 250.A N ASP 212.A OD1 no hydrogen 3.215 N/A GLU 251.A N LYS 240.A O no hydrogen 3.158 N/A ARG 255.A N VAL 252.A O no hydrogen 3.094 N/A ARG 255.A NE PRO 203.A O no hydrogen 2.960 N/A ARG 255.A NH1 ILE 232.A O no hydrogen 3.162 N/A ILE 256.A N ASP 204.A O no hydrogen 2.890 N/A PHE 258.A N ILE 206.A O no hydrogen 2.774 N/A LEU 260.A N THR 208.A O no hydrogen 2.917 N/A VAL 263.A N LEU 260.A O no hydrogen 2.759 N/A ILE 264.A N LEU 260.A O no hydrogen 3.310 N/A ARG 265.A N TYR 261.A O no hydrogen 3.493 N/A THR 266.A N ILE 264.A O no hydrogen 2.325 N/A THR 266.A OG1 VAL 263.A O no hydrogen 3.196 N/A THR 266.A OG1 THR 267.A OG1 no hydrogen 2.989 N/A THR 267.A OG1 THR 266.A OG1 no hydrogen 2.989 N/A ALA 277.A N THR 274.A OG1 no hydrogen 3.071 N/A VAL 278.A N THR 274.A O no hydrogen 2.761 N/A TYR 279.A N LEU 275.A O no hydrogen 2.573 N/A GLU 280.A N GLU 276.A O no hydrogen 3.068 N/A GLU 280.A N ALA 277.A O no hydrogen 3.293 N/A ALA 281.A N ALA 277.A O no hydrogen 3.445 N/A ILE 282.A N VAL 278.A O no hydrogen 3.398 N/A PHE 283.A N TYR 279.A O no hydrogen 3.488 N/A GLY 284.A N GLU 280.A O no hydrogen 2.613 N/A LYS 287.A NZ GLU 314.A OE1 no hydrogen 3.550 N/A TYR 291.A OH GLU 288.A O no hydrogen 3.065 N/A LYS 297.A N GLU 294.A O no hydrogen 2.778 N/A SER 301.A OG LYS 297.A O no hydrogen 2.604 N/A GLU 306.A N GLU 303.A OE1 no hydrogen 3.040 N/A ARG 307.A NH1 ASP 293.A OD1 no hydrogen 2.928 N/A VAL 308.A N ASN 304.A O no hydrogen 3.290 N/A ALA 309.A N LEU 305.A O no hydrogen 2.806 N/A LYS 310.A N GLU 306.A O no hydrogen 3.309 N/A TYR 311.A N ARG 307.A O no hydrogen 3.250 N/A SER 312.A N VAL 308.A O no hydrogen 3.030 N/A SER 312.A N ALA 309.A O no hydrogen 2.560 N/A SER 312.A OG SER 161.A OG no hydrogen 2.778 N/A MET 313.A N ALA 309.A O no hydrogen 3.010 N/A GLU 314.A N TYR 311.A O no hydrogen 3.230 N/A ASP 315.A N TYR 311.A O no hydrogen 2.791 N/A ALA 316.A N SER 312.A O no hydrogen 3.065 N/A LYS 317.A N MET 313.A O no hydrogen 3.253 N/A ALA 318.A N GLU 314.A O no hydrogen 2.914 N/A THR 319.A N ASP 315.A O no hydrogen 3.119 N/A THR 319.A OG1 ASP 315.A O no hydrogen 2.016 N/A THR 319.A OG1 ALA 316.A O no hydrogen 3.321 N/A TYR 320.A N ALA 316.A O no hydrogen 2.512 N/A GLU 321.A N LYS 317.A O no hydrogen 2.935 N/A LEU 322.A N ALA 318.A O no hydrogen 3.026 N/A GLY 323.A N THR 319.A O no hydrogen 3.137 N/A LYS 324.A N TYR 320.A O no hydrogen 2.968 N/A GLU 325.A N LEU 322.A O no hydrogen 2.642 N/A PHE 326.A N LEU 322.A O no hydrogen 2.661 N/A ILE 331.A N LEU 327.A O no hydrogen 2.720 N/A GLN 332.A N PRO 328.A O no hydrogen 2.899 N/A LEU 333.A N MET 329.A O no hydrogen 2.771 N/A SER 334.A N GLU 330.A O no hydrogen 3.005 N/A SER 334.A OG GLU 330.A O no hydrogen 2.514 N/A ARG 335.A N ILE 331.A O no hydrogen 2.900 N/A LEU 336.A N GLN 332.A O no hydrogen 2.907 N/A VAL 337.A N LEU 333.A O no hydrogen 2.705 N/A GLY 338.A N SER 334.A O no hydrogen 2.783 N/A GLN 339.A N SER 334.A O no hydrogen 3.400 N/A GLN 339.A NE2 LYS 118.A O no hydrogen 3.471 N/A VAL 344.A N PRO 340.A O no hydrogen 2.678 N/A SER 345.A N LEU 341.A O no hydrogen 3.049 N/A SER 345.A OG LEU 341.A O no hydrogen 2.554 N/A ARG 346.A N ASP 343.A O no hydrogen 2.743 N/A ARG 346.A NE ASP 212.A OD2 no hydrogen 3.249 N/A ARG 346.A NH1 HIS 257.A O no hydrogen 3.024 N/A ARG 346.A NH1 TRP 342.A O no hydrogen 2.712 N/A ARG 346.A NH2 ASP 212.A OD1 no hydrogen 3.021 N/A ARG 346.A NH2 ASP 212.A OD2 no hydrogen 3.345 N/A ARG 346.A NH2 HIS 257.A O no hydrogen 2.787 N/A SER 347.A OG VAL 344.A O no hydrogen 3.207 N/A ASN 351.A N SER 348.A O no hydrogen 2.963 N/A ASN 351.A N SER 348.A OG no hydrogen 3.278 N/A LEU 352.A N SER 348.A O no hydrogen 3.225 N/A VAL 353.A N THR 349.A O no hydrogen 3.230 N/A TRP 355.A N ASN 351.A O no hydrogen 2.992 N/A PHE 356.A N LEU 352.A O no hydrogen 2.783 N/A LEU 357.A N VAL 353.A O no hydrogen 2.767 N/A LEU 357.A N GLU 354.A O no hydrogen 2.904 N/A LEU 358.A N GLU 354.A O no hydrogen 2.851 N/A ARG 359.A N TRP 355.A O no hydrogen 3.267 N/A ARG 359.A NH2 LEU 121.A O no hydrogen 3.182 N/A LYS 360.A NZ GLU 363.A OE1 no hydrogen 3.551 N/A ALA 361.A N LEU 357.A O no hydrogen 2.771 N/A TYR 362.A N LEU 358.A O no hydrogen 3.309 N/A GLU 363.A N ARG 359.A O no hydrogen 3.319 N/A ARG 364.A NH1 SER 452.A OG no hydrogen 2.870 N/A ARG 364.A NH2 SER 452.A OG no hydrogen 3.369 N/A ASN 365.A N TYR 362.A O no hydrogen 2.716 N/A GLU 366.A N ALA 361.A O no hydrogen 2.756 N/A VAL 367.A N LYS 74.A O no hydrogen 2.954 N/A ALA 368.A N GLU 111.A OE1 no hydrogen 3.092 N/A ASN 370.A ND2 ILE 109.A O no hydrogen 3.176 N/A GLU 376.A N SER 373.A OG no hydrogen 2.830 N/A GLN 378.A N GLU 375.A O no hydrogen 2.652 N/A ARG 379.A N GLU 375.A O no hydrogen 3.064 N/A ARG 380.A NH1 ALA 501.A O no hydrogen 2.530 N/A ARG 380.A NH1 ALA 503.A O no hydrogen 3.294 N/A SER 384.A OG GLU 383.A OE2 no hydrogen 3.017 N/A THR 386.A OG1 TYR 385.A O no hydrogen 2.420 N/A LYS 391.A NZ GLU 523.A OE2 no hydrogen 2.800 N/A GLU 394.A N LEU 538.A O no hydrogen 3.096 N/A TRP 398.A N GLY 587.A O no hydrogen 2.842 N/A TRP 398.A NE1 GLU 394.A O no hydrogen 2.756 N/A ASN 400.A N LYS 585.A O no hydrogen 3.081 N/A ILE 401.A N TYR 584.A O no hydrogen 3.017 N/A VAL 402.A N ALA 547.A O no hydrogen 2.790 N/A TYR 403.A N GLY 582.A O no hydrogen 3.175 N/A LEU 404.A N LEU 545.A O no hydrogen 2.795 N/A ASP 405.A N GLU 579.A O no hydrogen 2.859 N/A LYS 407.A N GLU 577.A O no hydrogen 2.502 N/A SER 412.A N SER 408.A O no hydrogen 2.996 N/A SER 412.A OG SER 408.A O no hydrogen 3.114 N/A SER 412.A OG LEU 409.A O no hydrogen 2.519 N/A ILE 413.A N LEU 409.A O no hydrogen 2.704 N/A ILE 414.A N TYR 410.A O no hydrogen 2.945 N/A ILE 415.A N PRO 411.A O no hydrogen 3.118 N/A THR 416.A N SER 412.A O no hydrogen 3.058 N/A THR 416.A OG1 SER 412.A O no hydrogen 2.462 N/A HIS 417.A N ILE 413.A O no hydrogen 2.983 N/A ASN 418.A N ILE 415.A O no hydrogen 3.286 N/A ASN 418.A ND2 ILE 446.A O no hydrogen 2.759 N/A VAL 419.A N ILE 414.A O no hydrogen 3.111 N/A ASP 422.A N SER 420.A OG no hydrogen 3.273 N/A THR 423.A N SER 420.A O no hydrogen 3.018 N/A THR 423.A OG1 ASN 418.A O no hydrogen 2.786 N/A THR 423.A OG1 SER 420.A O no hydrogen 2.805 N/A LEU 424.A N PRO 421.A O no hydrogen 3.409 N/A ASN 425.A N LYS 441.A O no hydrogen 2.544 N/A CYS 429.A SG ASN 431.A O no hydrogen 2.820 N/A CYS 429.A SG ASP 445.A OD1 no hydrogen 2.974 N/A LYS 430.A N ASP 445.A OD2 no hydrogen 2.952 N/A ASN 431.A N ASP 445.A OD1 no hydrogen 2.941 N/A ALA 435.A N HIS 440.A O no hydrogen 2.841 N/A HIS 440.A NE2 GLU 512.A OE1 no hydrogen 2.607 N/A LYS 441.A N ASN 425.A OD1 no hydrogen 2.901 N/A LYS 441.A NZ TYR 432.A OH no hydrogen 2.403 N/A PHE 442.A N ASP 433.A O no hydrogen 3.299 N/A CYS 443.A N THR 423.A O no hydrogen 2.717 N/A LYS 444.A N ASN 431.A O no hydrogen 2.691 N/A LYS 444.A NZ THR 416.A O no hydrogen 2.571 N/A PHE 449.A N ASP 422.A OD2 no hydrogen 3.328 N/A SER 452.A N GLY 448.A O no hydrogen 2.882 N/A LEU 453.A N PHE 449.A O no hydrogen 3.459 N/A LEU 454.A N ILE 450.A O no hydrogen 2.740 N/A GLY 455.A N PRO 451.A O no hydrogen 2.723 N/A HIS 456.A N SER 452.A O no hydrogen 2.894 N/A LEU 457.A N LEU 453.A O no hydrogen 2.812 N/A LEU 458.A N LEU 454.A O no hydrogen 2.764 N/A GLU 459.A N GLY 455.A O no hydrogen 2.691 N/A GLU 460.A N HIS 456.A O no hydrogen 3.108 N/A GLU 460.A N LEU 457.A O no hydrogen 2.635 N/A ARG 461.A N LEU 457.A O no hydrogen 3.055 N/A ARG 461.A NE GLN 484.A O no hydrogen 3.382 N/A GLN 462.A N LEU 458.A O no hydrogen 3.167 N/A LYS 463.A N GLU 459.A O no hydrogen 3.418 N/A ILE 464.A N GLU 460.A O no hydrogen 3.310 N/A ILE 464.A N ARG 461.A O no hydrogen 3.366 N/A LYS 465.A N ARG 461.A O no hydrogen 3.029 N/A THR 466.A N GLN 462.A O no hydrogen 2.774 N/A THR 466.A OG1 GLN 462.A O no hydrogen 3.038 N/A LYS 467.A N LYS 463.A O no hydrogen 3.151 N/A MET 468.A N ILE 464.A O no hydrogen 2.996 N/A GLU 470.A N LYS 467.A O no hydrogen 2.977 N/A THR 471.A N MET 468.A O no hydrogen 2.738 N/A THR 471.A OG1 ASP 473.A O no hydrogen 3.242 N/A ILE 475.A N ASP 473.A OD2 no hydrogen 2.173 N/A LYS 477.A N ASP 473.A O no hydrogen 2.992 N/A ILE 478.A N PRO 474.A O no hydrogen 3.321 N/A LEU 479.A N ILE 475.A O no hydrogen 3.183 N/A LEU 480.A N GLU 476.A O no hydrogen 2.700 N/A ASP 481.A N LYS 477.A O no hydrogen 2.850 N/A TYR 482.A N ILE 478.A O no hydrogen 2.846 N/A ARG 483.A N LEU 479.A O no hydrogen 3.006 N/A GLN 484.A N LEU 480.A O no hydrogen 3.054 N/A LYS 485.A N ASP 481.A O no hydrogen 3.053 N/A ALA 486.A N TYR 482.A O no hydrogen 3.129 N/A ILE 487.A N ARG 483.A O no hydrogen 3.078 N/A LYS 488.A N GLN 484.A O no hydrogen 2.894 N/A LEU 489.A N LYS 485.A O no hydrogen 2.917 N/A LEU 490.A N ALA 486.A O no hydrogen 2.879 N/A ALA 491.A N ILE 487.A O no hydrogen 2.683 N/A ASN 492.A N LYS 488.A O no hydrogen 2.911 N/A SER 493.A N LEU 490.A O no hydrogen 2.995 N/A SER 493.A OG LEU 489.A O no hydrogen 2.647 N/A SER 493.A OG LEU 490.A O no hydrogen 3.436 N/A TYR 495.A OH THR 515.A OG1 no hydrogen 2.431 N/A TYR 497.A N SER 493.A O no hydrogen 3.229 N/A TYR 497.A OH GLU 354.A OE2 no hydrogen 2.746 N/A TYR 498.A N PHE 494.A O no hydrogen 3.037 N/A TYR 498.A OH VAL 419.A O no hydrogen 2.832 N/A GLY 499.A N TYR 495.A O no hydrogen 3.379 N/A TYR 500.A N TYR 497.A O no hydrogen 2.527 N/A ALA 503.A N TYR 500.A O no hydrogen 2.955 N/A ARG 504.A N GLU 354.A OE2 no hydrogen 2.604 N/A TRP 505.A N TYR 497.A OH no hydrogen 3.167 N/A TYR 506.A N ALA 503.A O no hydrogen 3.344 N/A CYS 507.A N TYR 498.A O no hydrogen 3.478 N/A CYS 507.A SG GLU 509.A OE2 no hydrogen 3.882 N/A LYS 508.A NZ TYR 506.A OH no hydrogen 3.563 N/A CYS 510.A N CYS 507.A O no hydrogen 2.805 N/A ALA 511.A N CYS 507.A O no hydrogen 3.069 N/A GLU 512.A N LYS 508.A O no hydrogen 2.842 N/A SER 513.A N GLU 509.A O no hydrogen 3.098 N/A SER 513.A OG GLU 509.A O no hydrogen 2.796 N/A VAL 514.A N CYS 510.A O no hydrogen 3.388 N/A THR 515.A N ALA 511.A O no hydrogen 3.300 N/A ALA 516.A N GLU 512.A O no hydrogen 2.930 N/A TRP 517.A N SER 513.A O no hydrogen 2.686 N/A GLY 518.A N VAL 514.A O no hydrogen 2.521 N/A ARG 519.A N THR 515.A O no hydrogen 2.965 N/A LYS 520.A N ALA 516.A O no hydrogen 3.210 N/A GLU 523.A N ARG 519.A O no hydrogen 3.059 N/A LEU 524.A N LYS 520.A O no hydrogen 3.157 N/A VAL 525.A N TYR 521.A O no hydrogen 2.885 N/A TRP 526.A N ILE 522.A O no hydrogen 2.811 N/A TRP 526.A NE1 GLU 530.A OE2 no hydrogen 3.103 N/A LYS 527.A N GLU 523.A O no hydrogen 2.945 N/A GLU 528.A N LEU 524.A O no hydrogen 3.030 N/A LEU 529.A N VAL 525.A O no hydrogen 2.659 N/A GLU 530.A N TRP 526.A O no hydrogen 3.042 N/A GLU 531.A N LYS 527.A O no hydrogen 2.698 N/A LYS 532.A NZ TYR 567.A OH no hydrogen 3.406 N/A PHE 533.A N GLU 528.A O no hydrogen 3.312 N/A LYS 536.A N THR 548.A O no hydrogen 2.520 N/A LYS 536.A NZ GLU 394.A OE2 no hydrogen 2.549 N/A VAL 537.A N GLU 530.A OE1 no hydrogen 2.808 N/A LEU 538.A N TYR 546.A O no hydrogen 2.866 N/A TYR 539.A OH LYS 592.A O no hydrogen 2.464 N/A ASP 541.A N GLY 544.A O no hydrogen 2.688 N/A THR 542.A OG1 ASP 541.A OD1 no hydrogen 2.790 N/A ASP 543.A N ASP 541.A O no hydrogen 2.466 N/A GLY 544.A N ASP 541.A O no hydrogen 3.281 N/A TYR 546.A N TYR 539.A O no hydrogen 3.235 N/A ALA 547.A N VAL 402.A O no hydrogen 2.698 N/A THR 548.A N LYS 536.A O no hydrogen 3.330 N/A THR 548.A OG1 ASN 400.A O no hydrogen 3.025 N/A ILE 549.A N THR 548.A OG1 no hydrogen 2.557 N/A GLY 552.A N ILE 549.A O no hydrogen 2.678 N/A LYS 558.A NZ GLU 600.A OE1 no hydrogen 3.376 N/A LYS 558.A NZ GLU 600.A OE2 no hydrogen 2.471 N/A LYS 560.A N GLU 556.A O no hydrogen 2.705 N/A LYS 560.A NZ GLU 563.A OE2 no hydrogen 3.370 N/A ALA 561.A N ILE 557.A O no hydrogen 2.842 N/A LEU 562.A N LYS 558.A O no hydrogen 2.865 N/A GLU 563.A N LYS 559.A O no hydrogen 2.954 N/A PHE 564.A N LYS 560.A O no hydrogen 2.875 N/A VAL 565.A N ALA 561.A O no hydrogen 3.117 N/A VAL 565.A N LEU 562.A O no hydrogen 3.011 N/A LYS 566.A N GLU 563.A O no hydrogen 3.163 N/A TYR 567.A N GLU 563.A O no hydrogen 3.230 N/A TYR 567.A OH GLU 528.A OE1 no hydrogen 2.779 N/A ILE 568.A N PHE 564.A O no hydrogen 2.907 N/A ASN 569.A N VAL 565.A O no hydrogen 3.125 N/A LYS 571.A N ILE 568.A O no hydrogen 2.411 N/A LEU 572.A N ILE 568.A O no hydrogen 2.919 N/A LEU 572.A N ASN 569.A O no hydrogen 2.952 N/A LEU 576.A N PRO 573.A O no hydrogen 3.112 N/A GLU 579.A N ASP 405.A O no hydrogen 2.612 N/A GLU 581.A N TYR 403.A O no hydrogen 2.928 N/A TYR 584.A N ILE 401.A O no hydrogen 3.038 N/A ARG 586.A NH1 LEU 626.A O no hydrogen 3.012 N/A GLY 587.A N TRP 398.A O no hydrogen 3.276 N/A PHE 588.A N ALA 596.A O no hydrogen 3.106 N/A THR 591.A N ARG 594.A O no hydrogen 3.236 N/A ARG 594.A N THR 591.A O no hydrogen 3.266 N/A TYR 595.A N ARG 607.A O no hydrogen 3.363 N/A ALA 596.A N PHE 588.A O no hydrogen 2.945 N/A VAL 597.A N ILE 605.A O no hydrogen 3.028 N/A ILE 598.A N ARG 586.A O no hydrogen 3.201 N/A ASP 599.A N LYS 603.A O no hydrogen 2.908 N/A GLU 601.A N ASP 599.A OD2 no hydrogen 2.638 N/A GLY 602.A N ASP 599.A O no hydrogen 3.157 N/A LYS 603.A N ASP 599.A OD2 no hydrogen 3.428 N/A ILE 605.A N VAL 597.A O no hydrogen 3.179 N/A THR 606.A OG1 TYR 595.A O no hydrogen 3.204 N/A THR 606.A OG1 ARG 607.A O no hydrogen 3.028 N/A ARG 607.A N TYR 595.A O no hydrogen 3.404 N/A GLU 612.A N LYS 654.A O no hydrogen 2.978 N/A LYS 615.A N SER 611.A O no hydrogen 3.044 N/A GLU 616.A N GLU 612.A O no hydrogen 3.460 N/A THR 617.A N ILE 613.A O no hydrogen 2.984 N/A THR 617.A OG1 ILE 613.A O no hydrogen 2.436 N/A GLN 618.A N ALA 614.A O no hydrogen 2.622 N/A GLN 618.A NE2 ALA 695.A O no hydrogen 2.910 N/A ARG 620.A N GLU 616.A O no hydrogen 3.304 N/A ARG 620.A N THR 617.A O no hydrogen 3.106 N/A VAL 621.A N THR 617.A O no hydrogen 2.999 N/A LEU 622.A N GLN 618.A O no hydrogen 3.246 N/A GLU 623.A N ALA 619.A O no hydrogen 2.894 N/A THR 624.A N ARG 620.A O no hydrogen 3.150 N/A THR 624.A OG1 ARG 620.A O no hydrogen 2.345 N/A THR 624.A OG1 VAL 621.A O no hydrogen 2.754 N/A ILE 625.A N VAL 621.A O no hydrogen 3.220 N/A LEU 626.A N LEU 622.A O no hydrogen 2.878 N/A HIS 628.A N GLU 623.A O no hydrogen 3.075 N/A ASP 630.A N THR 624.A O no hydrogen 2.772 N/A GLU 633.A N ASP 630.A OD1 no hydrogen 2.476 N/A VAL 635.A N VAL 631.A O no hydrogen 3.243 N/A ARG 636.A N GLU 632.A O no hydrogen 2.410 N/A ARG 636.A NE ARG 636.A O no hydrogen 2.584 N/A ARG 636.A NH2 GLU 640.A OE1 no hydrogen 2.920 N/A ILE 637.A N ALA 634.A O no hydrogen 2.440 N/A VAL 638.A N ALA 634.A O no hydrogen 2.618 N/A VAL 638.A N VAL 635.A O no hydrogen 2.637 N/A LYS 639.A N VAL 635.A O no hydrogen 2.721 N/A ILE 642.A N VAL 638.A O no hydrogen 2.944 N/A GLN 643.A N LYS 639.A O no hydrogen 3.126 N/A LYS 644.A N VAL 641.A O no hydrogen 2.949 N/A GLU 649.A N LYS 644.A O no hydrogen 2.742 N/A LYS 654.A NZ GLU 616.A OE2 no hydrogen 2.521 N/A HIS 658.A ND1 HIS 658.A O no hydrogen 2.589 N/A ALA 660.A N HIS 658.A O no hydrogen 2.119 N/A ALA 662.A N VAL 659.A O no hydrogen 2.899 N/A ALA 667.A N LYS 664.A O no hydrogen 3.374 N/A GLY 669.A N ALA 667.A O no hydrogen 2.625 N/A LYS 671.A N GLY 669.A O no hydrogen 2.995 N/A LYS 673.A NZ GLU 148.A O no hydrogen 3.273 N/A GLY 675.A N LYS 673.A O no hydrogen 2.365 N/A ALA 684.A N ASP 683.A OD2 no hydrogen 2.991 N/A TYR 686.A OH ASN 690.A OD1 no hydrogen 3.021 N/A ILE 688.A N ALA 684.A O no hydrogen 3.273 N/A GLU 689.A N GLU 685.A O no hydrogen 3.192 N/A GLN 691.A N TYR 686.A O no hydrogen 3.401 N/A LEU 693.A N ILE 688.A O no hydrogen 2.882 N/A VAL 696.A N LEU 693.A O no hydrogen 3.049 N/A GLU 701.A N LEU 697.A O no hydrogen 3.309 N/A GLU 701.A N ARG 698.A O no hydrogen 2.851 N/A PHE 703.A N LEU 700.A O no hydrogen 2.643 N/A GLY 704.A N GLU 701.A O no hydrogen 2.332 N/A ARG 711.A N LYS 707.A O no hydrogen 3.187 N/A ARG 711.A N GLU 708.A O no hydrogen 2.325 N/A ARG 711.A NE GLU 689.A OE1 no hydrogen 2.423 N/A ARG 711.A NH2 GLU 689.A OE1 no hydrogen 2.478 N/A ARG 711.A NH2 GLU 689.A OE2 no hydrogen 2.711 N/A TYR 712.A N ASP 709.A O no hydrogen 2.706 N/A