Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aju_UL.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A N GLN 2.A OE1 no hydrogen 3.202 N/A ARG 3.A N THR 621.A O no hydrogen 2.912 N/A GLU 5.A N GLU 619.A O no hydrogen 2.905 N/A ALA 7.A N ILE 617.A O no hydrogen 2.892 N/A ALA 14.A N ASN 309.A OD1 no hydrogen 2.586 N/A SER 15.A N SER 31.A O no hydrogen 3.003 N/A SER 15.A OG SER 31.A O no hydrogen 2.879 N/A VAL 20.A N ILE 29.A O no hydrogen 3.036 N/A ILE 22.A N GLN 27.A O no hydrogen 2.964 N/A LEU 28.A N TRP 39.A O no hydrogen 2.850 N/A ILE 29.A N VAL 20.A O no hydrogen 2.707 N/A THR 30.A N ASN 37.A O no hydrogen 2.878 N/A THR 30.A OG1 ILE 13.A O no hydrogen 3.519 N/A ALA 32.A N ASP 35.A O no hydrogen 2.749 N/A ASP 35.A N ALA 32.A O no hydrogen 3.291 N/A VAL 36.A N LEU 50.A O no hydrogen 2.982 N/A ASN 37.A N THR 30.A O no hydrogen 2.925 N/A ILE 38.A N SER 48.A O no hydrogen 2.876 N/A TRP 39.A N LEU 28.A O no hydrogen 2.958 N/A THR 43.A OG1 ASP 40.A O no hydrogen 3.358 N/A GLY 44.A N ASP 40.A O no hydrogen 3.028 N/A ASP 45.A N THR 43.A OG1 no hydrogen 3.329 N/A SER 48.A N ILE 38.A O no hydrogen 3.006 N/A LEU 50.A N VAL 36.A O no hydrogen 2.904 N/A GLY 53.A N ASP 52.A OD1 no hydrogen 2.522 N/A ALA 58.A N PRO 55.A O no hydrogen 3.428 N/A ALA 61.A N ALA 58.A O no hydrogen 3.254 N/A ALA 64.A N ARG 62.A O no hydrogen 2.531 N/A CYS 69.A SG TYR 71.A O no hydrogen 4.032 N/A THR 70.A N GLY 84.A O no hydrogen 3.137 N/A TYR 71.A N GLY 84.A O no hydrogen 2.979 N/A GLU 73.A N ALA 82.A O no hydrogen 2.926 N/A HIS 75.A N LEU 80.A O no hydrogen 2.849 N/A HIS 75.A NE2 ASP 77.A OD2 no hydrogen 3.179 N/A THR 78.A OG1 HIS 75.A O no hydrogen 3.373 N/A ASP 79.A N LYS 76.A O no hydrogen 2.964 N/A LEU 80.A N HIS 75.A O no hydrogen 2.948 N/A LEU 81.A N TRP 93.A O no hydrogen 2.908 N/A ALA 82.A N GLU 73.A O no hydrogen 2.864 N/A VAL 83.A N LYS 91.A O no hydrogen 2.880 N/A GLY 84.A N TYR 71.A O no hydrogen 2.845 N/A TYR 85.A N VAL 89.A O no hydrogen 3.090 N/A GLY 88.A N TYR 85.A O no hydrogen 3.400 N/A LYS 91.A N VAL 83.A O no hydrogen 2.909 N/A LYS 91.A NZ TYR 85.A OH no hydrogen 3.066 N/A TRP 93.A N LEU 81.A O no hydrogen 2.866 N/A ASP 94.A N THR 99.A O no hydrogen 2.868 N/A LEU 95.A N ASP 79.A OD2 no hydrogen 3.038 N/A MET 96.A N ASP 79.A OD2 no hydrogen 3.206 N/A SER 97.A OG ASP 94.A OD2 no hydrogen 3.546 N/A THR 99.A N ASP 94.A O no hydrogen 3.390 N/A THR 99.A OG1 VAL 100.A O no hydrogen 3.208 N/A PHE 104.A N ILE 90.A O no hydrogen 2.886 N/A HIS 107.A NE2 SER 125.A OG no hydrogen 2.984 N/A LYS 108.A N ASP 129.A OD2 no hydrogen 3.072 N/A THR 112.A N GLY 126.A O no hydrogen 3.054 N/A THR 112.A OG1 GLY 126.A O no hydrogen 2.487 N/A THR 112.A OG1 ILE 153.A O no hydrogen 2.840 N/A LEU 113.A N GLY 126.A O no hydrogen 2.863 N/A GLN 115.A N ILE 124.A O no hydrogen 2.988 N/A GLN 115.A NE2 PHE 116.A O no hydrogen 2.608 N/A GLN 115.A NE2 ASP 117.A OD1 no hydrogen 3.134 N/A ASP 117.A N ARG 122.A O no hydrogen 2.889 N/A GLY 120.A N ASP 117.A O no hydrogen 2.843 N/A THR 121.A N GLY 118.A O no hydrogen 2.811 N/A ARG 122.A N ASP 117.A O no hydrogen 2.918 N/A ARG 122.A NE GLY 120.A O no hydrogen 3.113 N/A LEU 123.A N TRP 135.A O no hydrogen 2.841 N/A ILE 124.A N GLN 115.A O no hydrogen 2.739 N/A SER 125.A N ILE 133.A O no hydrogen 2.925 N/A SER 125.A OG HIS 107.A NE2 no hydrogen 2.984 N/A SER 125.A OG ILE 133.A O no hydrogen 3.375 N/A GLY 126.A N LEU 113.A O no hydrogen 2.913 N/A SER 127.A OG HIS 107.A ND1 no hydrogen 2.747 N/A SER 127.A OG ASP 129.A OD1 no hydrogen 2.020 N/A LYS 128.A N ALA 110.A O no hydrogen 2.493 N/A ILE 132.A N LEU 146.A O no hydrogen 2.847 N/A ILE 133.A N SER 125.A O no hydrogen 2.910 N/A TRP 135.A N LEU 123.A O no hydrogen 2.805 N/A ASP 136.A N VAL 141.A O no hydrogen 2.911 N/A LEU 137.A N THR 121.A O no hydrogen 2.921 N/A VAL 138.A N THR 121.A OG1 no hydrogen 3.418 N/A VAL 141.A N ASP 136.A O no hydrogen 3.005 N/A VAL 141.A N ASP 136.A OD1 no hydrogen 3.238 N/A LEU 143.A N VAL 134.A O no hydrogen 2.892 N/A LEU 146.A N ILE 132.A O no hydrogen 2.794 N/A HIS 149.A ND1 SER 168.A OG no hydrogen 2.820 N/A HIS 149.A NE2 SER 166.A OG no hydrogen 2.686 N/A LYS 150.A N ASP 170.A OD2 no hydrogen 3.223 N/A THR 154.A N THR 167.A O no hydrogen 3.034 N/A GLY 155.A N THR 167.A O no hydrogen 2.914 N/A TRP 157.A N ILE 165.A O no hydrogen 2.898 N/A CYS 158.A SG GLY 160.A O no hydrogen 3.765 N/A CYS 158.A SG TRP 163.A O no hydrogen 3.626 N/A GLN 159.A N TRP 163.A O no hydrogen 2.907 N/A ASP 162.A N GLN 159.A O no hydrogen 2.963 N/A TRP 163.A N GLN 159.A O no hydrogen 3.040 N/A LEU 164.A N TRP 176.A O no hydrogen 2.963 N/A ILE 165.A N TRP 157.A O no hydrogen 2.878 N/A SER 166.A N LYS 174.A O no hydrogen 2.899 N/A SER 166.A OG HIS 149.A NE2 no hydrogen 2.686 N/A THR 167.A N GLY 155.A O no hydrogen 2.881 N/A THR 167.A OG1 CYS 194.A O no hydrogen 3.004 N/A SER 168.A OG HIS 149.A ND1 no hydrogen 2.820 N/A SER 168.A OG ASP 170.A O no hydrogen 2.754 N/A SER 168.A OG ASP 170.A OD1 no hydrogen 2.132 N/A MET 172.A N ASP 170.A O no hydrogen 2.425 N/A ILE 173.A N HIS 187.A O no hydrogen 2.887 N/A LYS 174.A N SER 166.A O no hydrogen 2.898 N/A LYS 174.A NZ SER 148.A O no hydrogen 3.196 N/A LEU 175.A N GLU 185.A O no hydrogen 2.796 N/A TRP 176.A N LEU 164.A O no hydrogen 2.880 N/A TRP 176.A NE1 SER 166.A OG no hydrogen 3.153 N/A ASP 177.A N GLN 182.A O no hydrogen 3.094 N/A LEU 178.A N ASP 162.A O no hydrogen 2.949 N/A HIS 181.A ND1 HIS 181.A O no hydrogen 2.531 N/A CYS 183.A SG GLU 185.A O no hydrogen 4.000 N/A ILE 184.A N LEU 175.A O no hydrogen 2.911 N/A GLU 185.A N LEU 175.A O no hydrogen 3.015 N/A HIS 187.A N ILE 173.A O no hydrogen 2.933 N/A ALA 189.A N GLY 171.A O no hydrogen 2.861 N/A GLU 193.A N GLU 193.A OE1 no hydrogen 2.385 N/A CYS 194.A N SER 168.A O no hydrogen 3.350 N/A CYS 194.A SG THR 167.A OG1 no hydrogen 2.610 N/A GLY 196.A N THR 207.A O no hydrogen 3.049 N/A ALA 198.A N ILE 205.A O no hydrogen 2.985 N/A LYS 200.A N LEU 203.A O no hydrogen 2.438 N/A LYS 200.A NZ ASP 201.A OD1 no hydrogen 2.787 N/A LEU 204.A N TRP 216.A O no hydrogen 2.835 N/A ILE 205.A N ALA 198.A O no hydrogen 2.872 N/A THR 206.A N LYS 214.A O no hydrogen 2.984 N/A THR 207.A N GLY 196.A O no hydrogen 2.862 N/A GLY 208.A N GLN 212.A O no hydrogen 2.999 N/A SER 211.A OG ASP 210.A O no hydrogen 2.434 N/A GLN 212.A N ASP 210.A OD1 no hydrogen 3.333 N/A VAL 213.A N PHE 235.A O no hydrogen 2.953 N/A LYS 214.A N THR 206.A O no hydrogen 2.887 N/A LYS 214.A NZ ALA 189.A O no hydrogen 3.136 N/A LYS 214.A NZ GLU 231.A OE1 no hydrogen 3.133 N/A ILE 215.A N GLY 233.A O no hydrogen 2.524 N/A TRP 216.A N LEU 204.A O no hydrogen 2.946 N/A LEU 218.A N ASP 202.A O no hydrogen 2.676 N/A ILE 220.A N ASP 219.A OD1 no hydrogen 2.608 N/A ASP 223.A N GLU 221.A OE1 no hydrogen 3.226 N/A LYS 228.A N GLY 226.A O no hydrogen 2.548 N/A GLU 231.A N THR 230.A OG1 no hydrogen 2.533 N/A GLY 233.A N ILE 215.A O no hydrogen 2.759 N/A PHE 235.A N VAL 213.A O no hydrogen 2.841 N/A SER 239.A OG GLN 241.A O no hydrogen 3.543 N/A GLN 241.A N SER 239.A OG no hydrogen 3.355 N/A LEU 244.A N GLN 257.A O no hydrogen 2.837 N/A LYS 245.A N GLN 257.A O no hydrogen 3.099 N/A LYS 245.A NZ TYR 255.A OH no hydrogen 2.223 N/A LYS 245.A NZ ALA 290.A O no hydrogen 3.246 N/A GLU 247.A N TYR 255.A O no hydrogen 2.985 N/A ILE 249.A N PHE 253.A O no hydrogen 2.921 N/A THR 250.A OG1 ILE 249.A O no hydrogen 2.505 N/A SER 252.A N ILE 249.A O no hydrogen 2.433 N/A PHE 253.A N ILE 249.A O no hydrogen 2.932 N/A PHE 254.A N PHE 266.A O no hydrogen 2.937 N/A TYR 255.A N GLU 247.A O no hydrogen 2.873 N/A TYR 255.A OH ALA 290.A O no hydrogen 2.795 N/A ILE 256.A N GLU 264.A O no hydrogen 2.888 N/A GLN 257.A N LYS 245.A O no hydrogen 2.792 N/A ASN 258.A N THR 262.A O no hydrogen 3.017 N/A ASN 258.A ND2 GLN 241.A O no hydrogen 3.107 N/A ALA 259.A N ASN 258.A OD1 no hydrogen 2.254 N/A THR 262.A OG1 ASP 260.A O no hydrogen 2.964 N/A THR 262.A OG1 ASP 260.A OD2 no hydrogen 2.399 N/A ILE 263.A N ILE 281.A O no hydrogen 2.950 N/A GLU 264.A N ILE 256.A O no hydrogen 2.915 N/A THR 265.A N GLN 279.A O no hydrogen 2.900 N/A THR 265.A OG1 GLN 279.A O no hydrogen 3.090 N/A PHE 266.A N PHE 254.A O no hydrogen 2.851 N/A ARG 267.A N HIS 276.A O no hydrogen 2.265 N/A ILE 268.A N SER 252.A O no hydrogen 2.901 N/A ARG 269.A NE PHE 273.A O no hydrogen 3.119 N/A ARG 269.A NH1 HIS 276.A ND1 no hydrogen 3.304 N/A ARG 269.A NH2 HIS 276.A ND1 no hydrogen 3.454 N/A SER 271.A OG ILE 234.A O no hydrogen 2.751 N/A ILE 274.A N TYR 270.A O no hydrogen 2.936 N/A LEU 275.A N SER 271.A O no hydrogen 2.901 N/A GLN 279.A N THR 265.A O no hydrogen 2.927 N/A GLN 279.A NE2 SER 325.A O no hydrogen 2.415 N/A ILE 281.A N ILE 263.A O no hydrogen 2.867 N/A SER 283.A OG GLU 312.A OE1 no hydrogen 3.032 N/A SER 283.A OG GLU 312.A OE2 no hydrogen 2.761 N/A LYS 288.A N THR 305.A O no hydrogen 2.698 N/A LYS 288.A NZ ASN 16.A OD1 no hydrogen 2.633 N/A SER 289.A OG ALA 17.A O no hydrogen 3.274 N/A SER 289.A OG ASN 18.A OD1 no hydrogen 3.199 N/A SER 291.A N VAL 303.A O no hydrogen 3.250 N/A SER 291.A OG ALA 290.A O no hydrogen 2.466 N/A THR 293.A N GLU 301.A O no hydrogen 2.472 N/A THR 293.A OG1 TRP 292.A O no hydrogen 2.725 N/A THR 294.A OG1 LYS 299.A O no hydrogen 2.125 N/A SER 296.A OG VAL 295.A O no hydrogen 2.660 N/A SER 298.A N VAL 295.A O no hydrogen 3.224 N/A SER 298.A OG SER 296.A OG no hydrogen 2.723 N/A LEU 300.A N ILE 316.A O no hydrogen 2.863 N/A GLU 301.A N THR 293.A O no hydrogen 2.868 N/A LEU 302.A N TYR 314.A O no hydrogen 2.835 N/A VAL 303.A N SER 291.A O no hydrogen 2.940 N/A LEU 304.A N GLU 312.A O no hydrogen 2.910 N/A THR 305.A N SER 289.A O no hydrogen 3.447 N/A THR 306.A N THR 310.A O no hydrogen 3.008 N/A THR 306.A OG1 SER 308.A O no hydrogen 2.512 N/A THR 306.A OG1 THR 310.A O no hydrogen 3.155 N/A THR 306.A OG1 THR 310.A OG1 no hydrogen 2.088 N/A SER 307.A N LYS 286.A O no hydrogen 2.466 N/A THR 310.A N SER 308.A O no hydrogen 2.581 N/A THR 310.A OG1 THR 306.A OG1 no hydrogen 2.088 N/A ILE 311.A N ILE 334.A O no hydrogen 2.993 N/A GLU 312.A N LEU 304.A O no hydrogen 2.881 N/A TYR 313.A N HIS 332.A O no hydrogen 2.908 N/A TYR 313.A OH GLU 301.A OE1 no hydrogen 2.867 N/A TYR 314.A N LEU 302.A O no hydrogen 2.909 N/A TYR 314.A OH GLU 312.A OE1 no hydrogen 2.492 N/A SER 315.A N LEU 329.A O no hydrogen 2.988 N/A ILE 316.A N LEU 300.A O no hydrogen 2.878 N/A TYR 318.A N SER 298.A O no hydrogen 2.872 N/A THR 324.A N ASP 322.A OD2 no hydrogen 2.713 N/A THR 324.A OG1 ASP 322.A O no hydrogen 2.921 N/A SER 325.A OG PRO 323.A O no hydrogen 3.506 N/A LYS 330.A NZ GLU 312.A OE2 no hydrogen 2.833 N/A LYS 330.A NZ TYR 314.A OH no hydrogen 2.177 N/A THR 331.A OG1 HIS 332.A ND1 no hydrogen 2.917 N/A HIS 332.A ND1 THR 331.A OG1 no hydrogen 2.917 N/A ILE 334.A N ILE 311.A O no hydrogen 2.871 N/A GLY 338.A N GLU 335.A O no hydrogen 2.332 N/A THR 341.A OG1 ASP 342.A OD1 no hydrogen 2.883 N/A ASP 342.A N THR 341.A OG1 no hydrogen 2.526 N/A ARG 344.A N THR 357.A O no hydrogen 2.596 N/A ARG 344.A NE ASP 342.A OD2 no hydrogen 2.758 N/A SER 345.A OG CYS 385.A O no hydrogen 3.429 N/A ILE 348.A N ASP 347.A OD1 no hydrogen 2.486 N/A ASN 352.A N SER 349.A O no hydrogen 2.892 N/A LYS 353.A N SER 349.A OG no hydrogen 2.991 N/A LEU 354.A N TRP 366.A O no hydrogen 2.922 N/A LEU 355.A N ASP 347.A O no hydrogen 2.985 N/A GLY 361.A N ALA 358.A O no hydrogen 2.889 N/A SER 362.A OG GLN 339.A OE1 no hydrogen 2.424 N/A LEU 363.A N GLY 361.A O no hydrogen 2.610 N/A LYS 364.A N ALA 356.A O no hydrogen 2.885 N/A LYS 364.A NZ LEU 336.A O no hydrogen 3.185 N/A ILE 365.A N ARG 375.A O no hydrogen 2.869 N/A TRP 366.A N LEU 354.A O no hydrogen 2.886 N/A THR 370.A OG1 ASN 367.A OD1 no hydrogen 2.244 N/A HIS 371.A N ASN 367.A O no hydrogen 2.763 N/A LYS 372.A N THR 370.A OG1 no hydrogen 3.164 N/A CYS 373.A SG ILE 365.A O no hydrogen 3.573 N/A ILE 374.A N ILE 365.A O no hydrogen 2.385 N/A ARG 375.A N ILE 365.A O no hydrogen 3.083 N/A ARG 375.A NH2 LEU 408.A O no hydrogen 2.575 N/A ARG 375.A NH2 ALA 409.A O no hydrogen 2.592 N/A PHE 377.A N LEU 363.A O no hydrogen 2.908 N/A CYS 379.A SG GLY 361.A O no hydrogen 3.852 N/A CYS 379.A SG GLY 380.A O no hydrogen 3.533 N/A GLY 380.A N ASN 360.A O no hydrogen 2.742 N/A LEU 383.A N GLY 397.A O no hydrogen 2.799 N/A THR 384.A N GLY 397.A O no hydrogen 2.965 N/A CYS 385.A N SER 345.A OG no hydrogen 2.618 N/A CYS 385.A SG ILE 395.A O no hydrogen 3.681 N/A LYS 386.A N ILE 395.A O no hydrogen 2.923 N/A PHE 387.A N ASP 347.A OD2 no hydrogen 2.378 N/A LEU 388.A N LEU 393.A O no hydrogen 2.827 N/A LEU 392.A N PRO 389.A O no hydrogen 3.226 N/A LEU 393.A N LEU 388.A O no hydrogen 2.964 N/A VAL 394.A N PHE 406.A O no hydrogen 2.966 N/A ILE 395.A N LYS 386.A O no hydrogen 2.929 N/A LEU 396.A N GLN 404.A O no hydrogen 2.848 N/A GLY 397.A N THR 384.A O no hydrogen 2.855 N/A THR 398.A N GLU 402.A O no hydrogen 3.325 N/A THR 398.A OG1 ASN 400.A O no hydrogen 2.216 N/A THR 398.A OG1 GLU 402.A O no hydrogen 3.011 N/A ARG 399.A N TYR 381.A O no hydrogen 2.937 N/A GLU 402.A N ASN 400.A O no hydrogen 2.368 N/A LEU 403.A N ILE 417.A O no hydrogen 3.158 N/A GLN 404.A N LEU 396.A O no hydrogen 2.977 N/A GLN 404.A NE2 CYS 379.A O no hydrogen 3.541 N/A PHE 406.A N VAL 394.A O no hydrogen 2.845 N/A LEU 414.A N SER 412.A O no hydrogen 3.016 N/A ILE 417.A N LEU 403.A O no hydrogen 2.961 N/A ASP 419.A N GLU 402.A OE2 no hydrogen 2.671 N/A HIS 421.A N GLY 401.A O no hydrogen 3.325 N/A ASP 422.A N ASP 443.A OD2 no hydrogen 2.309 N/A ALA 423.A N ASP 443.A OD1 no hydrogen 2.494 N/A TRP 426.A N GLY 440.A O no hydrogen 2.676 N/A SER 427.A N GLY 440.A O no hydrogen 2.978 N/A SER 427.A OG LEU 428.A O no hydrogen 3.506 N/A ASP 429.A N VAL 438.A O no hydrogen 2.907 N/A LEU 430.A N ASP 429.A OD1 no hydrogen 2.268 N/A THR 431.A N ARG 436.A O no hydrogen 2.849 N/A THR 431.A OG1 ASP 433.A OD1 no hydrogen 2.670 N/A THR 431.A OG1 ARG 436.A O no hydrogen 2.851 N/A SER 432.A N ASP 477.A OD1 no hydrogen 2.954 N/A SER 432.A OG SER 474.A O no hydrogen 3.414 N/A SER 432.A OG PRO 475.A O no hydrogen 2.486 N/A SER 432.A OG ASP 477.A OD1 no hydrogen 3.386 N/A GLY 434.A N THR 431.A OG1 no hydrogen 3.341 N/A LYS 435.A N ASP 433.A OD1 no hydrogen 3.194 N/A ARG 436.A N THR 431.A OG1 no hydrogen 3.009 N/A ARG 436.A NE ASP 459.A OD2 no hydrogen 3.182 N/A ARG 436.A NH2 ASP 459.A OD2 no hydrogen 3.330 N/A LEU 437.A N TRP 449.A O no hydrogen 2.865 N/A VAL 438.A N ASP 429.A O no hydrogen 2.874 N/A THR 439.A N LYS 447.A O no hydrogen 2.902 N/A THR 439.A OG1 HIS 421.A NE2 no hydrogen 3.380 N/A THR 439.A OG1 LYS 447.A O no hydrogen 3.191 N/A GLY 440.A N SER 427.A O no hydrogen 2.847 N/A SER 441.A N THR 445.A O no hydrogen 2.905 N/A SER 441.A OG THR 445.A O no hydrogen 3.190 N/A SER 441.A OG THR 445.A OG1 no hydrogen 2.137 N/A ALA 442.A N ALA 424.A O no hydrogen 2.749 N/A THR 445.A N SER 441.A O no hydrogen 2.993 N/A THR 445.A OG1 HIS 421.A ND1 no hydrogen 2.847 N/A THR 445.A OG1 SER 441.A O no hydrogen 3.356 N/A THR 445.A OG1 SER 441.A OG no hydrogen 2.137 N/A VAL 446.A N LEU 462.A O no hydrogen 2.899 N/A LYS 447.A N THR 439.A O no hydrogen 2.903 N/A LYS 447.A NZ ALA 420.A O no hydrogen 3.160 N/A PHE 448.A N THR 460.A O no hydrogen 2.880 N/A TRP 449.A N LEU 437.A O no hydrogen 2.849 N/A ASP 450.A N HIS 457.A O no hydrogen 2.840 N/A PHE 451.A N LYS 435.A O no hydrogen 2.942 N/A LYS 455.A N LYS 452.A O no hydrogen 2.835 N/A LYS 455.A NZ VAL 453.A O no hydrogen 3.462 N/A HIS 457.A N ASP 450.A O no hydrogen 3.006 N/A THR 460.A N PHE 448.A O no hydrogen 3.080 N/A THR 460.A OG1 THR 461.A O no hydrogen 3.325 N/A THR 461.A OG1 VAL 446.A O no hydrogen 3.262 N/A THR 461.A OG1 LEU 462.A O no hydrogen 3.536 N/A LEU 462.A N VAL 446.A O no hydrogen 2.815 N/A LEU 464.A N LYS 444.A O no hydrogen 2.912 N/A LEU 469.A N SER 483.A O no hydrogen 2.722 N/A CYS 470.A N SER 483.A O no hydrogen 3.067 N/A CYS 470.A SG VAL 471.A O no hydrogen 3.572 N/A ARG 472.A N ALA 481.A O no hydrogen 2.962 N/A ARG 472.A NE ASP 514.A OD1 no hydrogen 2.593 N/A ARG 472.A NH2 ASP 514.A OD1 no hydrogen 2.825 N/A VAL 473.A N ASP 429.A OD2 no hydrogen 2.652 N/A SER 474.A N TYR 479.A O no hydrogen 2.895 N/A ASP 476.A N SER 474.A OG no hydrogen 2.884 N/A ASP 477.A N SER 474.A O no hydrogen 2.889 N/A LEU 480.A N PHE 492.A O no hydrogen 2.914 N/A ALA 481.A N ARG 472.A O no hydrogen 2.863 N/A ILE 482.A N LYS 490.A O no hydrogen 2.871 N/A SER 483.A N CYS 470.A O no hydrogen 2.888 N/A SER 483.A OG CYS 470.A O no hydrogen 3.132 N/A SER 483.A OG VAL 510.A O no hydrogen 3.408 N/A LEU 484.A N THR 488.A O no hydrogen 2.964 N/A LEU 485.A N ASP 467.A O no hydrogen 2.575 N/A THR 488.A N ASP 486.A O no hydrogen 2.385 N/A THR 488.A OG1 ASP 486.A OD2 no hydrogen 2.678 N/A VAL 489.A N LEU 503.A O no hydrogen 2.924 N/A LYS 490.A N ILE 482.A O no hydrogen 2.940 N/A VAL 491.A N LEU 501.A O no hydrogen 2.936 N/A PHE 492.A N LEU 480.A O no hydrogen 2.886 N/A LEU 494.A N ARG 478.A O no hydrogen 2.861 N/A SER 496.A N PHE 493.A O no hydrogen 3.318 N/A MET 497.A N PHE 493.A O no hydrogen 2.774 N/A TYR 500.A OH LEU 536.A O no hydrogen 2.897 N/A TYR 500.A OH ASP 537.A O no hydrogen 3.384 N/A LEU 501.A N VAL 491.A O no hydrogen 2.922 N/A LEU 503.A N VAL 489.A O no hydrogen 2.848 N/A HIS 506.A ND1 ASP 528.A OD2 no hydrogen 3.080 N/A LEU 511.A N SER 525.A O no hydrogen 2.699 N/A SER 512.A N SER 525.A O no hydrogen 2.961 N/A SER 512.A OG ASN 554.A OD1 no hydrogen 2.649 N/A ASP 514.A N ILE 523.A O no hydrogen 2.989 N/A ILE 515.A N ASP 514.A OD1 no hydrogen 2.437 N/A SER 516.A N MET 521.A O no hydrogen 2.906 N/A SER 516.A OG ASP 518.A OD1 no hydrogen 2.696 N/A ASP 518.A N SER 516.A OG no hydrogen 3.121 N/A SER 519.A N SER 516.A O no hydrogen 3.374 N/A LYS 520.A N ASP 518.A OD1 no hydrogen 3.064 N/A LYS 520.A NZ ASP 537.A OD1 no hydrogen 2.726 N/A LYS 520.A NZ ASP 537.A OD2 no hydrogen 3.559 N/A ILE 522.A N TRP 534.A O no hydrogen 2.900 N/A ILE 523.A N ASP 514.A O no hydrogen 2.831 N/A THR 524.A N LYS 532.A O no hydrogen 2.934 N/A THR 524.A OG1 HIS 506.A NE2 no hydrogen 3.092 N/A THR 524.A OG1 LYS 532.A O no hydrogen 2.984 N/A SER 525.A N SER 512.A O no hydrogen 2.902 N/A SER 525.A OG ILE 552.A O no hydrogen 2.563 N/A SER 526.A OG HIS 506.A ND1 no hydrogen 2.762 N/A SER 526.A OG PRO 509.A O no hydrogen 3.378 N/A ASN 530.A N ASP 528.A OD1 no hydrogen 3.384 N/A ILE 531.A N LEU 545.A O no hydrogen 2.860 N/A LYS 532.A N THR 524.A O no hydrogen 2.954 N/A LYS 532.A NZ GLY 505.A O no hydrogen 2.995 N/A LYS 532.A NZ ASN 530.A OD1 no hydrogen 3.455 N/A ILE 533.A N LYS 543.A O no hydrogen 2.883 N/A TRP 534.A N ILE 522.A O no hydrogen 2.856 N/A TRP 534.A NE1 THR 524.A OG1 no hydrogen 2.856 N/A GLY 535.A N ASP 540.A O no hydrogen 2.900 N/A LEU 536.A N LYS 520.A O no hydrogen 3.027 N/A ASP 540.A N GLY 535.A O no hydrogen 2.992 N/A LYS 543.A N ILE 533.A O no hydrogen 2.997 N/A LEU 545.A N ILE 531.A O no hydrogen 2.919 N/A ALA 547.A N LYS 529.A O no hydrogen 2.971 N/A HIS 548.A NE2 SER 566.A OG no hydrogen 2.649 N/A ASP 550.A N ASP 570.A OD1 no hydrogen 3.188 N/A MET 553.A N CYS 567.A O no hydrogen 2.517 N/A ASN 554.A N CYS 567.A O no hydrogen 2.924 N/A VAL 555.A N SER 512.A OG no hydrogen 2.860 N/A LYS 556.A N PHE 565.A O no hydrogen 2.946 N/A PHE 557.A N ASP 514.A OD2 no hydrogen 2.703 N/A SER 561.A OG ASN 563.A OD1 no hydrogen 2.922 N/A ASN 563.A N SER 561.A O no hydrogen 2.953 N/A ASN 563.A ND2 ASP 577.A OD2 no hydrogen 2.289 N/A PHE 564.A N TRP 576.A O no hydrogen 2.944 N/A PHE 565.A N LYS 556.A O no hydrogen 2.850 N/A SER 566.A N LYS 574.A O no hydrogen 2.934 N/A SER 566.A OG HIS 548.A NE2 no hydrogen 2.649 N/A SER 566.A OG LYS 574.A O no hydrogen 3.130 N/A CYS 567.A N ASN 554.A O no hydrogen 2.907 N/A CYS 567.A SG ASN 554.A O no hydrogen 3.130 N/A CYS 567.A SG VAL 594.A O no hydrogen 3.900 N/A SER 568.A OG HIS 548.A ND1 no hydrogen 3.123 N/A SER 568.A OG ASP 570.A OD2 no hydrogen 2.431 N/A LYS 569.A N SER 551.A O no hydrogen 3.297 N/A ASP 570.A N SER 568.A OG no hydrogen 3.206 N/A VAL 573.A N LEU 587.A O no hydrogen 2.940 N/A LYS 574.A N SER 566.A O no hydrogen 2.945 N/A TYR 575.A N GLN 585.A O no hydrogen 2.894 N/A TRP 576.A N PHE 564.A O no hydrogen 2.907 N/A TRP 576.A NE1 SER 566.A OG no hydrogen 3.013 N/A GLY 578.A N HIS 562.A O no hydrogen 2.892 N/A GLU 579.A N ASP 577.A OD1 no hydrogen 2.720 N/A LYS 580.A N ASP 577.A OD1 no hydrogen 2.900 N/A PHE 581.A N ASP 577.A O no hydrogen 2.529 N/A CYS 583.A SG CYS 583.A O no hydrogen 2.940 N/A GLN 585.A N TYR 575.A O no hydrogen 3.036 N/A LEU 587.A N VAL 573.A O no hydrogen 2.832 N/A HIS 590.A NE2 SER 608.A OG no hydrogen 3.118 N/A GLN 591.A N ASP 612.A OD2 no hydrogen 3.300 N/A SER 592.A OG ASP 612.A OD2 no hydrogen 3.051 N/A GLU 593.A N GLU 593.A OE1 no hydrogen 2.434 N/A VAL 594.A N SER 568.A O no hydrogen 2.989 N/A ALA 596.A N SER 609.A O no hydrogen 3.012 N/A ALA 598.A N VAL 607.A O no hydrogen 2.937 N/A ALA 600.A N PHE 605.A O no hydrogen 2.944 N/A VAL 607.A N ALA 598.A O no hydrogen 2.957 N/A SER 608.A OG HIS 590.A NE2 no hydrogen 3.118 N/A SER 609.A OG SER 610.A O no hydrogen 3.088 N/A SER 610.A N SER 614.A O no hydrogen 3.041 N/A SER 610.A OG ASP 612.A OD1 no hydrogen 2.220 N/A ARG 616.A NE SER 614.A OG no hydrogen 2.336 N/A ARG 616.A NH1 GLN 6.A OE1 no hydrogen 2.260 N/A ARG 616.A NH2 GLU 34.A OE2 no hydrogen 3.378 N/A GLU 619.A N GLU 5.A O no hydrogen 2.901 N/A THR 621.A N ARG 3.A O no hydrogen 2.866 N/A ARG 628.A N LYS 624.A O no hydrogen 2.941 N/A MET 630.A N GLY 626.A O no hydrogen 2.919 N/A GLU 631.A N GLU 627.A O no hydrogen 3.039 N/A ALA 632.A N ARG 628.A O no hydrogen 2.955 N/A LEU 633.A N LEU 629.A O no hydrogen 2.872 N/A ASP 634.A N MET 630.A O no hydrogen 2.891 N/A LEU 635.A N GLU 631.A O no hydrogen 3.087 N/A GLY 636.A N ALA 632.A O no hydrogen 2.891 N/A ILE 637.A N LEU 633.A O no hydrogen 2.914 N/A ALA 638.A N ASP 634.A O no hydrogen 2.911 N/A GLU 639.A N LEU 635.A O no hydrogen 2.962 N/A ILE 640.A N GLY 636.A O no hydrogen 2.898 N/A GLU 641.A N ILE 637.A O no hydrogen 2.876 N/A GLY 642.A N ALA 638.A O no hydrogen 2.904 N/A LEU 643.A N GLU 639.A O no hydrogen 2.918 N/A GLU 644.A N ILE 640.A O no hydrogen 2.896 N/A ALA 645.A N GLU 641.A O no hydrogen 2.877 N/A TYR 646.A N GLY 642.A O no hydrogen 2.928 N/A ASN 647.A N LEU 643.A O no hydrogen 2.900 N/A ARG 648.A N GLU 644.A O no hydrogen 2.919 N/A ARG 648.A NE GLU 644.A OE2 no hydrogen 2.984 N/A ASP 649.A N ALA 645.A O no hydrogen 2.873 N/A MET 650.A N TYR 646.A O no hydrogen 2.944 N/A LYS 651.A N ASN 647.A O no hydrogen 2.921 N/A ILE 656.A N ASN 652.A O no hydrogen 2.895 N/A ALA 657.A N ALA 653.A O no hydrogen 2.875 N/A VAL 658.A N VAL 654.A O no hydrogen 2.920 N/A ASN 659.A N LEU 655.A O no hydrogen 2.852 N/A GLN 664.A NE2 GLN 664.A O no hydrogen 2.721 N/A TYR 665.A N THR 661.A O no hydrogen 2.893 N/A ILE 666.A N PRO 662.A O no hydrogen 2.938 N/A MET 667.A N GLU 663.A O no hydrogen 2.948 N/A ASP 668.A N GLN 664.A O no hydrogen 2.832 N/A THR 669.A N TYR 665.A O no hydrogen 3.028 N/A LEU 670.A N ILE 666.A O no hydrogen 2.977 N/A LEU 671.A N MET 667.A O no hydrogen 2.897 N/A ARG 672.A N ASP 668.A O no hydrogen 2.917 N/A ARG 672.A NH1 ARG 672.A O no hydrogen 2.998 N/A ILE 673.A N THR 669.A O no hydrogen 2.983 N/A GLN 677.A N ARG 674.A O no hydrogen 2.772 N/A LEU 678.A N ARG 674.A O no hydrogen 2.783 N/A GLU 679.A N MET 675.A O no hydrogen 3.097 N/A ALA 681.A N GLN 677.A O no hydrogen 2.896 N/A LEU 682.A N LEU 678.A O no hydrogen 2.983 N/A MET 683.A N GLU 679.A O no hydrogen 3.100 N/A VAL 684.A N ASP 680.A O no hydrogen 2.876 N/A MET 685.A N ALA 681.A O no hydrogen 3.062 N/A TYR 689.A OH ASP 634.A OD2 no hydrogen 2.755 N/A VAL 690.A N PRO 686.A O no hydrogen 2.949 N/A LEU 691.A N PHE 687.A O no hydrogen 2.922 N/A LYS 692.A N SER 688.A O no hydrogen 3.017 N/A LYS 692.A NZ ASP 634.A OD1 no hydrogen 2.858 N/A PHE 693.A N TYR 689.A O no hydrogen 2.851 N/A LEU 694.A N VAL 690.A O no hydrogen 2.983 N/A LYS 695.A N LEU 691.A O no hydrogen 3.076 N/A LYS 695.A NZ GLU 641.A OE2 no hydrogen 2.397 N/A PHE 696.A N LYS 692.A O no hydrogen 2.983 N/A ILE 697.A N PHE 693.A O no hydrogen 2.947 N/A ASP 698.A N LEU 694.A O no hydrogen 2.996 N/A THR 699.A N LYS 695.A O no hydrogen 3.000 N/A THR 699.A OG1 LYS 695.A O no hydrogen 3.056 N/A VAL 700.A N PHE 696.A O no hydrogen 3.034 N/A MET 701.A N ILE 697.A O no hydrogen 3.017 N/A GLN 702.A N ASP 698.A O no hydrogen 2.992 N/A ASN 703.A N THR 699.A O no hydrogen 2.952 N/A ASN 703.A ND2 GLU 663.A OE2 no hydrogen 2.670 N/A LEU 706.A N ASN 703.A O no hydrogen 3.206 N/A HIS 708.A N LYS 704.A O no hydrogen 3.096 N/A SER 709.A N THR 705.A O no hydrogen 2.931 N/A SER 709.A OG LEU 706.A O no hydrogen 2.572 N/A HIS 710.A N LEU 706.A O no hydrogen 2.970 N/A ILE 714.A N HIS 710.A O no hydrogen 3.212 N/A CYS 715.A N LEU 711.A O no hydrogen 3.089 N/A CYS 715.A SG LEU 711.A O no hydrogen 3.047 N/A LYS 716.A N PRO 712.A O no hydrogen 2.946 N/A ASN 717.A N LEU 713.A O no hydrogen 2.991 N/A LEU 718.A N ILE 714.A O no hydrogen 2.888 N/A PHE 719.A N CYS 715.A O no hydrogen 2.960 N/A PHE 720.A N LYS 716.A O no hydrogen 2.989 N/A ILE 721.A N ASN 717.A O no hydrogen 2.928 N/A ILE 722.A N LEU 718.A O no hydrogen 3.030 N/A LYS 723.A N PHE 719.A O no hydrogen 2.938 N/A PHE 724.A N PHE 720.A O no hydrogen 2.970 N/A ASN 725.A N ILE 721.A O no hydrogen 3.009 N/A ASN 725.A ND2 ILE 721.A O no hydrogen 3.019 N/A LEU 729.A N ASN 725.A O no hydrogen 3.148 N/A VAL 730.A N HIS 726.A O no hydrogen 2.964 N/A SER 731.A N LYS 727.A O no hydrogen 2.967 N/A GLN 732.A N GLU 728.A O no hydrogen 2.958 N/A ASN 734.A ND2 GLN 732.A OE1 no hydrogen 3.175 N/A GLU 735.A N GLU 735.A OE1 no hydrogen 2.471 N/A LYS 738.A N ASN 734.A O no hydrogen 2.890 N/A LEU 739.A N GLU 735.A O no hydrogen 2.947 N/A GLN 740.A N GLU 736.A O no hydrogen 2.887 N/A GLN 740.A NE2 GLU 736.A OE1 no hydrogen 3.076 N/A ILE 741.A N LEU 737.A O no hydrogen 2.915 N/A ASN 742.A N LYS 738.A O no hydrogen 2.897 N/A ASN 742.A ND2 LYS 738.A O no hydrogen 2.416 N/A ARG 743.A N LEU 739.A O no hydrogen 2.943 N/A VAL 744.A N GLN 740.A O no hydrogen 2.897 N/A LYS 745.A N ILE 741.A O no hydrogen 2.852 N/A THR 746.A N ASN 742.A O no hydrogen 2.981 N/A THR 746.A OG1 ASN 742.A O no hydrogen 2.859 N/A THR 746.A OG1 ARG 743.A O no hydrogen 2.471 N/A THR 746.A OG1 GLU 747.A OE1 no hydrogen 3.215 N/A GLU 747.A N ARG 743.A O no hydrogen 2.958 N/A GLU 747.A N GLU 747.A OE1 no hydrogen 2.963 N/A LEU 748.A N VAL 744.A O no hydrogen 2.914 N/A ARG 749.A N LYS 745.A O no hydrogen 2.930 N/A SER 750.A N THR 746.A O no hydrogen 2.957 N/A SER 750.A OG THR 746.A O no hydrogen 2.957 N/A ALA 751.A N GLU 747.A O no hydrogen 2.975 N/A LEU 752.A N LEU 748.A O no hydrogen 2.952 N/A LYS 753.A N ARG 749.A O no hydrogen 2.859 N/A SER 754.A N SER 750.A O no hydrogen 2.953 N/A SER 754.A OG ALA 751.A O no hydrogen 2.352 N/A THR 755.A N ALA 751.A O no hydrogen 3.088 N/A GLU 756.A N LEU 752.A O no hydrogen 2.829 N/A ASP 757.A N LYS 753.A O no hydrogen 2.875 N/A ASP 758.A N SER 754.A O no hydrogen 3.050 N/A LEU 759.A N THR 755.A O no hydrogen 2.985 N/A GLY 760.A N GLU 756.A O no hydrogen 3.017 N/A PHE 761.A N ASP 757.A O no hydrogen 2.929 N/A ASN 762.A N ASP 758.A O no hydrogen 3.016 N/A VAL 763.A N LEU 759.A O no hydrogen 2.972 N/A GLN 764.A N GLY 760.A O no hydrogen 3.013 N/A GLY 765.A N PHE 761.A O no hydrogen 2.960 N/A LEU 766.A N ASN 762.A O no hydrogen 2.952 N/A LYS 767.A N VAL 763.A O no hydrogen 2.944 N/A PHE 768.A N GLN 764.A O no hydrogen 2.949 N/A VAL 769.A N GLY 765.A O no hydrogen 2.954 N/A LYS 770.A N LEU 766.A O no hydrogen 2.930 N/A GLN 771.A N LYS 767.A O no hydrogen 2.949 N/A GLN 772.A N PHE 768.A O no hydrogen 2.914 N/A TRP 773.A N VAL 769.A O no hydrogen 2.960 N/A ASN 774.A N LYS 770.A O no hydrogen 2.855 N/A LEU 775.A N GLN 771.A O no hydrogen 2.897 N/A ARG 776.A N GLN 772.A O no hydrogen 2.963 N/A ARG 776.A NE HIS 777.A NE2 no hydrogen 3.371 N/A ARG 776.A NH1 HIS 777.A NE2 no hydrogen 2.816 N/A HIS 777.A N TRP 773.A O no hydrogen 2.918 N/A ASN 778.A ND2 ASN 774.A OD1 no hydrogen 2.807 N/A