Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lpf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG HIS 2.A O no hydrogen 3.548 N/A ARG 4.A NH2 GLU 332.A OE1 no hydrogen 3.321 N/A THR 8.A OG1 ILE 262.A O no hydrogen 3.011 N/A ILE 13.A N LEU 174.A O no hydrogen 2.835 N/A TRP 20.A N ILE 46.A O no hydrogen 3.131 N/A TRP 20.A NE1 ASP 17.A O no hydrogen 3.171 N/A ALA 21.A N GLN 71.A O no hydrogen 2.709 N/A SER 23.A N TRP 69.A O no hydrogen 3.253 N/A SER 23.A OG LEU 24.A O no hydrogen 3.277 N/A ASP 25.A N TYR 64.A OH no hydrogen 3.355 N/A ARG 26.A NH2 ASP 60.A O no hydrogen 2.999 N/A CYS 29.A N ASP 25.A OD1 no hydrogen 2.856 N/A GLY 30.A N ASP 25.A OD2 no hydrogen 2.821 N/A GLN 33.A N CYS 29.A O no hydrogen 2.884 N/A ARG 34.A NH1 GLU 37.A OE1 no hydrogen 2.938 N/A TRP 35.A N GLY 30.A O no hydrogen 3.176 N/A TRP 35.A NE1 GLN 33.A OE1 no hydrogen 3.086 N/A GLU 37.A N ARG 34.A O no hydrogen 3.023 N/A LEU 40.A N GLN 71.A OE1 no hydrogen 2.411 N/A ARG 44.A N PHE 22.A O no hydrogen 2.933 N/A ILE 46.A N TRP 20.A O no hydrogen 2.974 N/A VAL 48.A N GLY 18.A O no hydrogen 2.693 N/A GLY 50.A N ILE 169.A O no hydrogen 2.924 N/A SER 51.A N ARG 300.A O no hydrogen 2.916 N/A SER 51.A OG HIS 170.A NE2 no hydrogen 3.013 N/A SER 51.A OG ARG 300.A O no hydrogen 3.476 N/A PHE 52.A N ALA 167.A O no hydrogen 2.764 N/A ASN 53.A ND2 ALA 167.A O no hydrogen 3.292 N/A ASP 60.A N ASP 58.A OD1 no hydrogen 2.951 N/A ARG 62.A N ASP 58.A O no hydrogen 2.942 N/A ARG 62.A NE ASP 54.A OD1 no hydrogen 2.837 N/A ASN 63.A N ALA 59.A O no hydrogen 3.018 N/A TYR 64.A N ILE 61.A O no hydrogen 3.340 N/A TYR 64.A OH ASP 25.A O no hydrogen 1.979 N/A TYR 64.A OH ASN 67.A O no hydrogen 2.450 N/A GLY 66.A N ASN 136.A OD1 no hydrogen 3.061 N/A VAL 68.A N VAL 134.A O no hydrogen 3.019 N/A TRP 69.A N SER 23.A O no hydrogen 3.005 N/A TRP 69.A NE1 ASP 25.A OD2 no hydrogen 3.337 N/A TYR 70.A N VAL 132.A O no hydrogen 2.875 N/A GLN 71.A N ALA 21.A O no hydrogen 2.921 N/A GLN 71.A NE2 TRP 35.A O no hydrogen 3.578 N/A GLN 71.A NE2 SER 38.A O no hydrogen 3.512 N/A GLN 71.A NE2 THR 131.A OG1 no hydrogen 2.549 N/A ARG 72.A N ILE 130.A O no hydrogen 3.099 N/A ARG 72.A NH1 GLU 73.A O no hydrogen 2.823 N/A ARG 72.A NH2 LYS 15.A O no hydrogen 3.417 N/A VAL 74.A N VAL 128.A O no hydrogen 2.702 N/A ILE 76.A N LYS 126.A O no hydrogen 3.022 N/A TRP 80.A N PRO 77.A O no hydrogen 3.252 N/A ALA 81.A N GLY 79.A O no hydrogen 2.858 N/A ARG 84.A NE ASP 117.A OD2 no hydrogen 3.400 N/A ILE 85.A N THR 119.A OG1 no hydrogen 3.045 N/A VAL 86.A N TYR 175.A O no hydrogen 2.848 N/A LEU 87.A N ALA 116.A O no hydrogen 2.961 N/A ARG 88.A NE ASP 90.A OD1 no hydrogen 3.104 N/A ARG 88.A NH1 GLU 115.A OE1 no hydrogen 3.185 N/A ARG 88.A NH2 GLU 331.A OE2 no hydrogen 3.047 N/A PHE 89.A N PHE 114.A O no hydrogen 3.023 N/A ASP 90.A N SER 172.A O no hydrogen 2.974 N/A THR 93.A N GLY 168.A O no hydrogen 2.891 N/A THR 93.A OG1 GLY 110.A O no hydrogen 2.702 N/A THR 93.A OG1 HIS 170.A ND1 no hydrogen 2.571 N/A TYR 95.A N ASN 135.A O no hydrogen 3.121 N/A TYR 95.A OH GLU 106.A OE2 no hydrogen 2.884 N/A GLY 96.A N HIS 107.A O no hydrogen 3.057 N/A LYS 97.A N CYS 133.A O no hydrogen 2.773 N/A TRP 99.A N THR 131.A O no hydrogen 2.937 N/A VAL 100.A N GLN 103.A O no hydrogen 2.876 N/A ASN 101.A N ARG 129.A O no hydrogen 2.790 N/A VAL 105.A N VAL 98.A O no hydrogen 2.854 N/A HIS 107.A N GLY 96.A O no hydrogen 3.036 N/A THR 112.A OG1 GLU 389.A OE1 no hydrogen 2.974 N/A PHE 114.A N PHE 89.A O no hydrogen 3.023 N/A ALA 116.A N LEU 87.A O no hydrogen 3.054 N/A VAL 118.A N ILE 85.A O no hydrogen 2.782 N/A THR 119.A N ASP 117.A OD1 no hydrogen 3.434 N/A THR 119.A OG1 GLN 83.A O no hydrogen 3.485 N/A THR 119.A OG1 ASP 117.A OD1 no hydrogen 2.864 N/A TYR 121.A N VAL 118.A O no hydrogen 2.880 N/A VAL 122.A N THR 119.A O no hydrogen 3.158 N/A LYS 126.A N ILE 123.A O no hydrogen 2.944 N/A SER 127.A OG VAL 74.A O no hydrogen 3.129 N/A VAL 128.A N VAL 74.A O no hydrogen 2.718 N/A ARG 129.A N ASN 101.A OD1 no hydrogen 3.240 N/A ARG 129.A NE TRP 36.A O no hydrogen 2.785 N/A ARG 129.A NH2 TRP 36.A O no hydrogen 2.642 N/A ILE 130.A N ARG 72.A O no hydrogen 2.946 N/A THR 131.A N TRP 99.A O no hydrogen 3.119 N/A THR 131.A OG1 TRP 36.A O no hydrogen 3.551 N/A VAL 132.A N TYR 70.A O no hydrogen 2.754 N/A CYS 133.A N LYS 97.A O no hydrogen 2.859 N/A CYS 133.A SG ASN 67.A OD1 no hydrogen 3.212 N/A VAL 134.A N VAL 68.A O no hydrogen 2.861 N/A ASN 135.A N TYR 95.A O no hydrogen 2.765 N/A ASN 136.A ND2 TYR 64.A O no hydrogen 2.922 N/A LEU 138.A N GLN 157.A OE1 no hydrogen 2.925 N/A GLN 141.A N ASN 139.A OD1 no hydrogen 2.534 N/A THR 142.A N ASN 139.A O no hydrogen 3.179 N/A THR 142.A OG1 PRO 144.A O no hydrogen 3.442 N/A GLY 146.A N ASN 139.A O no hydrogen 3.269 N/A ILE 148.A N LYS 156.A O no hydrogen 2.895 N/A ASP 150.A N LYS 154.A O no hydrogen 3.345 N/A ASN 152.A N ASP 150.A OD1 no hydrogen 2.908 N/A GLY 153.A N ASP 150.A O no hydrogen 2.983 N/A LYS 154.A N ASP 150.A OD1 no hydrogen 3.238 N/A LYS 156.A N ILE 148.A O no hydrogen 2.901 N/A GLN 157.A NE2 LEU 138.A O no hydrogen 3.250 N/A GLN 157.A NE2 SER 158.A O no hydrogen 3.220 N/A PHE 164.A N ALA 545.A O no hydrogen 3.026 N/A ASN 165.A N TYR 159.A OH no hydrogen 3.096 N/A ASN 165.A ND2 ASN 136.A O no hydrogen 3.223 N/A TYR 166.A OH ASP 54.A OD2 no hydrogen 2.678 N/A ARG 171.A NH1 TYR 111.A O no hydrogen 2.773 N/A ARG 171.A NH1 PRO 328.A O no hydrogen 3.536 N/A ARG 171.A NH2 GLU 295.A OE1 no hydrogen 2.756 N/A ARG 171.A NH2 PRO 328.A O no hydrogen 2.820 N/A SER 172.A OG ASP 90.A OD2 no hydrogen 2.777 N/A LEU 174.A N ILE 13.A O no hydrogen 3.301 N/A TYR 175.A N VAL 86.A O no hydrogen 2.894 N/A TYR 175.A OH GLU 115.A OE1 no hydrogen 2.984 N/A THR 177.A N ARG 84.A O no hydrogen 3.172 N/A ASN 179.A N GLU 259.A OE2 no hydrogen 3.189 N/A THR 180.A OG1 SER 256.A OG no hydrogen 2.778 N/A TRP 181.A N ALA 206.A O no hydrogen 3.291 N/A VAL 182.A N ASP 261.A OD2 no hydrogen 3.220 N/A ASP 183.A N VAL 204.A O no hydrogen 3.346 N/A ASP 184.A N VAL 204.A O no hydrogen 3.401 N/A THR 186.A N TRP 202.A O no hydrogen 2.855 N/A VAL 188.A N VAL 200.A O no hydrogen 3.204 N/A HIS 190.A N ALA 198.A O no hydrogen 2.839 N/A ALA 198.A N HIS 197.A ND1 no hydrogen 2.215 N/A SER 199.A N GLN 233.A O no hydrogen 2.829 N/A ASP 201.A N THR 231.A O no hydrogen 2.848 N/A TRP 202.A N THR 186.A O no hydrogen 3.042 N/A VAL 204.A N ASP 184.A O no hydrogen 2.939 N/A ALA 206.A N TRP 181.A O no hydrogen 2.642 N/A ASP 209.A N LYS 255.A O no hydrogen 3.055 N/A SER 211.A N THR 253.A O no hydrogen 3.038 N/A SER 211.A OG GLY 225.A O no hydrogen 3.444 N/A VAL 212.A N GLY 225.A O no hydrogen 2.993 N/A GLU 213.A N CYS 251.A O no hydrogen 3.155 N/A LEU 214.A N ALA 223.A O no hydrogen 2.795 N/A ARG 215.A N GLU 249.A O no hydrogen 2.779 N/A ASP 216.A N GLN 220.A O no hydrogen 2.812 N/A ALA 217.A N TYR 246.A OH no hydrogen 3.310 N/A GLN 219.A N ASP 216.A O no hydrogen 2.882 N/A VAL 222.A N LEU 214.A O no hydrogen 2.769 N/A GLY 225.A N VAL 212.A O no hydrogen 2.810 N/A GLY 227.A N VAL 210.A O no hydrogen 3.312 N/A THR 231.A OG1 ASP 201.A OD1 no hydrogen 2.216 N/A THR 231.A OG1 ASP 201.A OD2 no hydrogen 2.004 N/A GLN 233.A N SER 199.A O no hydrogen 3.298 N/A HIS 238.A N TYR 248.A OH no hydrogen 2.751 N/A TRP 240.A N ILE 269.A O no hydrogen 2.800 N/A TRP 240.A NE1 ASP 337.A O no hydrogen 2.682 N/A GLN 241.A NE2 ASN 282.A OD1 no hydrogen 2.923 N/A GLU 244.A N GLN 241.A O no hydrogen 2.763 N/A GLY 245.A N GLN 241.A O no hydrogen 2.690 N/A TYR 246.A OH ASP 216.A OD1 no hydrogen 2.757 N/A GLU 249.A N ARG 215.A O no hydrogen 2.762 N/A LEU 250.A N LEU 265.A O no hydrogen 2.718 N/A CYS 251.A N GLU 213.A O no hydrogen 2.973 N/A VAL 252.A N TYR 263.A O no hydrogen 2.687 N/A THR 253.A N SER 211.A O no hydrogen 3.049 N/A ALA 254.A N ASP 261.A O no hydrogen 2.819 N/A LYS 255.A N ASP 209.A O no hydrogen 2.673 N/A SER 256.A N GLU 259.A O no hydrogen 2.933 N/A SER 256.A OG THR 180.A OG1 no hydrogen 2.778 N/A SER 256.A OG ASN 207.A O no hydrogen 3.395 N/A ASP 261.A N ALA 254.A O no hydrogen 2.865 N/A ILE 262.A N ASP 261.A OD1 no hydrogen 2.633 N/A TYR 263.A N VAL 252.A O no hydrogen 2.718 N/A TYR 263.A OH ARG 4.A O no hydrogen 2.901 N/A LEU 265.A N LEU 250.A O no hydrogen 2.634 N/A VAL 267.A N TYR 248.A O no hydrogen 2.985 N/A ARG 270.A NE PRO 398.A O no hydrogen 2.884 N/A ARG 270.A NH1 ARG 270.A O no hydrogen 3.094 N/A ARG 270.A NH2 PRO 398.A O no hydrogen 3.025 N/A ALA 273.A N LEU 280.A O no hydrogen 2.915 N/A LYS 275.A N GLN 278.A O no hydrogen 3.118 N/A GLN 278.A N LYS 275.A O no hydrogen 3.315 N/A LEU 280.A N ALA 273.A O no hydrogen 2.651 N/A ILE 281.A N LYS 284.A O no hydrogen 2.925 N/A ASN 282.A N SER 271.A O no hydrogen 2.862 N/A HIS 283.A NE2 VAL 191.A O no hydrogen 2.476 N/A LYS 284.A N ILE 281.A O no hydrogen 3.025 N/A PHE 286.A N PHE 279.A O no hydrogen 2.904 N/A TYR 287.A N GLY 583.A O no hydrogen 3.159 N/A TYR 287.A OH GLU 536.A OE2 no hydrogen 2.514 N/A PHE 288.A N VAL 534.A O no hydrogen 3.069 N/A THR 289.A N ASN 320.A OD1 no hydrogen 2.803 N/A THR 289.A OG1 GLY 318.A O no hydrogen 3.256 N/A PHE 291.A N SER 321.A O no hydrogen 3.278 N/A GLY 292.A N VAL 538.A O no hydrogen 3.266 N/A ARG 293.A NH2 ASP 311.A OD2 no hydrogen 2.863 N/A HIS 294.A ND1 TYR 327.A OH no hydrogen 2.698 N/A GLU 295.A N TYR 327.A OH no hydrogen 2.554 N/A ARG 300.A N ASP 298.A O no hydrogen 2.800 N/A LYS 302.A N SER 51.A OG no hydrogen 2.632 N/A LYS 302.A NZ GLU 295.A O no hydrogen 2.782 N/A LYS 302.A NZ TYR 327.A OH no hydrogen 2.763 N/A GLY 303.A N ARG 300.A O no hydrogen 2.794 N/A PHE 304.A N HIS 170.A O no hydrogen 2.817 N/A LEU 308.A N ASP 305.A OD2 no hydrogen 3.040 N/A HIS 310.A N VAL 307.A O no hydrogen 2.842 N/A ASP 311.A N LEU 308.A O no hydrogen 2.891 N/A ALA 313.A N VAL 309.A O no hydrogen 3.003 N/A LEU 314.A N HIS 310.A O no hydrogen 2.878 N/A TRP 316.A N ALA 313.A O no hydrogen 2.840 N/A ILE 317.A N LEU 314.A O no hydrogen 2.862 N/A GLY 318.A N ASP 315.A O no hydrogen 3.081 N/A ASN 320.A N THR 289.A O no hydrogen 3.275 N/A ASN 320.A N THR 289.A OG1 no hydrogen 2.980 N/A ASN 320.A ND2 TYR 287.A O no hydrogen 2.902 N/A SER 321.A OG THR 289.A O no hydrogen 2.839 N/A SER 321.A OG ASN 320.A OD1 no hydrogen 3.335 N/A TYR 322.A N VAL 342.A O no hydrogen 3.188 N/A ARG 323.A N PHE 291.A O no hydrogen 3.110 N/A ARG 323.A NH1 HIS 326.A NE2 no hydrogen 3.495 N/A ARG 323.A NH1 GLU 346.A OE2 no hydrogen 2.877 N/A ARG 323.A NH1 ASN 406.A OD1 no hydrogen 3.098 N/A ARG 323.A NH2 THR 496.A O no hydrogen 3.132 N/A ARG 323.A NH2 GLU 497.A OE2 no hydrogen 3.437 N/A THR 324.A N ILE 344.A O no hydrogen 2.896 N/A THR 324.A OG1 TYR 327.A O no hydrogen 3.282 N/A THR 324.A OG1 ASP 345.A OD1 no hydrogen 3.243 N/A SER 325.A N TYR 329.A OH no hydrogen 3.215 N/A SER 325.A OG ARG 293.A O no hydrogen 2.653 N/A SER 325.A OG ARG 323.A O no hydrogen 3.330 N/A HIS 326.A N GLU 346.A OE1 no hydrogen 2.948 N/A TYR 327.A OH HIS 294.A ND1 no hydrogen 2.698 N/A ALA 330.A N GLU 295.A OE2 no hydrogen 2.992 N/A GLU 331.A N GLU 331.A OE1 no hydrogen 3.005 N/A GLU 332.A N GLU 332.A OE2 no hydrogen 2.629 N/A ASP 334.A N GLU 331.A O no hydrogen 2.887 N/A TRP 335.A N GLU 332.A O no hydrogen 3.090 N/A ASP 337.A N LEU 333.A O no hydrogen 2.819 N/A GLU 338.A N ASP 334.A O no hydrogen 2.931 N/A HIS 339.A N TRP 335.A O no hydrogen 2.934 N/A HIS 339.A ND1 TRP 335.A O no hydrogen 3.036 N/A ILE 341.A N ALA 336.A O no hydrogen 2.959 N/A VAL 342.A N ASN 320.A O no hydrogen 3.229 N/A VAL 343.A N SER 399.A O no hydrogen 2.876 N/A ILE 344.A N TYR 322.A O no hydrogen 2.776 N/A GLU 346.A N THR 324.A OG1 no hydrogen 2.918 N/A THR 347.A N SER 403.A O no hydrogen 3.008 N/A THR 347.A OG1 ILE 404.A O no hydrogen 2.784 N/A ALA 349.A N THR 347.A OG1 no hydrogen 2.997 N/A VAL 350.A N ALA 348.A O no hydrogen 3.002 N/A ASN 353.A ND2 GLU 407.A O no hydrogen 3.235 N/A SER 355.A N ASN 353.A OD1 no hydrogen 2.737 N/A GLU 361.A N GLY 359.A O no hydrogen 3.004 N/A TYR 370.A OH ASP 409.A O no hydrogen 2.830 N/A SER 371.A OG GLU 368.A O no hydrogen 2.615 N/A ALA 374.A N SER 371.A OG no hydrogen 3.246 N/A VAL 375.A N SER 371.A O no hydrogen 3.182 N/A ASN 376.A N THR 379.A OG1 no hydrogen 3.223 N/A ASN 376.A ND2 GLU 372.A O no hydrogen 3.107 N/A THR 379.A N ASN 376.A OD1 no hydrogen 2.994 N/A THR 379.A OG1 TRP 140.A O no hydrogen 2.558 N/A THR 379.A OG1 GLN 141.A OE1 no hydrogen 3.260 N/A THR 379.A OG1 ASN 376.A OD1 no hydrogen 3.452 N/A GLN 380.A N ASN 376.A O no hydrogen 2.981 N/A GLN 380.A NE2 TYR 418.A O no hydrogen 2.972 N/A GLN 381.A N GLY 377.A O no hydrogen 3.035 N/A ALA 382.A N GLU 378.A O no hydrogen 2.890 N/A HIS 383.A N THR 379.A O no hydrogen 2.794 N/A LEU 384.A N GLN 380.A O no hydrogen 2.920 N/A GLN 385.A N GLN 381.A O no hydrogen 2.858 N/A GLN 385.A NE2 GLU 389.A OE2 no hydrogen 3.130 N/A ALA 386.A N ALA 382.A O no hydrogen 3.043 N/A ILE 387.A N HIS 383.A O no hydrogen 2.916 N/A LYS 388.A N LEU 384.A O no hydrogen 2.904 N/A GLU 389.A N GLN 385.A O no hydrogen 2.886 N/A LEU 390.A N ALA 386.A O no hydrogen 3.139 N/A ILE 391.A N ILE 387.A O no hydrogen 3.010 N/A ALA 392.A N LYS 388.A O no hydrogen 2.911 N/A ARG 393.A N GLU 389.A O no hydrogen 3.210 N/A ARG 393.A N LEU 390.A O no hydrogen 3.212 N/A ARG 393.A NE ASP 394.A OD1 no hydrogen 2.910 N/A ARG 393.A NH1 TYR 329.A O no hydrogen 2.970 N/A ARG 393.A NH2 TYR 329.A O no hydrogen 2.825 N/A ARG 393.A NH2 ASP 394.A OD1 no hydrogen 3.342 N/A ARG 393.A NH2 ASP 394.A OD2 no hydrogen 2.932 N/A ASP 394.A N LEU 390.A O no hydrogen 3.033 N/A LYS 395.A NZ ASP 184.A OD1 no hydrogen 2.767 N/A HIS 397.A N ASP 394.A O no hydrogen 3.082 N/A HIS 397.A ND1 ASP 337.A OD2 no hydrogen 2.709 N/A SER 399.A N ASP 337.A OD1 no hydrogen 2.932 N/A SER 399.A OG ASP 337.A OD1 no hydrogen 3.172 N/A VAL 400.A N HIS 397.A O no hydrogen 3.013 N/A VAL 401.A N VAL 343.A O no hydrogen 3.226 N/A TRP 402.A N PRO 434.A O no hydrogen 3.188 N/A TRP 402.A NE1 ASP 430.A OD2 no hydrogen 2.881 N/A SER 403.A N ASP 345.A O no hydrogen 2.749 N/A SER 403.A OG GLU 346.A OE2 no hydrogen 2.784 N/A SER 403.A OG ALA 405.A O no hydrogen 3.431 N/A ILE 404.A N THR 436.A O no hydrogen 2.951 N/A ASN 406.A N ALA 349.A O no hydrogen 3.309 N/A GLU 407.A N VAL 438.A O no hydrogen 2.680 N/A THR 410.A OG1 ASP 447.A OD1 no hydrogen 2.782 N/A ARG 411.A N ASP 409.A OD1 no hydrogen 3.092 N/A ARG 411.A NE ASP 409.A OD1 no hydrogen 2.971 N/A ARG 411.A NH2 SER 355.A OG no hydrogen 2.879 N/A ARG 411.A NH2 ASP 409.A OD2 no hydrogen 2.608 N/A GLN 413.A NE2 GLU 417.A OE1 no hydrogen 3.339 N/A ALA 415.A N PRO 412.A O no hydrogen 3.119 N/A ARG 416.A NH1 THR 448.A O no hydrogen 2.832 N/A ARG 416.A NH1 ASP 451.A OD1 no hydrogen 3.034 N/A ARG 416.A NH1 ASP 451.A OD2 no hydrogen 3.439 N/A ARG 416.A NH2 ASP 451.A OD2 no hydrogen 2.692 N/A TYR 418.A N GLY 414.A O no hydrogen 2.752 N/A PHE 419.A N ALA 415.A O no hydrogen 2.951 N/A ALA 420.A N ARG 416.A O no hydrogen 3.044 N/A LEU 422.A N PHE 419.A O no hydrogen 2.937 N/A ALA 423.A N PHE 419.A O no hydrogen 2.827 N/A GLU 424.A N ALA 420.A O no hydrogen 2.991 N/A ALA 425.A N PRO 421.A O no hydrogen 2.956 N/A THR 426.A N LEU 422.A O no hydrogen 2.891 N/A THR 426.A OG1 LEU 422.A O no hydrogen 2.678 N/A ARG 427.A N ALA 423.A O no hydrogen 3.232 N/A ARG 427.A NH1 ASP 454.A OD1 no hydrogen 3.088 N/A ARG 427.A NH1 ASP 454.A OD2 no hydrogen 2.926 N/A ARG 427.A NH2 LEU 452.A O no hydrogen 2.625 N/A LYS 428.A N GLU 424.A O no hydrogen 3.255 N/A LEU 429.A N ALA 425.A O no hydrogen 2.978 N/A ASP 430.A N THR 426.A O no hydrogen 3.051 N/A ARG 433.A NE VAL 400.A O no hydrogen 2.913 N/A ARG 433.A NH1 LYS 395.A O no hydrogen 3.067 N/A ARG 433.A NH1 ASP 430.A OD2 no hydrogen 2.948 N/A ARG 433.A NH2 LYS 395.A O no hydrogen 2.706 N/A ARG 433.A NH2 HIS 397.A O no hydrogen 3.077 N/A ILE 435.A N ASP 454.A OD2 no hydrogen 3.074 N/A THR 436.A N TRP 402.A O no hydrogen 2.854 N/A THR 436.A OG1 VAL 455.A O no hydrogen 2.710 N/A CYS 437.A SG ALA 405.A O no hydrogen 3.990 N/A VAL 438.A N ALA 405.A O no hydrogen 2.831 N/A ASN 439.A N CYS 457.A O no hydrogen 2.807 N/A ASN 439.A ND2 CYS 442.A O no hydrogen 3.483 N/A CYS 442.A N VAL 440.A O no hydrogen 2.896 N/A CYS 442.A SG ASP 409.A OD1 no hydrogen 3.701 N/A CYS 442.A SG THR 410.A OG1 no hydrogen 3.153 N/A ASP 443.A N THR 446.A OG1 no hydrogen 3.309 N/A ALA 444.A N GLU 481.A OE2 no hydrogen 3.462 N/A HIS 445.A N ASP 443.A OD1 no hydrogen 3.415 N/A THR 446.A N ASP 443.A O no hydrogen 3.078 N/A THR 446.A OG1 PHE 441.A O no hydrogen 3.497 N/A THR 446.A OG1 ASP 443.A OD2 no hydrogen 3.464 N/A ASP 447.A N ASP 443.A O no hydrogen 2.982 N/A THR 448.A OG1 THR 410.A O no hydrogen 2.560 N/A ILE 449.A N ASP 447.A OD2 no hydrogen 3.348 N/A SER 450.A N ASP 447.A OD2 no hydrogen 3.052 N/A SER 450.A OG ASP 447.A OD2 no hydrogen 2.541 N/A LEU 452.A N ILE 449.A O no hydrogen 3.093 N/A PHE 453.A N SER 450.A O no hydrogen 3.244 N/A ASP 454.A N ILE 435.A O no hydrogen 2.899 N/A VAL 455.A N ILE 435.A O no hydrogen 3.413 N/A LEU 456.A N PRO 492.A O no hydrogen 2.818 N/A CYS 457.A SG THR 436.A OG1 no hydrogen 3.466 N/A LEU 458.A N ILE 494.A O no hydrogen 2.972 N/A ASN 459.A N ASN 439.A O no hydrogen 2.997 N/A ASN 459.A ND2 ASN 406.A OD1 no hydrogen 3.107 N/A ASN 459.A ND2 GLU 407.A OE2 no hydrogen 2.741 N/A ARG 460.A N GLU 497.A O no hydrogen 2.946 N/A ARG 460.A NE GLU 481.A OE1 no hydrogen 3.346 N/A ARG 460.A NH1 ASN 439.A O no hydrogen 3.417 N/A ARG 460.A NH1 ASN 459.A O no hydrogen 3.284 N/A ARG 460.A NH2 GLU 481.A OE1 no hydrogen 2.665 N/A TYR 461.A OH GLU 497.A OE1 no hydrogen 2.593 N/A GLY 463.A N VAL 466.A O no hydrogen 2.714 N/A TRP 464.A N TYR 461.A O no hydrogen 2.837 N/A TYR 465.A N TYR 461.A O no hydrogen 3.201 N/A GLY 469.A N GLY 463.A O no hydrogen 2.598 N/A ASP 470.A N GLN 467.A O no hydrogen 3.036 N/A THR 473.A N ASP 470.A OD2 no hydrogen 3.068 N/A ALA 474.A N ASP 470.A O no hydrogen 2.903 N/A GLU 475.A N LEU 471.A O no hydrogen 2.794 N/A VAL 477.A N THR 473.A O no hydrogen 3.218 N/A LEU 478.A N ALA 474.A O no hydrogen 2.907 N/A GLU 479.A N GLU 475.A O no hydrogen 3.278 N/A LYS 480.A N LYS 476.A O no hydrogen 3.156 N/A GLU 481.A N VAL 477.A O no hydrogen 3.056 N/A LEU 482.A N LEU 478.A O no hydrogen 2.930 N/A LEU 483.A N GLU 479.A O no hydrogen 2.969 N/A ALA 484.A N LYS 480.A O no hydrogen 3.003 N/A TRP 485.A N GLU 481.A O no hydrogen 3.009 N/A TRP 485.A NE1 GLU 481.A OE1 no hydrogen 3.127 N/A GLN 486.A N LEU 482.A O no hydrogen 3.012 N/A GLN 486.A NE2 GLU 277.A OE1 no hydrogen 3.184 N/A GLN 486.A NE2 GLU 277.A OE2 no hydrogen 3.074 N/A GLN 486.A NE2 SER 531.A OG no hydrogen 3.007 N/A GLU 487.A N LEU 483.A O no hydrogen 2.934 N/A LYS 488.A N ALA 484.A O no hydrogen 2.773 N/A LYS 488.A NZ ALA 444.A O no hydrogen 3.060 N/A LEU 489.A N TRP 485.A O no hydrogen 2.987 N/A HIS 490.A N GLN 486.A O no hydrogen 2.776 N/A GLN 491.A NE2 SER 450.A O no hydrogen 3.209 N/A ILE 493.A N ALA 532.A O no hydrogen 2.703 N/A ILE 494.A N LEU 456.A O no hydrogen 2.771 N/A ILE 495.A N GLY 535.A O no hydrogen 3.039 N/A THR 496.A N LEU 458.A O no hydrogen 2.985 N/A THR 496.A OG1 ASN 459.A OD1 no hydrogen 2.735 N/A TYR 498.A OH HIS 524.A NE2 no hydrogen 2.886 N/A THR 502.A N LYS 557.A O no hydrogen 2.850 N/A THR 502.A OG1 VAL 500.A O no hydrogen 3.131 N/A LEU 503.A N TRP 512.A O no hydrogen 3.165 N/A GLY 505.A N GLU 514.A OE2 no hydrogen 2.972 N/A LEU 506.A N LEU 503.A O no hydrogen 2.996 N/A HIS 507.A ND1 GLU 515.A OE2 no hydrogen 2.956 N/A SER 508.A N GLU 515.A OE1 no hydrogen 3.032 N/A SER 508.A OG ASP 511.A OD2 no hydrogen 3.081 N/A THR 510.A OG1 THR 510.A O no hydrogen 2.573 N/A SER 513.A N ASP 511.A O no hydrogen 3.298 N/A SER 513.A OG ASP 511.A O no hydrogen 3.099 N/A SER 513.A OG GLU 515.A OE1 no hydrogen 3.481 N/A GLU 514.A N LEU 506.A O no hydrogen 2.951 N/A TYR 516.A N SER 513.A OG no hydrogen 3.338 N/A TYR 516.A OH GLY 463.A O no hydrogen 3.137 N/A GLN 517.A N SER 513.A O no hydrogen 3.195 N/A GLN 517.A NE2 GLY 559.A O no hydrogen 2.974 N/A CYS 518.A N GLU 514.A O no hydrogen 3.076 N/A CYS 518.A SG GLU 514.A O no hydrogen 3.534 N/A CYS 518.A SG SER 569.A OG no hydrogen 3.525 N/A ALA 519.A N GLU 515.A O no hydrogen 2.945 N/A TRP 520.A N TYR 516.A O no hydrogen 2.781 N/A TRP 520.A NE1 TYR 462.A O no hydrogen 2.916 N/A LEU 521.A N GLN 517.A O no hydrogen 3.181 N/A ASP 522.A N CYS 518.A O no hydrogen 3.272 N/A TYR 523.A OH TYR 462.A O no hydrogen 3.056 N/A HIS 524.A N LEU 521.A O no hydrogen 2.882 N/A HIS 524.A NE2 TYR 498.A OH no hydrogen 2.886 N/A ARG 525.A N ASP 522.A O no hydrogen 3.114 N/A ARG 525.A NH1 GLU 475.A OE2 no hydrogen 3.163 N/A PHE 527.A N TYR 523.A O no hydrogen 3.023 N/A ASP 528.A N HIS 524.A O no hydrogen 3.140 N/A ARG 529.A N VAL 526.A O no hydrogen 2.972 N/A ARG 529.A NH1 GLU 475.A OE1 no hydrogen 3.226 N/A ARG 529.A NH1 GLU 479.A OE1 no hydrogen 2.797 N/A ARG 529.A NH1 GLU 479.A OE2 no hydrogen 3.531 N/A ARG 529.A NH2 GLU 475.A OE1 no hydrogen 2.980 N/A VAL 530.A N PHE 527.A O no hydrogen 3.029 N/A VAL 533.A N VAL 530.A O no hydrogen 3.179 N/A VAL 534.A N ILE 493.A O no hydrogen 2.716 N/A GLU 536.A N PHE 288.A O no hydrogen 2.889 N/A GLN 537.A N ILE 495.A O no hydrogen 2.826 N/A GLN 537.A NE2 SER 321.A OG no hydrogen 2.813 N/A VAL 538.A N GLY 290.A O no hydrogen 2.730 N/A TRP 539.A N TYR 498.A O no hydrogen 2.716 N/A ASN 540.A N LYS 558.A O no hydrogen 3.225 N/A ASN 540.A ND2 ALA 542.A O no hydrogen 2.974 N/A PHE 541.A N GLY 292.A O no hydrogen 3.444 N/A ASP 543.A N PHE 561.A O no hydrogen 3.079 N/A PHE 544.A N ASN 556.A O no hydrogen 3.165 N/A ALA 545.A N ASP 296.A OD1 no hydrogen 3.184 N/A THR 546.A OG1 SER 547.A O no hydrogen 2.951 N/A SER 547.A N ASP 162.A O no hydrogen 3.454 N/A ARG 552.A N GLY 549.A O no hydrogen 3.432 N/A ARG 552.A NH1 ASP 162.A OD1 no hydrogen 2.796 N/A ARG 552.A NH2 TYR 465.A OH no hydrogen 2.840 N/A ASN 556.A N PHE 544.A O no hydrogen 2.939 N/A LYS 557.A N ASP 501.A OD2 no hydrogen 3.096 N/A LYS 557.A NZ VAL 553.A O no hydrogen 2.881 N/A LYS 558.A NZ TYR 465.A OH no hydrogen 2.924 N/A LYS 558.A NZ ASP 501.A OD1 no hydrogen 2.749 N/A LYS 558.A NZ ASN 556.A OD1 no hydrogen 3.542 N/A ILE 560.A N ASN 540.A O no hydrogen 2.695 N/A ILE 560.A N PHE 541.A O no hydrogen 3.188 N/A PHE 561.A N PHE 541.A O no hydrogen 2.948 N/A THR 562.A N LYS 566.A O no hydrogen 2.934 N/A THR 562.A OG1 ASP 564.A OD1 no hydrogen 2.421 N/A THR 562.A OG1 LYS 566.A O no hydrogen 3.325 N/A ARG 563.A NE ASP 296.A OD1 no hydrogen 3.138 N/A ARG 563.A NE ASP 296.A OD2 no hydrogen 2.780 N/A ARG 563.A NH1 ASP 298.A OD1 no hydrogen 3.055 N/A ARG 563.A NH2 TYR 166.A OH no hydrogen 2.946 N/A ARG 563.A NH2 ASP 296.A OD1 no hydrogen 2.518 N/A ARG 565.A N THR 562.A O no hydrogen 2.820 N/A ARG 565.A NE ARG 563.A O no hydrogen 3.173 N/A ARG 565.A NH1 ASP 311.A OD1 no hydrogen 3.073 N/A ARG 565.A NH2 ASP 296.A O no hydrogen 3.276 N/A ARG 565.A NH2 ARG 563.A O no hydrogen 3.220 N/A LYS 566.A N THR 562.A OG1 no hydrogen 2.745 N/A LYS 566.A NZ ASP 564.A OD2 no hydrogen 3.142 N/A LYS 568.A N ILE 560.A O no hydrogen 2.962 N/A LYS 568.A NZ THR 502.A O no hydrogen 2.606 N/A LYS 568.A NZ ASP 543.A OD1 no hydrogen 2.904 N/A LYS 568.A NZ ASP 543.A OD2 no hydrogen 3.412 N/A LYS 568.A NZ GLY 559.A O no hydrogen 3.073 N/A SER 569.A N GLU 514.A OE1 no hydrogen 2.738 N/A SER 569.A OG GLU 514.A OE1 no hydrogen 2.921 N/A ALA 571.A N LYS 568.A O no hydrogen 2.851 N/A PHE 572.A N SER 569.A O no hydrogen 3.177 N/A LEU 574.A N ALA 570.A O no hydrogen 3.021 N/A GLN 575.A N ALA 571.A O no hydrogen 2.901 N/A GLN 575.A NE2 TRP 316.A O no hydrogen 2.617 N/A LYS 576.A N PHE 572.A O no hydrogen 3.075 N/A ARG 577.A N LEU 573.A O no hydrogen 3.098 N/A ARG 577.A NH1 ASP 528.A OD1 no hydrogen 3.560 N/A ARG 577.A NH1 GLU 536.A OE1 no hydrogen 3.170 N/A ARG 577.A NH2 ASP 528.A OD1 no hydrogen 3.337 N/A ARG 577.A NH2 ASP 528.A OD2 no hydrogen 2.535 N/A TRP 578.A N LEU 574.A O no hydrogen 2.730 N/A TRP 578.A NE1 GLU 536.A OE1 no hydrogen 2.753 N/A THR 579.A N GLN 575.A O no hydrogen 2.980 N/A THR 579.A OG1 GLN 575.A O no hydrogen 2.675 N/A THR 579.A OG1 GLN 575.A OE1 no hydrogen 3.476 N/A GLY 580.A N LYS 576.A O no hydrogen 3.104 N/A LYS 585.A NZ PHE 527.A O no hydrogen 3.148 N/A LYS 585.A NZ VAL 530.A O no hydrogen 2.981 N/A LYS 585.A NZ VAL 533.A O no hydrogen 2.743 N/A