Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g11_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N SER 2.A O no hydrogen 3.165 N/A GLN 6.A N SER 2.A O no hydrogen 3.382 N/A GLN 6.A N GLU 3.A O no hydrogen 3.240 N/A ALA 7.A N GLU 3.A O no hydrogen 3.378 N/A PHE 8.A N GLU 4.A O no hydrogen 3.098 N/A GLN 9.A N SER 5.A O no hydrogen 3.118 N/A GLN 9.A NE2 GLU 480.A OE2 no hydrogen 3.554 N/A ARG 10.A N GLN 6.A O no hydrogen 2.880 N/A GLN 11.A N ALA 7.A O no hydrogen 2.837 N/A LEU 12.A N PHE 8.A O no hydrogen 3.004 N/A THR 13.A N GLN 9.A O no hydrogen 3.033 N/A THR 13.A OG1 GLN 9.A O no hydrogen 2.730 N/A LEU 15.A N GLN 11.A O no hydrogen 3.336 N/A ILE 16.A N LEU 12.A O no hydrogen 2.823 N/A GLY 17.A N THR 13.A O no hydrogen 2.932 N/A THR 21.A OG1 ASP 19.A OD1 no hydrogen 2.670 N/A THR 21.A OG1 ASP 19.A OD2 no hydrogen 3.377 N/A ASP 22.A N ASP 19.A O no hydrogen 3.404 N/A SER 24.A N ASP 22.A OD1 no hydrogen 3.215 N/A SER 24.A OG ASP 22.A OD1 no hydrogen 2.675 N/A SER 24.A OG ASP 22.A OD2 no hydrogen 3.395 N/A ASN 25.A ND2 THR 285.A O no hydrogen 2.640 N/A ASN 25.A ND2 GLN 473.A OE1 no hydrogen 3.154 N/A PHE 33.A N ASP 29.A O no hydrogen 3.021 N/A THR 34.A N GLU 30.A O no hydrogen 3.171 N/A THR 34.A OG1 GLU 30.A O no hydrogen 2.698 N/A ARG 35.A N LEU 31.A O no hydrogen 2.743 N/A ARG 36.A N GLU 32.A O no hydrogen 3.078 N/A GLY 37.A N PHE 33.A O no hydrogen 2.765 N/A VAL 39.A N ARG 36.A O no hydrogen 3.334 N/A ARG 42.A N LEU 38.A O no hydrogen 3.106 N/A ARG 42.A NH2 GLU 166.A OE2 no hydrogen 2.720 N/A MET 43.A N VAL 39.A O no hydrogen 3.157 N/A ALA 44.A N THR 40.A O no hydrogen 2.801 N/A GLU 45.A N ARG 42.A O no hydrogen 2.950 N/A VAL 46.A N ARG 42.A O no hydrogen 2.863 N/A ALA 47.A N MET 43.A O no hydrogen 3.092 N/A SER 48.A N GLU 45.A O no hydrogen 3.288 N/A ARG 49.A N GLU 45.A O no hydrogen 3.101 N/A ARG 49.A NH1 LEU 448.A O no hydrogen 3.125 N/A ARG 49.A NH1 GLY 485.A O no hydrogen 2.922 N/A ARG 49.A NH2 GLY 485.A O no hydrogen 3.139 N/A LYS 52.A N ASP 50.A OD1 no hydrogen 2.952 N/A LEU 53.A N ASP 50.A OD1 no hydrogen 3.082 N/A TYR 54.A N ASP 50.A O no hydrogen 2.981 N/A TYR 54.A OH CYS 486.A O no hydrogen 2.966 N/A ALA 55.A N PRO 51.A O no hydrogen 3.376 N/A MET 56.A N LYS 52.A O no hydrogen 3.282 N/A HIS 57.A N LEU 53.A O no hydrogen 3.054 N/A TRP 59.A N GLU 124.A OE1 no hydrogen 3.435 N/A THR 61.A N ASN 134.A O no hydrogen 2.849 N/A THR 61.A OG1 ASP 416.A OD2 no hydrogen 3.048 N/A SER 62.A N GLU 414.A OE1 no hydrogen 3.192 N/A SER 62.A OG GLU 414.A OE2 no hydrogen 2.969 N/A LYS 63.A NZ GLU 414.A OE1 no hydrogen 2.870 N/A LYS 63.A NZ ASP 416.A OD2 no hydrogen 3.256 N/A LYS 63.A NZ ASP 417.A OD1 no hydrogen 3.045 N/A LEU 69.A N PRO 66.A O no hydrogen 3.319 N/A LYS 71.A NZ TYR 68.A O no hydrogen 2.812 N/A LYS 72.A NZ CYS 141.A O no hydrogen 3.404 N/A LYS 72.A NZ GLU 146.A O no hydrogen 3.387 N/A CYS 77.A N ASN 75.A OD1 no hydrogen 3.374 N/A CYS 77.A SG ASN 75.A O no hydrogen 3.372 N/A ILE 78.A N VAL 93.A O no hydrogen 2.630 N/A ILE 80.A N ILE 91.A O no hydrogen 3.475 N/A VAL 81.A N ILE 148.A O no hydrogen 3.121 N/A ILE 82.A N GLN 89.A O no hydrogen 3.320 N/A HIS 83.A N VAL 150.A O no hydrogen 2.553 N/A THR 87.A N ARG 84.A O no hydrogen 3.413 N/A ILE 91.A N ILE 80.A O no hydrogen 3.231 N/A VAL 93.A N ILE 78.A O no hydrogen 2.748 N/A ASP 96.A N SER 94.A O no hydrogen 2.596 N/A ILE 102.A N THR 98.A O no hydrogen 2.811 N/A SER 105.A OG ILE 102.A O no hydrogen 2.970 N/A PHE 106.A N LEU 103.A O no hydrogen 2.987 N/A PHE 107.A N LEU 103.A O no hydrogen 2.971 N/A THR 108.A OG1 GLN 104.A O no hydrogen 3.225 N/A MET 110.A N PHE 106.A O no hydrogen 2.831 N/A VAL 116.A N ASP 153.A O no hydrogen 2.703 N/A ARG 118.A N VAL 151.A O no hydrogen 3.244 N/A ARG 118.A NE VAL 119.A O no hydrogen 3.017 N/A ARG 118.A NE ARG 122.A O no hydrogen 2.898 N/A ARG 118.A NH2 ARG 122.A O no hydrogen 3.336 N/A ARG 118.A NH2 ASP 581.A OD1 no hydrogen 2.639 N/A VAL 119.A N GLU 124.A O no hydrogen 2.863 N/A CYS 120.A N HIS 149.A O no hydrogen 3.302 N/A CYS 120.A SG HIS 83.A ND1 no hydrogen 3.842 N/A CYS 120.A SG HIS 149.A O no hydrogen 3.283 N/A GLY 121.A N THR 583.A OG1 no hydrogen 3.106 N/A ARG 122.A N VAL 119.A O no hydrogen 3.307 N/A ARG 122.A NH1 ASP 550.A OD1 no hydrogen 2.975 N/A ARG 122.A NH1 ASP 550.A OD2 no hydrogen 3.072 N/A ARG 122.A NH2 ASP 550.A OD2 no hydrogen 2.749 N/A ASP 123.A N GLY 552.A O no hydrogen 2.909 N/A LEU 126.A N LEU 117.A O no hydrogen 2.827 N/A THR 130.A N GLY 128.A O no hydrogen 2.841 N/A ILE 132.A N ASP 97.A O no hydrogen 2.892 N/A ASN 134.A N PRO 131.A O no hydrogen 2.906 N/A ARG 139.A N PHE 135.A O no hydrogen 3.135 N/A ARG 139.A NE LYS 133.A O no hydrogen 2.628 N/A ARG 139.A NH1 LYS 63.A O no hydrogen 3.278 N/A ARG 139.A NH2 LYS 63.A O no hydrogen 2.820 N/A ARG 139.A NH2 LYS 133.A O no hydrogen 3.202 N/A HIS 140.A N GLN 136.A O no hydrogen 2.914 N/A CYS 141.A N TRP 137.A O no hydrogen 3.118 N/A CYS 141.A SG TRP 137.A O no hydrogen 3.198 N/A LEU 142.A N VAL 138.A O no hydrogen 3.158 N/A LYS 143.A N ARG 139.A O no hydrogen 3.105 N/A ASN 144.A N HIS 140.A O no hydrogen 3.334 N/A GLY 145.A N CYS 141.A O no hydrogen 2.980 N/A GLU 146.A N CYS 141.A O no hydrogen 2.736 N/A HIS 149.A ND1 GLU 147.A O no hydrogen 2.838 N/A VAL 150.A N VAL 81.A O no hydrogen 2.904 N/A VAL 151.A N ARG 118.A O no hydrogen 2.682 N/A LEU 152.A N HIS 83.A O no hydrogen 3.132 N/A ASP 153.A N VAL 116.A O no hydrogen 3.467 N/A LEU 160.A N ASP 157.A O no hydrogen 3.217 N/A LYS 170.A NZ GLU 225.A OE1 no hydrogen 3.544 N/A PHE 171.A N ILE 228.A O no hydrogen 2.988 N/A ARG 172.A N ASN 301.A OD1 no hydrogen 3.150 N/A VAL 173.A N LEU 224.A O no hydrogen 3.140 N/A LYS 174.A N LEU 298.A O no hydrogen 3.055 N/A ILE 175.A N VAL 222.A O no hydrogen 2.984 N/A ARG 176.A N SER 296.A O no hydrogen 2.923 N/A ARG 176.A NE ASN 221.A OD1 no hydrogen 3.530 N/A ARG 176.A NH1 GLU 265.A OE1 no hydrogen 2.808 N/A GLY 177.A N SER 296.A O no hydrogen 3.430 N/A ILE 178.A N VAL 218.A O no hydrogen 2.859 N/A ASP 179.A N SER 294.A O no hydrogen 3.029 N/A ILE 180.A N GLU 216.A O no hydrogen 3.066 N/A ARG 185.A NH2 ASN 186.A O no hydrogen 3.217 N/A THR 190.A OG1 LYS 212.A O no hydrogen 3.067 N/A VAL 191.A N LYS 212.A O no hydrogen 2.634 N/A PHE 192.A N TYR 244.A O no hydrogen 3.323 N/A VAL 193.A N THR 209.A OG1 no hydrogen 2.832 N/A GLU 194.A N GLN 242.A O no hydrogen 2.662 N/A ALA 195.A N ARG 207.A O no hydrogen 3.244 N/A ASN 196.A N ASN 240.A O no hydrogen 2.823 N/A ASN 196.A ND2 GLU 194.A OE2 no hydrogen 2.869 N/A ASN 196.A ND2 ASN 240.A OD1 no hydrogen 3.465 N/A ILE 197.A N CYS 205.A O no hydrogen 3.313 N/A GLN 198.A N LEU 238.A O no hydrogen 2.815 N/A HIS 199.A N GLN 202.A O no hydrogen 3.361 N/A LEU 204.A N ILE 197.A O no hydrogen 2.866 N/A CYS 205.A SG SER 227.A OG no hydrogen 2.787 N/A ARG 207.A N ALA 195.A O no hydrogen 3.238 N/A ARG 208.A NH2 GLU 194.A OE1 no hydrogen 2.857 N/A THR 209.A N VAL 193.A O no hydrogen 3.324 N/A THR 209.A OG1 VAL 193.A O no hydrogen 3.019 N/A LYS 212.A N VAL 191.A O no hydrogen 3.164 N/A LYS 212.A NZ LEU 219.A O no hydrogen 2.876 N/A THR 215.A OG1 GLU 217.A O no hydrogen 2.899 N/A VAL 218.A N ILE 178.A O no hydrogen 3.341 N/A TRP 220.A N ARG 176.A O no hydrogen 3.017 N/A TRP 220.A NE1 SER 210.A O no hydrogen 2.942 N/A ASN 221.A N ARG 176.A O no hydrogen 2.956 N/A VAL 222.A N ILE 175.A O no hydrogen 3.340 N/A LEU 224.A N VAL 173.A O no hydrogen 2.725 N/A PHE 226.A N PHE 171.A O no hydrogen 2.616 N/A ILE 230.A N ARG 169.A O no hydrogen 3.319 N/A ASP 232.A N LYS 229.A O no hydrogen 3.188 N/A LYS 235.A NZ GLU 400.A OE2 no hydrogen 2.952 N/A LEU 238.A N GLN 198.A O no hydrogen 2.829 N/A LEU 239.A N LEU 252.A O no hydrogen 2.642 N/A ASN 240.A N ASN 196.A O no hydrogen 2.751 N/A ASN 240.A ND2 ASN 251.A OD1 no hydrogen 2.785 N/A LEU 241.A N VAL 250.A O no hydrogen 2.939 N/A GLN 242.A N GLU 194.A O no hydrogen 2.857 N/A ILE 243.A N TYR 248.A O no hydrogen 2.688 N/A TYR 244.A N PHE 192.A O no hydrogen 3.013 N/A CYS 245.A SG THR 190.A O no hydrogen 3.608 N/A LEU 247.A N ILE 243.A O no hydrogen 2.721 N/A TYR 248.A N ILE 243.A O no hydrogen 3.407 N/A TYR 249.A N TRP 271.A O no hydrogen 3.086 N/A TYR 249.A OH ASP 279.A O no hydrogen 3.174 N/A VAL 250.A N LEU 241.A O no hydrogen 2.867 N/A ASN 251.A ND2 LYS 280.A O no hydrogen 2.900 N/A ASN 251.A ND2 THR 282.A O no hydrogen 3.396 N/A LEU 252.A N LEU 239.A O no hydrogen 3.320 N/A LEU 254.A N ALA 237.A O no hydrogen 2.898 N/A ASP 256.A N LEU 260.A O no hydrogen 3.105 N/A ARG 258.A N ASP 256.A OD1 no hydrogen 2.952 N/A ARG 258.A NH2 ASP 29.A OD1 no hydrogen 2.845 N/A PHE 259.A N ASP 256.A O no hydrogen 3.142 N/A ARG 262.A N LEU 254.A O no hydrogen 3.400 N/A ARG 262.A NH1 LEU 253.A O no hydrogen 2.709 N/A ARG 263.A NH1 ASP 300.A OD1 no hydrogen 3.199 N/A GLY 264.A N LEU 299.A O no hydrogen 3.046 N/A TYR 266.A N ILE 297.A O no hydrogen 3.073 N/A LEU 268.A N ILE 295.A O no hydrogen 2.901 N/A MET 270.A N MET 293.A O no hydrogen 2.764 N/A TRP 271.A N TYR 249.A O no hydrogen 2.852 N/A TRP 271.A NE1 ALA 284.A O no hydrogen 3.146 N/A ILE 273.A N LEU 247.A O no hydrogen 3.483 N/A ALA 278.A N MET 784.A O no hydrogen 2.817 N/A LYS 280.A N ASN 277.A O no hydrogen 3.193 N/A LYS 280.A NZ GLN 242.A OE1 no hydrogen 3.022 N/A LEU 281.A N ALA 278.A O no hydrogen 2.853 N/A THR 282.A OG1 HIS 470.A O no hydrogen 2.724 N/A ALA 284.A N THR 282.A OG1 no hydrogen 3.325 N/A THR 285.A OG1 ASN 25.A O no hydrogen 3.304 N/A THR 285.A OG1 ASN 25.A OD1 no hydrogen 3.112 N/A ASN 286.A N HIS 269.A O no hydrogen 3.212 N/A ASP 288.A N ASN 286.A OD1 no hydrogen 3.089 N/A LYS 289.A N PRO 287.A O no hydrogen 2.944 N/A LYS 289.A NZ ASN 25.A OD1 no hydrogen 2.955 N/A LYS 289.A NZ ASN 286.A O no hydrogen 3.047 N/A SER 292.A N ASP 288.A O no hydrogen 3.379 N/A SER 292.A OG HIS 269.A ND1 no hydrogen 3.140 N/A SER 292.A OG ASP 288.A O no hydrogen 2.676 N/A SER 294.A N ASP 179.A O no hydrogen 2.708 N/A SER 294.A OG ASP 179.A O no hydrogen 3.568 N/A ILE 295.A N LEU 268.A O no hydrogen 2.877 N/A SER 296.A N GLY 177.A O no hydrogen 2.824 N/A ILE 297.A N TYR 266.A O no hydrogen 2.889 N/A LEU 298.A N LYS 174.A O no hydrogen 2.993 N/A LEU 299.A N GLY 264.A O no hydrogen 3.321 N/A ARG 314.A N PRO 310.A O no hydrogen 3.108 N/A ARG 314.A NH1 GLU 308.A OE2 no hydrogen 2.929 N/A ARG 314.A NH2 GLU 343.A OE2 no hydrogen 3.554 N/A LYS 315.A N ASN 311.A O no hydrogen 3.182 N/A GLN 316.A N GLN 312.A O no hydrogen 3.347 N/A LEU 317.A N LEU 313.A O no hydrogen 3.203 N/A GLU 318.A N ARG 314.A O no hydrogen 2.905 N/A ILE 320.A N LEU 317.A O no hydrogen 3.018 N/A ILE 321.A N LEU 317.A O no hydrogen 3.276 N/A ALA 322.A N GLU 318.A O no hydrogen 3.211 N/A THR 323.A OG1 ILE 320.A O no hydrogen 2.549 N/A ASN 327.A N ASP 324.A O no hydrogen 3.354 N/A LYS 334.A N THR 330.A O no hydrogen 2.690 N/A LYS 334.A NZ SER 356.A O no hydrogen 2.806 N/A LEU 336.A N GLU 332.A O no hydrogen 3.439 N/A LEU 337.A N ASP 333.A O no hydrogen 3.176 N/A HIS 339.A N GLU 335.A O no hydrogen 2.740 N/A PHE 340.A N LEU 336.A O no hydrogen 3.389 N/A SER 344.A N PHE 340.A O no hydrogen 2.901 N/A SER 344.A OG LEU 337.A O no hydrogen 3.171 N/A SER 344.A OG PHE 340.A O no hydrogen 2.726 N/A LEU 345.A N ARG 341.A O no hydrogen 2.912 N/A LYS 349.A NZ ASP 385.A OD2 no hydrogen 2.828 N/A ALA 350.A N HIS 347.A O no hydrogen 3.048 N/A TYR 351.A N PRO 348.A O no hydrogen 3.440 N/A TYR 351.A OH LEU 345.A O no hydrogen 3.033 N/A LYS 353.A NZ ILE 320.A O no hydrogen 3.510 N/A LYS 353.A NZ THR 323.A O no hydrogen 3.202 N/A LYS 353.A NZ THR 323.A OG1 no hydrogen 2.924 N/A LYS 353.A NZ ASP 324.A O no hydrogen 2.847 N/A LEU 354.A N TYR 351.A O no hydrogen 3.033 N/A PHE 355.A N TYR 351.A O no hydrogen 2.915 N/A SER 356.A N PRO 352.A O no hydrogen 3.358 N/A SER 356.A OG PRO 352.A O no hydrogen 2.747 N/A SER 357.A N LEU 354.A O no hydrogen 3.095 N/A SER 357.A OG LYS 353.A O no hydrogen 2.627 N/A GLN 363.A NE2 LYS 231.A O no hydrogen 2.672 N/A VAL 366.A N GLN 362.A O no hydrogen 3.120 N/A ALA 367.A N GLN 363.A O no hydrogen 3.108 N/A LYS 368.A N GLU 364.A O no hydrogen 2.890 N/A THR 369.A N ILE 365.A O no hydrogen 3.098 N/A THR 369.A N VAL 366.A O no hydrogen 3.137 N/A THR 369.A OG1 ILE 365.A O no hydrogen 2.676 N/A TYR 370.A N VAL 366.A O no hydrogen 3.239 N/A TYR 370.A OH ASP 399.A OD2 no hydrogen 2.779 N/A GLN 371.A N ALA 367.A O no hydrogen 3.369 N/A LEU 372.A N LYS 368.A O no hydrogen 2.963 N/A LEU 373.A N THR 369.A O no hydrogen 2.855 N/A ALA 374.A N TYR 370.A O no hydrogen 3.087 N/A ARG 376.A NE LEU 373.A O no hydrogen 2.927 N/A GLU 377.A N ARG 375.A O no hydrogen 2.987 N/A TRP 379.A NE1 ILE 405.A O no hydrogen 2.957 N/A SER 382.A OG TRP 379.A O no hydrogen 2.681 N/A THR 389.A N ASP 385.A O no hydrogen 3.010 N/A THR 389.A OG1 ASP 385.A O no hydrogen 2.644 N/A MET 390.A N VAL 386.A O no hydrogen 2.851 N/A GLN 391.A N GLY 387.A O no hydrogen 3.322 N/A LEU 392.A N THR 389.A O no hydrogen 3.273 N/A LEU 393.A N MET 390.A O no hydrogen 2.883 N/A ASN 396.A N ASP 394.A OD1 no hydrogen 2.870 N/A SER 398.A OG GLY 236.A O no hydrogen 3.341 N/A VAL 402.A N ASP 399.A OD1 no hydrogen 3.313 N/A ARG 403.A N ASP 399.A O no hydrogen 3.259 N/A ARG 403.A NE GLU 432.A OE1 no hydrogen 2.717 N/A ARG 403.A NH1 LEU 393.A O no hydrogen 2.969 N/A ARG 403.A NH1 ALA 428.A O no hydrogen 3.322 N/A ARG 403.A NH1 GLU 432.A OE1 no hydrogen 2.939 N/A ARG 403.A NH2 ASP 394.A O no hydrogen 2.816 N/A ARG 403.A NH2 PHE 397.A O no hydrogen 2.935 N/A ALA 404.A N GLU 400.A O no hydrogen 3.174 N/A ILE 405.A N ASN 401.A O no hydrogen 3.147 N/A ALA 406.A N ARG 403.A O no hydrogen 3.287 N/A VAL 407.A N ARG 403.A O no hydrogen 3.279 N/A GLN 408.A N ALA 404.A O no hydrogen 3.191 N/A LYS 409.A N ALA 406.A O no hydrogen 2.796 N/A LYS 409.A NZ TRP 379.A O no hydrogen 3.479 N/A LYS 409.A NZ ASP 380.A O no hydrogen 3.264 N/A LEU 410.A N ALA 406.A O no hydrogen 3.213 N/A GLU 411.A N VAL 407.A O no hydrogen 3.095 N/A SER 412.A N LYS 409.A O no hydrogen 3.214 N/A SER 412.A OG LYS 409.A O no hydrogen 2.615 N/A LEU 413.A N LEU 410.A O no hydrogen 3.082 N/A VAL 418.A N GLU 414.A O no hydrogen 3.015 N/A LEU 419.A N ASP 415.A O no hydrogen 3.146 N/A HIS 420.A N ASP 417.A O no hydrogen 3.235 N/A HIS 420.A ND1 ASP 416.A O no hydrogen 2.825 N/A TYR 421.A N ASP 417.A O no hydrogen 3.372 N/A GLN 424.A N GLN 424.A OE1 no hydrogen 2.995 N/A LEU 425.A N TYR 421.A O no hydrogen 2.838 N/A VAL 426.A N LEU 422.A O no hydrogen 2.928 N/A GLN 427.A N LEU 423.A O no hydrogen 2.973 N/A GLN 427.A NE2 GLU 464.A OE2 no hydrogen 3.508 N/A LYS 430.A N GLN 427.A O no hydrogen 3.343 N/A LYS 430.A NZ GLN 427.A OE1 no hydrogen 2.933 N/A LYS 430.A NZ GLU 464.A OE1 no hydrogen 2.844 N/A LYS 430.A NZ THR 785.A O no hydrogen 3.315 N/A PHE 431.A N ALA 428.A O no hydrogen 3.193 N/A GLU 432.A N VAL 429.A O no hydrogen 3.066 N/A TYR 434.A OH ILE 255.A O no hydrogen 2.672 N/A ALA 440.A N SER 437.A OG no hydrogen 3.375 N/A ARG 441.A N SER 437.A O no hydrogen 2.865 N/A ARG 441.A NE ASP 436.A OD1 no hydrogen 2.859 N/A PHE 442.A N ALA 438.A O no hydrogen 2.978 N/A LEU 443.A N LEU 439.A O no hydrogen 3.231 N/A LEU 444.A N ALA 440.A O no hydrogen 3.338 N/A LYS 445.A N ARG 441.A O no hydrogen 3.149 N/A ARG 446.A N PHE 442.A O no hydrogen 3.091 N/A ARG 446.A NH1 LEU 413.A O no hydrogen 2.924 N/A ARG 446.A NH2 LEU 413.A O no hydrogen 2.723 N/A ARG 446.A NH2 ASP 415.A OD1 no hydrogen 3.401 N/A GLY 447.A N LEU 443.A O no hydrogen 3.073 N/A LEU 448.A N LEU 444.A O no hydrogen 3.164 N/A LEU 448.A N LYS 445.A O no hydrogen 3.119 N/A ARG 449.A N LYS 445.A O no hydrogen 2.969 N/A ARG 449.A N ARG 446.A O no hydrogen 3.255 N/A ASN 450.A N ARG 446.A O no hydrogen 3.147 N/A LYS 451.A NZ ASP 161.A OD2 no hydrogen 3.435 N/A ARG 452.A N ASN 450.A OD1 no hydrogen 2.890 N/A GLY 454.A N ASN 450.A O no hydrogen 2.966 N/A HIS 455.A N LYS 451.A O no hydrogen 2.971 N/A HIS 455.A NE2 PRO 548.A O no hydrogen 2.716 N/A PHE 456.A N ARG 452.A O no hydrogen 3.329 N/A LEU 457.A N ILE 453.A O no hydrogen 2.984 N/A PHE 458.A N GLY 454.A O no hydrogen 2.860 N/A TRP 459.A N HIS 455.A O no hydrogen 3.378 N/A TRP 459.A NE1 GLN 497.A OE1 no hydrogen 3.045 N/A PHE 460.A N PHE 456.A O no hydrogen 2.665 N/A LEU 461.A N LEU 457.A O no hydrogen 2.827 N/A ARG 462.A N PHE 458.A O no hydrogen 2.858 N/A ARG 462.A NE LEU 15.A O no hydrogen 2.721 N/A ARG 462.A NH2 LEU 15.A O no hydrogen 3.130 N/A SER 463.A N TRP 459.A O no hydrogen 3.156 N/A SER 463.A OG SER 633.A O no hydrogen 3.181 N/A ILE 465.A N LEU 461.A O no hydrogen 3.095 N/A ALA 466.A N ARG 462.A O no hydrogen 3.167 N/A GLN 467.A NE2 SER 463.A O no hydrogen 2.753 N/A GLN 467.A NE2 SER 633.A OG no hydrogen 3.050 N/A SER 468.A N GLU 464.A O no hydrogen 2.906 N/A ARG 469.A NE GLN 472.A OE1 no hydrogen 2.933 N/A TYR 471.A OH ALA 278.A O no hydrogen 2.702 N/A TYR 471.A OH LYS 430.A O no hydrogen 2.729 N/A GLN 472.A N SER 468.A O no hydrogen 3.080 N/A GLN 472.A NE2 SER 468.A O no hydrogen 3.631 N/A ARG 474.A NH1 GLU 432.A O no hydrogen 2.777 N/A ARG 474.A NH2 GLU 432.A O no hydrogen 3.058 N/A PHE 475.A N TYR 471.A O no hydrogen 3.038 N/A ALA 476.A N GLN 472.A O no hydrogen 3.037 N/A ILE 478.A N ARG 474.A O no hydrogen 3.277 N/A LEU 479.A N PHE 475.A O no hydrogen 2.895 N/A GLU 480.A N ALA 476.A O no hydrogen 2.941 N/A ALA 481.A N VAL 477.A O no hydrogen 3.166 N/A TYR 482.A N LEU 479.A O no hydrogen 2.889 N/A LEU 483.A N LEU 479.A O no hydrogen 2.929 N/A ARG 484.A N GLU 480.A O no hydrogen 3.182 N/A ARG 484.A NE GLU 480.A OE2 no hydrogen 3.049 N/A ARG 484.A NH2 GLN 9.A OE1 no hydrogen 2.607 N/A ARG 484.A NH2 GLU 480.A OE2 no hydrogen 3.302 N/A GLY 485.A N TYR 482.A O no hydrogen 2.815 N/A CYS 486.A SG LEU 483.A O no hydrogen 3.449 N/A CYS 486.A SG GLY 487.A O no hydrogen 3.549 N/A THR 488.A N GLU 162.A O no hydrogen 3.340 N/A THR 488.A OG1 LEU 160.A O no hydrogen 2.965 N/A THR 488.A OG1 GLU 162.A O no hydrogen 3.260 N/A LEU 491.A N GLY 487.A O no hydrogen 3.051 N/A HIS 492.A N THR 488.A O no hydrogen 2.988 N/A ASP 493.A N ALA 489.A O no hydrogen 3.300 N/A PHE 494.A N MET 490.A O no hydrogen 2.722 N/A THR 495.A N LEU 491.A O no hydrogen 3.341 N/A THR 495.A OG1 LEU 491.A O no hydrogen 2.659 N/A GLN 496.A N HIS 492.A O no hydrogen 3.082 N/A GLN 497.A N ASP 493.A O no hydrogen 2.910 N/A GLN 497.A NE2 ASP 493.A O no hydrogen 3.212 N/A VAL 498.A N PHE 494.A O no hydrogen 2.764 N/A GLN 499.A N THR 495.A O no hydrogen 3.187 N/A VAL 500.A N GLN 496.A O no hydrogen 3.347 N/A ILE 501.A N GLN 497.A O no hydrogen 3.091 N/A GLU 502.A N VAL 498.A O no hydrogen 3.045 N/A MET 503.A N GLN 499.A O no hydrogen 3.140 N/A LEU 504.A N VAL 500.A O no hydrogen 3.113 N/A GLN 505.A N ILE 501.A O no hydrogen 3.246 N/A LYS 506.A N GLU 502.A O no hydrogen 3.230 N/A VAL 507.A N MET 503.A O no hydrogen 3.305 N/A THR 508.A N LEU 504.A O no hydrogen 2.803 N/A THR 508.A OG1 LEU 504.A O no hydrogen 2.666 N/A LEU 509.A N GLN 505.A O no hydrogen 3.076 N/A ASP 510.A N LYS 506.A O no hydrogen 3.050 N/A ILE 511.A N VAL 507.A O no hydrogen 2.946 N/A LYS 512.A N THR 508.A O no hydrogen 3.071 N/A SER 513.A N LEU 509.A O no hydrogen 3.361 N/A SER 513.A OG LEU 509.A O no hydrogen 2.815 N/A LEU 514.A N ASP 510.A O no hydrogen 3.214 N/A VAL 521.A N ASP 520.A OD1 no hydrogen 2.602 N/A ILE 526.A N SER 522.A O no hydrogen 3.239 N/A SER 527.A N SER 523.A O no hydrogen 2.779 N/A GLN 528.A N GLN 524.A O no hydrogen 2.879 N/A LEU 529.A N VAL 525.A O no hydrogen 3.002 N/A LYS 530.A N ILE 526.A O no hydrogen 3.025 N/A GLN 531.A N SER 527.A O no hydrogen 2.907 N/A LYS 532.A N GLN 528.A O no hydrogen 3.225 N/A LEU 533.A N LEU 529.A O no hydrogen 3.363 N/A GLU 534.A N LYS 530.A O no hydrogen 3.358 N/A LEU 536.A N LYS 532.A O no hydrogen 3.404 N/A GLN 537.A N LEU 533.A O no hydrogen 3.065 N/A LEU 541.A N LEU 536.A O no hydrogen 2.705 N/A PHE 545.A N ALA 555.A O no hydrogen 2.798 N/A ARG 546.A NE ASP 493.A OD2 no hydrogen 2.798 N/A ARG 546.A NH1 PRO 551.A O no hydrogen 2.978 N/A VAL 547.A N LEU 553.A O no hydrogen 3.232 N/A ASP 550.A N VAL 547.A O no hydrogen 3.001 N/A LEU 553.A N ASP 550.A O no hydrogen 3.078 N/A GLY 556.A N LYS 578.A O no hydrogen 2.784 N/A ALA 559.A N GLU 576.A O no hydrogen 2.757 N/A LYS 562.A N ALA 559.A O no hydrogen 2.992 N/A CYS 563.A N ILE 560.A O no hydrogen 3.118 N/A CYS 563.A SG ALA 559.A O no hydrogen 3.374 N/A LYS 564.A N TRP 574.A O no hydrogen 3.374 N/A LYS 570.A NZ ASP 598.A OD1 no hydrogen 3.122 N/A LYS 571.A NZ SER 568.A O no hydrogen 3.448 N/A LEU 573.A N PHE 594.A O no hydrogen 3.001 N/A TRP 574.A N LYS 564.A O no hydrogen 2.925 N/A TRP 574.A NE1 GLU 576.A OE2 no hydrogen 2.775 N/A LEU 575.A N ILE 592.A O no hydrogen 2.903 N/A PHE 577.A N ILE 590.A O no hydrogen 2.742 N/A LYS 578.A N ALA 557.A O no hydrogen 2.622 N/A LYS 578.A NZ LEU 558.A O no hydrogen 3.050 N/A CYS 579.A SG GLY 121.A O no hydrogen 3.905 N/A CYS 579.A SG ASP 581.A O no hydrogen 3.858 N/A ALA 580.A N LYS 554.A O no hydrogen 3.235 N/A THR 583.A OG1 ASP 581.A OD1 no hydrogen 3.025 N/A THR 589.A OG1 GLU 576.A OE1 no hydrogen 2.659 N/A ILE 590.A N PHE 577.A O no hydrogen 2.799 N/A ILE 592.A N LEU 575.A O no hydrogen 2.713 N/A ILE 593.A N ILE 641.A O no hydrogen 2.694 N/A PHE 594.A N LEU 573.A O no hydrogen 3.283 N/A LYS 595.A NZ ASP 598.A OD2 no hydrogen 3.363 N/A LYS 595.A NZ ASP 725.A OD2 no hydrogen 2.949 N/A GLY 597.A N LYS 637.A O no hydrogen 2.817 N/A ARG 601.A NE ASP 599.A OD1 no hydrogen 3.373 N/A ARG 601.A NH1 GLU 464.A OE1 no hydrogen 3.425 N/A GLN 602.A N ASP 599.A O no hydrogen 3.265 N/A GLN 602.A NE2 ASP 599.A OD2 no hydrogen 3.197 N/A MET 604.A N LEU 600.A O no hydrogen 2.713 N/A LEU 605.A N ARG 601.A O no hydrogen 3.057 N/A ILE 606.A N GLN 602.A O no hydrogen 3.252 N/A LEU 607.A N ASP 603.A O no hydrogen 3.264 N/A GLN 608.A N MET 604.A O no hydrogen 3.276 N/A ILE 609.A N LEU 605.A O no hydrogen 3.092 N/A LEU 610.A N ILE 606.A O no hydrogen 3.051 N/A ARG 611.A N LEU 607.A O no hydrogen 2.986 N/A ARG 611.A NH2 PRO 628.A O no hydrogen 3.524 N/A ILE 612.A N GLN 608.A O no hydrogen 2.917 N/A MET 613.A N ILE 609.A O no hydrogen 2.587 N/A GLU 614.A N LEU 610.A O no hydrogen 3.110 N/A SER 615.A OG ILE 612.A O no hydrogen 2.637 N/A ILE 616.A N ILE 612.A O no hydrogen 3.174 N/A TRP 617.A N MET 613.A O no hydrogen 3.427 N/A TRP 617.A NE1 ALA 764.A O no hydrogen 2.803 N/A GLU 618.A N GLU 614.A O no hydrogen 2.760 N/A THR 619.A N SER 615.A O no hydrogen 3.150 N/A THR 619.A OG1 SER 615.A O no hydrogen 3.441 N/A THR 619.A OG1 ILE 616.A O no hydrogen 2.724 N/A SER 621.A N GLU 618.A O no hydrogen 3.032 N/A LEU 622.A N TRP 617.A O no hydrogen 2.756 N/A CYS 625.A N ASP 623.A OD1 no hydrogen 2.784 N/A CYS 625.A SG ASP 623.A OD1 no hydrogen 3.709 N/A LEU 627.A N TYR 696.A OH no hydrogen 2.965 N/A GLY 630.A N GLU 642.A OE2 no hydrogen 2.696 N/A CYS 631.A SG MET 640.A O no hydrogen 3.719 N/A ILE 632.A N MET 640.A O no hydrogen 3.167 N/A THR 634.A N ILE 638.A O no hydrogen 3.421 N/A THR 634.A OG1 ILE 638.A O no hydrogen 3.408 N/A GLY 635.A N ILE 638.A O no hydrogen 2.903 N/A GLY 639.A N LYS 595.A O no hydrogen 3.371 N/A MET 640.A N ILE 632.A O no hydrogen 3.123 N/A ILE 641.A N ILE 593.A O no hydrogen 2.772 N/A GLU 642.A N GLY 630.A O no hydrogen 2.709 N/A ILE 643.A N GLY 591.A O no hydrogen 3.079 N/A LYS 645.A NZ THR 589.A O no hydrogen 3.024 N/A THR 648.A N ILE 715.A O no hydrogen 2.699 N/A ILE 650.A N ILE 713.A O no hydrogen 3.277 N/A ILE 653.A N THR 649.A O no hydrogen 3.025 N/A GLN 654.A N ILE 650.A O no hydrogen 3.275 N/A GLN 654.A NE2 LYS 664.A O no hydrogen 3.313 N/A GLN 655.A N ALA 651.A O no hydrogen 2.970 N/A THR 657.A OG1 ILE 653.A O no hydrogen 3.195 N/A VAL 658.A N GLN 654.A O no hydrogen 2.903 N/A THR 661.A N ASN 660.A OD1 no hydrogen 2.737 N/A THR 661.A OG1 ASN 660.A OD1 no hydrogen 3.296 N/A LYS 664.A N GLN 654.A OE1 no hydrogen 3.360 N/A ASN 669.A N GLU 666.A O no hydrogen 3.272 N/A TRP 671.A N VAL 667.A O no hydrogen 3.232 N/A LYS 673.A N ASN 669.A O no hydrogen 3.444 N/A LYS 673.A NZ THR 678.A O no hydrogen 3.363 N/A GLU 674.A N HIS 670.A O no hydrogen 3.269 N/A SER 676.A N LEU 672.A O no hydrogen 3.082 N/A SER 676.A N LYS 673.A O no hydrogen 3.081 N/A SER 676.A OG LEU 672.A O no hydrogen 2.643 N/A GLN 683.A N GLU 679.A O no hydrogen 3.095 N/A ALA 684.A N GLU 680.A O no hydrogen 2.839 N/A ALA 685.A N LYS 681.A O no hydrogen 2.867 N/A VAL 686.A N PHE 682.A O no hydrogen 2.788 N/A GLU 687.A N GLN 683.A O no hydrogen 3.073 N/A ARG 688.A N ALA 684.A O no hydrogen 2.954 N/A PHE 689.A N ALA 685.A O no hydrogen 3.042 N/A VAL 690.A N VAL 686.A O no hydrogen 3.347 N/A TYR 691.A N GLU 687.A O no hydrogen 3.306 N/A SER 692.A N ARG 688.A O no hydrogen 2.959 N/A SER 692.A OG ARG 688.A O no hydrogen 2.994 N/A SER 692.A OG PHE 689.A O no hydrogen 3.023 N/A SER 692.A OG GLY 719.A O no hydrogen 3.488 N/A CYS 693.A N PHE 689.A O no hydrogen 2.732 N/A ALA 694.A N TYR 691.A O no hydrogen 3.047 N/A GLY 695.A N TYR 691.A O no hydrogen 2.733 N/A TYR 696.A N SER 692.A O no hydrogen 3.214 N/A CYS 697.A SG CYS 693.A O no hydrogen 2.931 N/A CYS 697.A SG VAL 734.A O no hydrogen 3.642 N/A VAL 698.A N ALA 694.A O no hydrogen 3.349 N/A ALA 699.A N GLY 695.A O no hydrogen 3.005 N/A THR 700.A N TYR 696.A O no hydrogen 2.788 N/A THR 700.A OG1 ILE 705.A O no hydrogen 2.457 N/A PHE 701.A N VAL 698.A O no hydrogen 3.260 N/A VAL 702.A N VAL 698.A O no hydrogen 3.242 N/A LEU 703.A N ALA 699.A O no hydrogen 3.318 N/A ILE 705.A N THR 700.A O no hydrogen 3.059 N/A ARG 708.A NH2 ASP 725.A O no hydrogen 2.623 N/A HIS 709.A N ASN 712.A OD1 no hydrogen 3.356 N/A ASN 712.A N HIS 709.A O no hydrogen 2.873 N/A MET 714.A N PHE 722.A O no hydrogen 2.727 N/A ILE 715.A N THR 648.A O no hydrogen 2.738 N/A THR 716.A N ASN 720.A O no hydrogen 2.779 N/A THR 716.A OG1 ASN 720.A O no hydrogen 3.348 N/A GLU 717.A N ASP 646.A O no hydrogen 2.877 N/A THR 718.A N THR 716.A OG1 no hydrogen 3.277 N/A THR 718.A OG1 THR 718.A O no hydrogen 2.560 N/A GLY 719.A N THR 716.A O no hydrogen 3.226 N/A ASN 720.A N THR 716.A OG1 no hydrogen 2.894 N/A LEU 721.A N SER 692.A OG no hydrogen 3.028 N/A PHE 722.A N MET 714.A O no hydrogen 2.745 N/A ILE 724.A N ASN 712.A O no hydrogen 2.726 N/A ASP 725.A N TYR 629.A OH no hydrogen 3.306 N/A PHE 726.A N ASP 603.A OD2 no hydrogen 2.679 N/A THR 736.A OG1 ASP 738.A OD1 no hydrogen 2.445 N/A PHE 739.A N THR 736.A O no hydrogen 2.821 N/A PHE 741.A N PRO 737.A O no hydrogen 2.893 N/A MET 743.A N LEU 740.A O no hydrogen 2.873 N/A GLY 744.A N LEU 740.A O no hydrogen 3.114 N/A THR 745.A OG1 SER 751.A OG no hydrogen 2.665 N/A LYS 748.A NZ GLU 821.A OE2 no hydrogen 3.296 N/A LYS 748.A NZ ASP 825.A OD1 no hydrogen 3.546 N/A LYS 749.A NZ THR 750.A O no hydrogen 3.541 N/A SER 751.A OG MET 743.A O no hydrogen 2.971 N/A SER 751.A OG THR 745.A OG1 no hydrogen 2.665 N/A PHE 754.A N SER 751.A OG no hydrogen 3.322 N/A GLN 755.A N SER 751.A O no hydrogen 2.982 N/A PHE 757.A N HIS 753.A O no hydrogen 2.618 N/A GLN 758.A N PHE 754.A O no hydrogen 3.034 N/A ASP 759.A N GLN 755.A O no hydrogen 2.991 N/A ILE 760.A N LYS 756.A O no hydrogen 2.936 N/A CYS 761.A N PHE 757.A O no hydrogen 2.986 N/A CYS 761.A SG PHE 757.A O no hydrogen 3.301 N/A VAL 762.A N GLN 758.A O no hydrogen 3.063 N/A LYS 763.A N ASP 759.A O no hydrogen 3.214 N/A ALA 764.A N ILE 760.A O no hydrogen 2.812 N/A TYR 765.A N CYS 761.A O no hydrogen 2.817 N/A TYR 765.A OH ALA 802.A O no hydrogen 2.624 N/A LEU 766.A N VAL 762.A O no hydrogen 3.052 N/A LEU 768.A N ALA 764.A O no hydrogen 3.367 N/A ARG 769.A N TYR 765.A O no hydrogen 3.397 N/A ARG 769.A NE LEU 803.A O no hydrogen 3.318 N/A HIS 770.A N LEU 766.A O no hydrogen 3.191 N/A HIS 770.A NE2 GLU 809.A OE1 no hydrogen 3.113 N/A HIS 771.A N LEU 768.A O no hydrogen 2.873 N/A THR 772.A N ARG 769.A O no hydrogen 3.314 N/A THR 772.A OG1 ARG 769.A O no hydrogen 2.486 N/A LEU 774.A N HIS 771.A O no hydrogen 2.819 N/A LEU 775.A N HIS 771.A O no hydrogen 3.292 N/A ILE 776.A N THR 772.A O no hydrogen 3.042 N/A ILE 777.A N ASN 773.A O no hydrogen 3.166 N/A LEU 778.A N LEU 774.A O no hydrogen 3.372 N/A PHE 779.A N LEU 775.A O no hydrogen 3.027 N/A SER 780.A N ILE 776.A O no hydrogen 2.917 N/A SER 780.A OG ILE 777.A O no hydrogen 2.676 N/A MET 781.A N ILE 777.A O no hydrogen 2.957 N/A MET 782.A N LEU 778.A O no hydrogen 2.835 N/A LEU 783.A N PHE 779.A O no hydrogen 3.216 N/A MET 784.A N SER 780.A O no hydrogen 3.324 N/A THR 785.A N MET 781.A O no hydrogen 3.066 N/A THR 785.A OG1 MET 781.A O no hydrogen 2.629 N/A GLY 786.A N MET 782.A O no hydrogen 2.794 N/A MET 787.A N MET 782.A O no hydrogen 3.355 N/A THR 791.A N ASP 795.A OD2 no hydrogen 2.806 N/A THR 791.A OG1 ASP 795.A OD2 no hydrogen 3.157 N/A GLU 797.A N LYS 793.A O no hydrogen 2.779 N/A ARG 800.A N GLU 797.A O no hydrogen 3.051 N/A ALA 802.A N TYR 798.A O no hydrogen 3.106 N/A LEU 803.A N ILE 799.A O no hydrogen 2.976 N/A THR 804.A N ASP 801.A O no hydrogen 3.273 N/A VAL 805.A N ARG 800.A O no hydrogen 3.214 N/A LYS 807.A NZ ASP 811.A OD2 no hydrogen 3.240 N/A ALA 812.A N ASN 808.A O no hydrogen 2.934 N/A LYS 813.A N GLU 809.A O no hydrogen 2.759 N/A LYS 814.A N GLU 810.A O no hydrogen 3.356 N/A TYR 815.A N ASP 811.A O no hydrogen 2.924 N/A PHE 816.A N ALA 812.A O no hydrogen 3.002 N/A LEU 817.A N LYS 813.A O no hydrogen 3.182 N/A ASP 818.A N LYS 814.A O no hydrogen 2.900 N/A GLN 819.A N TYR 815.A O no hydrogen 3.216 N/A ILE 820.A N PHE 816.A O no hydrogen 3.251 N/A GLU 821.A N LEU 817.A O no hydrogen 3.449 N/A VAL 822.A N ASP 818.A O no hydrogen 3.213 N/A CYS 823.A N ILE 820.A O no hydrogen 2.964 N/A CYS 823.A SG PHE 733.A O no hydrogen 3.211 N/A CYS 823.A SG LEU 735.A O no hydrogen 3.603 N/A ARG 824.A N ILE 820.A O no hydrogen 2.988 N/A ARG 824.A N GLU 821.A O no hydrogen 3.130 N/A ARG 824.A NH2 LYS 749.A O no hydrogen 3.019 N/A ASP 825.A N GLU 821.A O no hydrogen 3.192 N/A LYS 826.A NZ GLU 729.A OE2 no hydrogen 3.460 N/A LYS 826.A NZ ARG 730.A O no hydrogen 3.230 N/A GLY 827.A N CYS 823.A O no hydrogen 3.356 N/A TRP 828.A NE1 ASP 665.A OD2 no hydrogen 2.761 N/A THR 829.A N LYS 826.A O no hydrogen 3.137 N/A THR 829.A OG1 LYS 826.A O no hydrogen 2.552 N/A PHE 832.A N TRP 828.A O no hydrogen 2.983 N/A ASN 833.A N THR 829.A O no hydrogen 3.139 N/A TRP 834.A N VAL 830.A O no hydrogen 3.068 N/A TRP 834.A NE1 ASP 707.A OD1 no hydrogen 2.889 N/A