Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6zki_3.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 15.A O no hydrogen 2.987 N/A VAL 6.A N VAL 13.A O no hydrogen 2.971 N/A PHE 7.A N TRP 72.A O no hydrogen 2.753 N/A VAL 8.A N GLN 11.A O no hydrogen 3.064 N/A ASP 9.A N ILE 74.A O no hydrogen 2.634 N/A GLY 10.A N ASN 73.A OD1 no hydrogen 2.761 N/A GLN 11.A N VAL 8.A O no hydrogen 3.137 N/A SER 12.A OG GLU 5.A OE2 no hydrogen 2.728 N/A VAL 13.A N VAL 6.A O no hydrogen 2.915 N/A VAL 15.A N ILE 4.A O no hydrogen 2.973 N/A THR 19.A N GLU 16.A O no hydrogen 3.306 N/A THR 19.A OG1 GLU 16.A O no hydrogen 2.554 N/A VAL 21.A N MET 66.A O no hydrogen 2.989 N/A LEU 22.A N ALA 63.A O no hydrogen 2.852 N/A GLN 23.A N THR 20.A OG1 no hydrogen 3.426 N/A ALA 24.A N THR 20.A O no hydrogen 3.045 N/A CYS 25.A N VAL 21.A O no hydrogen 2.950 N/A CYS 25.A SG VAL 21.A O no hydrogen 3.246 N/A GLU 26.A N LEU 22.A O no hydrogen 2.864 N/A LYS 27.A N GLN 23.A O no hydrogen 2.986 N/A GLY 29.A N GLU 26.A O no hydrogen 3.074 N/A MET 30.A N CYS 25.A O no hydrogen 3.010 N/A ARG 34.A NE ILE 32.A O no hydrogen 2.801 N/A ARG 34.A NH2 ILE 32.A O no hydrogen 2.969 N/A ARG 40.A N HIS 38.A ND1 no hydrogen 3.308 N/A ARG 40.A NH1 GLU 251.A OE1 no hydrogen 3.047 N/A ARG 40.A NH1 GLU 255.A OE1 no hydrogen 3.188 N/A ARG 40.A NH2 GLU 251.A OE2 no hydrogen 2.397 N/A LEU 41.A N HIS 38.A O no hydrogen 3.061 N/A SER 42.A N GLU 160.A OE1 no hydrogen 3.216 N/A SER 42.A OG GLU 160.A OE1 no hydrogen 3.464 N/A SER 42.A OG GLU 160.A OE2 no hydrogen 2.542 N/A ASN 46.A ND2 THR 152.A OG1 no hydrogen 3.114 N/A VAL 52.A N VAL 61.A O no hydrogen 3.105 N/A GLU 53.A N THR 81.A OG1 no hydrogen 2.921 N/A GLU 55.A N ASN 73.A O no hydrogen 3.111 N/A LYS 59.A N ALA 57.A O no hydrogen 2.888 N/A VAL 61.A N VAL 52.A O no hydrogen 2.986 N/A ALA 63.A N CYS 50.A O no hydrogen 3.381 N/A ALA 65.A N ALA 62.A O no hydrogen 3.121 N/A MET 66.A N ALA 62.A O no hydrogen 2.877 N/A VAL 68.A N THR 19.A O no hydrogen 2.961 N/A GLY 71.A N GLU 5.A O no hydrogen 2.924 N/A TRP 72.A N MET 69.A O no hydrogen 3.488 N/A ASN 73.A ND2 GLU 55.A OE2 no hydrogen 3.282 N/A ILE 74.A N PHE 7.A O no hydrogen 2.535 N/A LEU 75.A N GLU 53.A O no hydrogen 2.745 N/A THR 76.A N ASP 9.A OD1 no hydrogen 2.827 N/A THR 76.A OG1 ASP 9.A OD1 no hydrogen 3.247 N/A THR 76.A OG1 ASP 9.A OD2 no hydrogen 2.405 N/A SER 78.A OG GLU 53.A OE1 no hydrogen 2.717 N/A SER 78.A OG LEU 75.A O no hydrogen 3.493 N/A SER 78.A OG THR 81.A OG1 no hydrogen 2.874 N/A THR 81.A OG1 LEU 75.A O no hydrogen 2.915 N/A THR 81.A OG1 SER 78.A OG no hydrogen 2.874 N/A LYS 82.A N SER 78.A O no hydrogen 3.182 N/A LYS 83.A N GLU 79.A O no hydrogen 2.895 N/A ALA 84.A N LYS 80.A O no hydrogen 2.919 N/A ARG 85.A N THR 81.A O no hydrogen 2.951 N/A GLU 86.A N LYS 82.A O no hydrogen 2.933 N/A GLY 87.A N LYS 83.A O no hydrogen 2.957 N/A VAL 88.A N ALA 84.A O no hydrogen 2.980 N/A MET 89.A N ARG 85.A O no hydrogen 2.928 N/A GLU 90.A N GLU 86.A O no hydrogen 2.917 N/A PHE 91.A N GLY 87.A O no hydrogen 3.009 N/A LEU 92.A N VAL 88.A O no hydrogen 2.882 N/A LEU 93.A N MET 89.A O no hydrogen 2.946 N/A ASP 99.A N PRO 97.A O no hydrogen 2.881 N/A GLN 105.A NE2 GLU 108.A O no hydrogen 2.520 N/A GLY 106.A N CYS 103.A O no hydrogen 3.441 N/A GLY 107.A N GLN 112.A OE1 no hydrogen 3.162 N/A GLU 108.A N GLN 105.A O no hydrogen 2.969 N/A CYS 109.A SG PRO 199.A O no hydrogen 3.862 N/A ASP 110.A N PRO 199.A O no hydrogen 3.273 N/A ASP 113.A N CYS 109.A O no hydrogen 3.046 N/A GLN 114.A N ASP 110.A O no hydrogen 2.914 N/A GLN 114.A NE2 ARG 34.A O no hydrogen 2.727 N/A SER 115.A N LEU 111.A O no hydrogen 2.959 N/A MET 116.A N GLN 112.A O no hydrogen 2.946 N/A MET 117.A N ASP 113.A O no hydrogen 2.892 N/A PHE 118.A N GLN 114.A O no hydrogen 2.926 N/A GLY 119.A N SER 115.A O no hydrogen 3.102 N/A SER 120.A OG ASP 121.A OD1 no hydrogen 3.352 N/A ARG 122.A NE ASP 121.A OD1 no hydrogen 3.214 N/A ARG 122.A NH2 ASP 121.A OD2 no hydrogen 3.443 N/A ARG 124.A NE GLU 90.A OE2 no hydrogen 2.568 N/A ARG 124.A NH2 GLU 90.A OE1 no hydrogen 2.913 N/A ARG 124.A NH2 GLU 90.A OE2 no hydrogen 2.908 N/A PHE 125.A N SER 123.A OG no hydrogen 2.898 N/A LYS 129.A NZ LEU 93.A O no hydrogen 3.358 N/A LYS 129.A NZ ALA 94.A O no hydrogen 2.394 N/A ARG 130.A NH1 ASN 174.A O no hydrogen 2.627 N/A ARG 130.A NH2 GLN 150.A OE1 no hydrogen 3.053 N/A VAL 132.A N THR 146.A OG1 no hydrogen 3.258 N/A LYS 135.A NZ GLU 133.A O no hydrogen 2.985 N/A LYS 135.A NZ GLN 177.A OE1 no hydrogen 3.154 N/A LYS 142.A N THR 204.A O no hydrogen 2.863 N/A ILE 144.A N ALA 202.A O no hydrogen 3.111 N/A MET 145.A N ASP 134.A OD1 no hydrogen 2.998 N/A THR 146.A OG1 VAL 132.A O no hydrogen 3.209 N/A ARG 147.A N ILE 144.A O no hydrogen 3.384 N/A ARG 147.A NE ASP 99.A OD2 no hydrogen 3.345 N/A ARG 147.A NH1 GLY 201.A O no hydrogen 3.184 N/A ARG 147.A NH2 ILE 102.A O no hydrogen 3.466 N/A CYS 148.A N MET 145.A O no hydrogen 3.337 N/A GLN 150.A NE2 MET 176.A O no hydrogen 3.546 N/A CYS 151.A SG PHE 35.A O no hydrogen 3.970 N/A THR 152.A OG1 CYS 151.A O no hydrogen 2.627 N/A ARG 153.A NH1 ILE 197.A O no hydrogen 3.274 N/A ARG 153.A NH2 TYR 37.A O no hydrogen 2.555 N/A ARG 156.A NE THR 152.A O no hydrogen 2.621 N/A ARG 156.A NH1 CYS 36.A O no hydrogen 2.953 N/A ARG 156.A NH1 SER 42.A O no hydrogen 2.563 N/A ARG 156.A NH2 CYS 36.A O no hydrogen 2.457 N/A ARG 156.A NH2 CYS 151.A O no hydrogen 2.949 N/A PHE 157.A N ARG 153.A O no hydrogen 2.927 N/A ALA 158.A N CYS 154.A O no hydrogen 2.917 N/A SER 159.A N ILE 155.A O no hydrogen 2.860 N/A SER 159.A OG ASP 165.A OD1 no hydrogen 2.645 N/A GLU 160.A N ARG 156.A O no hydrogen 2.932 N/A GLU 160.A N PHE 157.A O no hydrogen 3.303 N/A ILE 161.A N PHE 157.A O no hydrogen 2.911 N/A ALA 162.A N PHE 157.A O no hydrogen 2.851 N/A VAL 164.A N ALA 158.A O no hydrogen 2.519 N/A ASP 165.A N ALA 158.A O no hydrogen 3.098 N/A GLY 168.A N GLY 179.A O no hydrogen 2.851 N/A THR 170.A N GLN 177.A O no hydrogen 2.805 N/A THR 170.A OG1 GLN 177.A O no hydrogen 3.453 N/A ASN 174.A ND2 ASN 174.A O no hydrogen 2.900 N/A MET 176.A N GLY 173.A O no hydrogen 3.256 N/A GLN 177.A N THR 170.A O no hydrogen 2.663 N/A GLY 179.A N GLY 168.A O no hydrogen 2.857 N/A THR 180.A OG1 ILE 182.A O no hydrogen 2.426 N/A SER 188.A OG GLU 189.A OE1 no hydrogen 2.905 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.670 N/A LEU 190.A N SER 188.A OG no hydrogen 3.370 N/A SER 191.A N ASP 260.A OD2 no hydrogen 3.263 N/A SER 191.A OG SER 188.A O no hydrogen 3.367 N/A SER 191.A OG ASP 260.A OD2 no hydrogen 2.356 N/A ASN 193.A N LEU 190.A O no hydrogen 3.397 N/A ASN 193.A ND2 ILE 258.A O no hydrogen 2.905 N/A ILE 195.A N GLY 192.A O no hydrogen 3.292 N/A ILE 197.A N ASN 193.A O no hydrogen 2.984 N/A CYS 198.A N ILE 194.A O no hydrogen 3.061 N/A CYS 198.A SG VAL 200.A O no hydrogen 3.222 N/A THR 204.A N LYS 142.A O no hydrogen 3.004 N/A LYS 206.A N LEU 140.A O no hydrogen 2.870 N/A LYS 206.A NZ GLY 138.A O no hydrogen 3.236 N/A TYR 208.A N SER 205.A OG no hydrogen 3.414 N/A PHE 210.A N ASP 104.A OD1 no hydrogen 3.124 N/A THR 211.A N TYR 208.A O no hydrogen 3.219 N/A THR 211.A OG1 TYR 208.A O no hydrogen 2.638 N/A ARG 213.A NH1 CYS 103.A O no hydrogen 2.481 N/A ARG 213.A NH1 GLY 106.A O no hydrogen 3.235 N/A ARG 213.A NH2 PRO 101.A O no hydrogen 2.472 N/A THR 217.A N PRO 214.A O no hydrogen 3.426 N/A THR 217.A OG1 PRO 214.A O no hydrogen 2.708 N/A ARG 218.A N THR 237.A O no hydrogen 2.467 N/A LYS 219.A NZ THR 217.A O no hydrogen 3.241 N/A THR 220.A N VAL 235.A O no hydrogen 2.989 N/A SER 222.A N ILE 233.A O no hydrogen 2.790 N/A SER 222.A OG ILE 223.A O no hydrogen 3.500 N/A ILE 223.A N SER 222.A OG no hydrogen 2.507 N/A ASP 224.A N SER 231.A O no hydrogen 2.581 N/A MET 226.A N ASP 224.A OD1 no hydrogen 2.727 N/A ILE 233.A N SER 222.A O no hydrogen 2.952 N/A VAL 234.A N LEU 246.A O no hydrogen 2.605 N/A VAL 235.A N THR 220.A O no hydrogen 2.683 N/A THR 237.A N ARG 218.A O no hydrogen 2.839 N/A THR 237.A OG1 ARG 218.A O no hydrogen 3.400 N/A ARG 238.A N GLU 241.A O no hydrogen 2.951 N/A ARG 238.A NH2 THR 211.A O no hydrogen 3.333 N/A THR 239.A OG1 ARG 238.A O no hydrogen 2.633 N/A GLU 241.A N ARG 238.A O no hydrogen 3.363 N/A MET 243.A N SER 236.A O no hydrogen 2.993 N/A ARG 244.A N SER 236.A O no hydrogen 3.495 N/A ARG 244.A NH1 GLU 108.A OE1 no hydrogen 3.508 N/A ARG 244.A NH1 GLU 108.A OE2 no hydrogen 2.939 N/A ARG 244.A NH2 GLU 108.A OE1 no hydrogen 2.815 N/A LEU 246.A N VAL 234.A O no hydrogen 2.860 N/A ARG 248.A N ASN 232.A O no hydrogen 2.709 N/A ARG 248.A NE ILE 233.A O no hydrogen 3.190 N/A ARG 248.A NH2 SER 222.A O no hydrogen 3.044 N/A HIS 250.A N GLU 255.A O no hydrogen 2.949 N/A HIS 250.A NE2 ASP 629.A OD1 no hydrogen 2.582 N/A HIS 250.A NE2 ASP 629.A OD2 no hydrogen 3.329 N/A ASP 252.A N HIS 250.A ND1 no hydrogen 3.375 N/A ILE 253.A N HIS 250.A O no hydrogen 3.238 N/A ASN 254.A N HIS 250.A O no hydrogen 3.302 N/A ASN 254.A ND2 ASN 232.A O no hydrogen 3.226 N/A TRP 257.A N ASN 254.A O no hydrogen 2.476 N/A ILE 258.A N ASN 193.A OD1 no hydrogen 3.281 N/A SER 259.A OG THR 262.A OG1 no hydrogen 3.052 N/A ASP 260.A N GLU 189.A O no hydrogen 2.950 N/A LYS 261.A NZ THR 669.A OG1 no hydrogen 2.846 N/A THR 262.A N SER 259.A OG no hydrogen 3.353 N/A THR 262.A OG1 ASP 224.A OD2 no hydrogen 2.340 N/A THR 262.A OG1 SER 259.A OG no hydrogen 3.052 N/A ARG 263.A N SER 259.A O no hydrogen 2.955 N/A ARG 263.A NH1 ASP 196.A OD1 no hydrogen 2.926 N/A ARG 263.A NH2 ASN 193.A OD1 no hydrogen 2.376 N/A ARG 263.A NH2 ASP 196.A OD2 no hydrogen 2.373 N/A PHE 264.A N ASP 260.A O no hydrogen 2.928 N/A ALA 265.A N LYS 261.A O no hydrogen 2.944 N/A TYR 266.A OH MET 243.A O no hydrogen 3.178 N/A LYS 270.A NZ GLU 241.A OE2 no hydrogen 3.202 N/A LYS 270.A NZ VAL 242.A O no hydrogen 3.178 N/A ARG 271.A N GLY 268.A O no hydrogen 3.467 N/A ARG 271.A NH1 ALA 675.A O no hydrogen 2.485 N/A ARG 273.A NE HIS 543.A O no hydrogen 3.061 N/A ARG 273.A NH1 LEU 269.A O no hydrogen 2.794 N/A ARG 273.A NH1 GLU 563.A OE2 no hydrogen 2.706 N/A ARG 273.A NH2 GLU 563.A OE1 no hydrogen 2.718 N/A ARG 273.A NH2 GLU 563.A OE2 no hydrogen 3.186 N/A LEU 274.A N HIS 543.A O no hydrogen 3.011 N/A MET 278.A N ILE 555.A O no hydrogen 3.113 N/A VAL 279.A N THR 287.A O no hydrogen 3.100 N/A ARG 280.A N ASP 553.A O no hydrogen 3.245 N/A ARG 280.A NE ALA 552.A O no hydrogen 2.812 N/A ARG 280.A NH1 GLY 284.A O no hydrogen 3.067 N/A ARG 280.A NH2 PRO 550.A O no hydrogen 2.769 N/A ARG 280.A NH2 ALA 552.A O no hydrogen 3.072 N/A ASN 281.A N LEU 285.A O no hydrogen 2.936 N/A GLU 282.A N GLU 282.A OE1 no hydrogen 2.721 N/A GLY 284.A N ASN 281.A O no hydrogen 3.170 N/A LEU 285.A N ASN 281.A OD1 no hydrogen 2.669 N/A THR 287.A N VAL 279.A O no hydrogen 2.947 N/A THR 289.A N PRO 277.A O no hydrogen 2.880 N/A THR 289.A OG1 ASP 293.A OD2 no hydrogen 3.078 N/A THR 290.A OG1 GLU 292.A OE1 no hydrogen 3.307 N/A TRP 291.A NE1 LEU 587.A O no hydrogen 2.841 N/A GLU 292.A N GLU 292.A OE1 no hydrogen 2.928 N/A ASP 293.A N THR 290.A OG1 no hydrogen 3.336 N/A ALA 294.A N THR 290.A O no hydrogen 3.189 N/A LEU 295.A N TRP 291.A O no hydrogen 2.936 N/A SER 296.A N GLU 292.A O no hydrogen 2.911 N/A SER 296.A OG GLU 292.A O no hydrogen 2.714 N/A ARG 297.A N ASP 293.A O no hydrogen 2.935 N/A ARG 297.A NH1 ARG 280.A O no hydrogen 3.404 N/A VAL 298.A N ALA 294.A O no hydrogen 2.986 N/A ALA 299.A N LEU 295.A O no hydrogen 2.899 N/A GLY 300.A N SER 296.A O no hydrogen 2.884 N/A LEU 302.A N VAL 298.A O no hydrogen 2.904 N/A GLN 303.A N ALA 299.A O no hydrogen 2.914 N/A GLN 303.A NE2 ALA 602.A O no hydrogen 2.499 N/A SER 304.A OG MET 301.A O no hydrogen 2.825 N/A CYS 305.A N LEU 302.A O no hydrogen 3.242 N/A CYS 305.A SG MET 301.A O no hydrogen 3.256 N/A CYS 305.A SG ASP 309.A O no hydrogen 3.752 N/A ASN 308.A ND2 THR 337.A OG1 no hydrogen 3.126 N/A ALA 311.A N MET 516.A O no hydrogen 2.987 N/A ALA 312.A N THR 337.A O no hydrogen 3.092 N/A ILE 313.A N PHE 518.A O no hydrogen 2.759 N/A ALA 314.A N CYS 339.A O no hydrogen 2.745 N/A GLY 315.A N LEU 520.A O no hydrogen 2.594 N/A ALA 320.A N THR 567.A O no hydrogen 2.912 N/A GLU 321.A N GLU 321.A OE1 no hydrogen 2.805 N/A LEU 323.A N ASP 319.A O no hydrogen 3.119 N/A ILE 324.A N ALA 320.A O no hydrogen 2.944 N/A ALA 325.A N GLU 321.A O no hydrogen 2.881 N/A LEU 326.A N ALA 322.A O no hydrogen 2.929 N/A LYS 327.A N LEU 323.A O no hydrogen 2.925 N/A LYS 327.A NZ LEU 500.A O no hydrogen 2.362 N/A ASP 328.A N ILE 324.A O no hydrogen 2.910 N/A LEU 329.A N ALA 325.A O no hydrogen 2.953 N/A LEU 330.A N LEU 326.A O no hydrogen 2.931 N/A ASN 331.A N LYS 327.A O no hydrogen 2.902 N/A ARG 332.A N ASP 328.A O no hydrogen 2.998 N/A ARG 332.A N LEU 329.A O no hydrogen 3.113 N/A VAL 333.A N LEU 330.A O no hydrogen 3.318 N/A ASP 334.A N ASN 331.A O no hydrogen 3.040 N/A SER 335.A N LEU 330.A O no hydrogen 2.860 N/A SER 335.A OG GLY 307.A O no hydrogen 3.317 N/A SER 335.A OG VAL 310.A O no hydrogen 2.607 N/A LEU 338.A N ASP 336.A O no hydrogen 2.689 N/A CYS 339.A N ALA 312.A O no hydrogen 2.689 N/A CYS 339.A SG GLY 505.A O no hydrogen 3.359 N/A THR 340.A OG1 GLU 342.A O no hydrogen 3.207 N/A GLU 341.A N ALA 314.A O no hydrogen 3.344 N/A ASP 352.A N ALA 349.A O no hydrogen 3.272 N/A ARG 354.A NE ASP 499.A OD1 no hydrogen 2.964 N/A ARG 354.A NE ASP 499.A OD2 no hydrogen 3.511 N/A ARG 354.A NH1 GLU 632.A O no hydrogen 3.473 N/A ARG 354.A NH2 ASP 499.A OD2 no hydrogen 3.459 N/A SER 355.A OG ASN 635.A O no hydrogen 3.020 N/A ASN 356.A ND2 GLY 350.A O no hydrogen 3.195 N/A TYR 357.A N ARG 354.A O no hydrogen 3.236 N/A TYR 357.A OH ASP 499.A OD1 no hydrogen 2.286 N/A LEU 359.A N THR 571.A O no hydrogen 2.735 N/A ASN 360.A ND2 SER 355.A O no hydrogen 2.390 N/A ASN 360.A ND2 MET 485.A O no hydrogen 2.997 N/A THR 361.A N ASN 486.A OD1 no hydrogen 2.750 N/A THR 361.A OG1 LYS 483.A O no hydrogen 2.902 N/A THR 362.A OG1 THR 361.A O no hydrogen 3.053 N/A ILE 363.A N GLU 572.A OE1 no hydrogen 2.605 N/A VAL 366.A N ILE 363.A O no hydrogen 3.336 N/A GLU 367.A N ALA 364.A O no hydrogen 3.253 N/A GLU 368.A N GLY 365.A O no hydrogen 3.167 N/A ALA 369.A N VAL 366.A O no hydrogen 3.245 N/A ASP 370.A N LYS 443.A O no hydrogen 3.221 N/A VAL 372.A N LYS 400.A O no hydrogen 2.793 N/A LEU 373.A N MET 445.A O no hydrogen 2.906 N/A LEU 374.A N ALA 402.A O no hydrogen 2.711 N/A VAL 375.A N VAL 447.A O no hydrogen 2.720 N/A GLY 376.A N ILE 404.A O no hydrogen 2.717 N/A THR 377.A OG1 GLU 382.A OE1 no hydrogen 2.324 N/A ASN 378.A ND2 GLN 660.A O no hydrogen 2.365 N/A ASN 378.A ND2 LEU 661.A O no hydrogen 3.629 N/A ARG 380.A NE GLU 189.A OE1 no hydrogen 2.796 N/A ARG 380.A NH2 GLU 189.A OE1 no hydrogen 3.324 N/A PHE 381.A N ASN 378.A O no hydrogen 3.179 N/A GLU 382.A N ASN 378.A O no hydrogen 2.973 N/A ALA 383.A N PRO 379.A O no hydrogen 3.393 N/A ASN 387.A N ALA 383.A O no hydrogen 3.073 N/A ASN 387.A ND2 LEU 410.A O no hydrogen 3.061 N/A ALA 388.A N PRO 384.A O no hydrogen 2.934 N/A ARG 389.A N LEU 385.A O no hydrogen 2.934 N/A ARG 389.A NH1 GLU 251.A O no hydrogen 3.500 N/A ARG 389.A NH2 GLU 251.A O no hydrogen 3.137 N/A ILE 390.A N PHE 386.A O no hydrogen 2.980 N/A ARG 391.A N ASN 387.A O no hydrogen 2.864 N/A ARG 391.A NE GLU 160.A O no hydrogen 2.612 N/A ARG 391.A NH2 SER 159.A O no hydrogen 2.941 N/A ARG 391.A NH2 GLU 160.A O no hydrogen 3.537 N/A LYS 392.A N ALA 388.A O no hydrogen 2.938 N/A LYS 392.A NZ GLU 255.A OE2 no hydrogen 2.382 N/A SER 393.A N ARG 389.A O no hydrogen 2.976 N/A SER 393.A OG GLU 367.A OE2 no hydrogen 2.710 N/A SER 393.A OG ARG 389.A O no hydrogen 3.113 N/A TRP 394.A N ILE 390.A O no hydrogen 2.801 N/A TRP 394.A NE1 ARG 413.A O no hydrogen 3.009 N/A LEU 395.A N ARG 391.A O no hydrogen 2.872 N/A HIS 396.A N LYS 392.A O no hydrogen 2.949 N/A ASN 397.A N SER 393.A O no hydrogen 3.030 N/A LEU 399.A N SER 393.A O no hydrogen 3.345 N/A LYS 400.A N ASP 370.A O no hydrogen 3.250 N/A ALA 402.A N VAL 372.A O no hydrogen 2.737 N/A LEU 403.A N ASP 415.A O no hydrogen 3.217 N/A ILE 404.A N LEU 374.A O no hydrogen 2.721 N/A GLY 405.A N GLY 418.A O no hydrogen 2.884 N/A VAL 408.A N SER 406.A O no hydrogen 2.701 N/A THR 411.A N ASP 409.A OD1 no hydrogen 3.200 N/A THR 411.A OG1 LEU 410.A O no hydrogen 2.484 N/A TYR 414.A OH VAL 408.A O no hydrogen 2.536 N/A ASP 415.A N VAL 401.A O no hydrogen 2.913 N/A HIS 416.A NE2 GLY 405.A O no hydrogen 2.715 N/A LEU 417.A N LEU 403.A O no hydrogen 3.037 N/A ILE 423.A N SER 420.A O no hydrogen 3.310 N/A LEU 424.A N PRO 421.A O no hydrogen 3.101 N/A ASP 426.A N LYS 422.A O no hydrogen 2.942 N/A ILE 427.A N ILE 423.A O no hydrogen 2.886 N/A ALA 428.A N LEU 424.A O no hydrogen 3.195 N/A SER 429.A N ASP 426.A O no hydrogen 3.208 N/A SER 429.A OG GLN 425.A O no hydrogen 3.505 N/A SER 429.A OG ASP 426.A O no hydrogen 2.882 N/A SER 429.A OG SER 431.A OG no hydrogen 3.283 N/A GLY 430.A N ASP 426.A O no hydrogen 2.978 N/A SER 431.A OG SER 429.A OG no hydrogen 3.283 N/A SER 435.A N HIS 432.A O no hydrogen 3.169 N/A SER 435.A OG ILE 427.A O no hydrogen 3.069 N/A GLN 436.A NE2 GLY 430.A O no hydrogen 2.588 N/A LEU 438.A N PHE 434.A O no hydrogen 2.959 N/A GLN 439.A N SER 435.A O no hydrogen 2.897 N/A GLN 439.A NE2 LYS 471.A O no hydrogen 3.583 N/A GLU 440.A N GLN 436.A O no hydrogen 2.949 N/A LYS 442.A N ASP 370.A OD2 no hydrogen 2.978 N/A LYS 443.A N ASP 370.A OD1 no hydrogen 3.157 N/A VAL 446.A N VAL 484.A O no hydrogen 3.030 N/A VAL 447.A N LEU 373.A O no hydrogen 2.681 N/A LEU 448.A N ASN 486.A O no hydrogen 2.885 N/A GLY 449.A N VAL 375.A O no hydrogen 2.947 N/A SER 450.A N LEU 488.A O no hydrogen 2.958 N/A SER 450.A OG GLU 342.A OE2 no hydrogen 2.548 N/A SER 451.A OG GLY 376.A O no hydrogen 3.358 N/A SER 451.A OG GLU 382.A OE2 no hydrogen 2.488 N/A ALA 452.A N GLY 449.A O no hydrogen 3.157 N/A GLN 454.A N SER 451.A O no hydrogen 3.424 N/A ILE 461.A N ASP 457.A O no hydrogen 3.131 N/A LEU 462.A N GLY 458.A O no hydrogen 2.928 N/A ALA 463.A N ALA 459.A O no hydrogen 2.919 N/A ALA 464.A N ALA 460.A O no hydrogen 2.915 N/A VAL 465.A N ILE 461.A O no hydrogen 2.955 N/A SER 466.A N LEU 462.A O no hydrogen 2.920 N/A ASN 467.A N ALA 463.A O no hydrogen 2.856 N/A ILE 468.A N ALA 464.A O no hydrogen 2.948 N/A ALA 469.A N VAL 465.A O no hydrogen 2.963 N/A GLN 470.A N SER 466.A O no hydrogen 2.913 N/A GLN 470.A NE2 GLN 638.A OE1 no hydrogen 3.353 N/A LYS 471.A N ASN 467.A O no hydrogen 2.862 N/A ILE 472.A N ILE 468.A O no hydrogen 2.955 N/A ARG 473.A N ALA 469.A O no hydrogen 2.918 N/A ARG 473.A NH2 GLY 480.A O no hydrogen 2.651 N/A THR 474.A N GLN 470.A O no hydrogen 3.283 N/A THR 474.A OG1 GLN 470.A O no hydrogen 2.431 N/A SER 475.A N ILE 472.A O no hydrogen 3.214 N/A SER 475.A OG GLN 439.A OE1 no hydrogen 3.475 N/A SER 475.A OG LYS 471.A O no hydrogen 2.325 N/A SER 475.A OG ILE 472.A O no hydrogen 3.380 N/A SER 476.A N ILE 472.A O no hydrogen 2.791 N/A SER 476.A OG GLN 439.A O no hydrogen 2.327 N/A GLY 477.A N SER 476.A OG no hydrogen 2.514 N/A TRP 482.A NE1 PRO 444.A O no hydrogen 2.366 N/A LYS 483.A NZ ALA 634.A O no hydrogen 3.275 N/A ASN 486.A ND2 THR 361.A OG1 no hydrogen 2.632 N/A ILE 487.A N LEU 358.A O no hydrogen 2.917 N/A LEU 488.A N LEU 448.A O no hydrogen 2.993 N/A HIS 489.A N THR 571.A OG1 no hydrogen 2.849 N/A HIS 489.A NE2 TYR 357.A O no hydrogen 2.521 N/A ARG 490.A NE GLU 342.A OE2 no hydrogen 3.300 N/A SER 493.A N GLY 316.A O no hydrogen 3.194 N/A SER 493.A OG GLY 315.A O no hydrogen 2.557 N/A GLN 494.A N ILE 491.A O no hydrogen 3.446 N/A GLN 494.A NE2 GLU 342.A O no hydrogen 3.623 N/A ALA 497.A N SER 493.A O no hydrogen 3.140 N/A LEU 498.A N GLN 494.A O no hydrogen 2.907 N/A ASP 499.A N VAL 495.A O no hydrogen 2.893 N/A LEU 500.A N ALA 496.A O no hydrogen 3.035 N/A GLY 501.A N LEU 498.A O no hydrogen 3.346 N/A TYR 502.A N ALA 497.A O no hydrogen 2.884 N/A TYR 502.A OH LEU 323.A O no hydrogen 2.397 N/A LYS 503.A N LEU 338.A O no hydrogen 2.937 N/A GLY 505.A N THR 340.A OG1 no hydrogen 3.343 N/A GLU 507.A N GLU 507.A OE1 no hydrogen 2.803 N/A ILE 509.A N VAL 506.A O no hydrogen 3.262 N/A ARG 510.A N VAL 506.A O no hydrogen 3.290 N/A LYS 511.A N GLU 507.A O no hydrogen 2.904 N/A LYS 515.A N ASP 309.A O no hydrogen 2.955 N/A LYS 515.A NZ SER 304.A O no hydrogen 3.037 N/A LEU 517.A N PHE 537.A O no hydrogen 2.979 N/A PHE 518.A N ALA 311.A O no hydrogen 2.832 N/A LEU 519.A N VAL 539.A O no hydrogen 2.810 N/A LEU 520.A N ILE 313.A O no hydrogen 2.925 N/A GLY 521.A N GLN 541.A O no hydrogen 2.732 N/A GLY 524.A N GLU 341.A OE2 no hydrogen 2.637 N/A ARG 529.A NE ILE 551.A O no hydrogen 2.794 N/A ARG 529.A NH1 CYS 536.A O no hydrogen 3.192 N/A ARG 529.A NH2 ILE 551.A O no hydrogen 2.827 N/A ASP 531.A N THR 528.A O no hydrogen 2.978 N/A CYS 536.A SG PRO 514.A O no hydrogen 3.561 N/A PHE 537.A N LYS 515.A O no hydrogen 3.241 N/A VAL 539.A N LEU 517.A O no hydrogen 2.707 N/A TYR 540.A N VAL 554.A O no hydrogen 3.201 N/A TYR 540.A OH ASP 523.A OD1 no hydrogen 3.037 N/A TYR 540.A OH ASP 523.A OD2 no hydrogen 2.635 N/A TYR 540.A OH HIS 544.A O no hydrogen 3.079 N/A GLN 541.A N LEU 519.A O no hydrogen 2.873 N/A GLN 541.A NE2 ASP 591.A O no hydrogen 2.896 N/A GLN 541.A NE2 ASP 591.A OD1 no hydrogen 3.455 N/A GLY 542.A N LEU 556.A O no hydrogen 3.129 N/A HIS 543.A ND1 HIS 544.A ND1 no hydrogen 3.002 N/A HIS 544.A ND1 HIS 543.A ND1 no hydrogen 3.002 N/A HIS 544.A NE2 GLY 268.A O no hydrogen 2.356 N/A GLY 545.A N GLN 272.A O no hydrogen 3.227 N/A GLY 548.A N ASP 523.A OD1 no hydrogen 2.774 N/A ALA 552.A N ALA 549.A O no hydrogen 3.293 N/A ASP 553.A N ILE 538.A O no hydrogen 2.728 N/A VAL 554.A N ILE 538.A O no hydrogen 3.472 N/A ILE 555.A N MET 278.A O no hydrogen 2.766 N/A LEU 556.A N TYR 540.A O no hydrogen 2.846 N/A GLY 558.A N GLY 542.A O no hydrogen 2.578 N/A ALA 560.A N GLU 563.A OE1 no hydrogen 2.975 N/A GLU 563.A N ALA 560.A O no hydrogen 2.971 N/A LYS 564.A NZ ALA 559.A O no hydrogen 3.036 N/A LYS 564.A NZ TYR 568.A OH no hydrogen 3.544 N/A SER 565.A OG THR 578.A O no hydrogen 3.086 N/A THR 567.A N GLU 321.A OE1 no hydrogen 2.843 N/A THR 567.A N GLU 321.A OE2 no hydrogen 3.016 N/A THR 567.A OG1 GLU 321.A OE2 no hydrogen 2.839 N/A THR 567.A OG1 TYR 628.A OH no hydrogen 2.869 N/A TYR 568.A N GLN 576.A O no hydrogen 2.596 N/A TYR 568.A OH LEU 317.A O no hydrogen 3.356 N/A ASN 570.A N ARG 574.A O no hydrogen 3.167 N/A ASN 570.A ND2 VAL 229.A O no hydrogen 3.227 N/A ASN 570.A ND2 GLU 572.A OE2 no hydrogen 3.448 N/A THR 571.A N ALA 228.A O no hydrogen 2.633 N/A GLU 572.A N ASN 570.A OD1 no hydrogen 3.418 N/A GLY 573.A N ASN 570.A O no hydrogen 3.490 N/A ARG 574.A N ASN 570.A OD1 no hydrogen 2.805 N/A GLN 576.A N TYR 568.A O no hydrogen 2.751 N/A THR 578.A N ALA 566.A O no hydrogen 2.873 N/A THR 578.A OG1 LYS 564.A O no hydrogen 2.584 N/A THR 578.A OG1 ALA 566.A O no hydrogen 3.457 N/A ALA 581.A N THR 562.A O no hydrogen 3.008 N/A VAL 582.A N THR 562.A O no hydrogen 3.240 N/A LEU 587.A N THR 275.A O no hydrogen 2.709 N/A ALA 588.A N PRO 585.A O no hydrogen 3.314 N/A ARG 589.A N PRO 557.A O no hydrogen 3.174 N/A ARG 589.A NH1 ALA 588.A O no hydrogen 3.340 N/A TRP 592.A NE1 GLU 590.A OE2 no hydrogen 2.862 N/A ILE 594.A N GLU 590.A O no hydrogen 3.178 N/A ILE 595.A N ASP 591.A O no hydrogen 3.058 N/A ARG 596.A N TRP 592.A O no hydrogen 2.857 N/A ARG 596.A NE TYR 608.A O no hydrogen 2.655 N/A ARG 596.A NH1 ARG 596.A O no hydrogen 3.288 N/A ARG 596.A NH1 GLU 600.A OE1 no hydrogen 3.069 N/A ARG 596.A NH2 ASP 609.A OD1 no hydrogen 2.412 N/A ALA 597.A N LYS 593.A O no hydrogen 2.896 N/A LEU 598.A N ILE 594.A O no hydrogen 2.889 N/A SER 599.A N ILE 595.A O no hydrogen 2.921 N/A SER 599.A OG ARG 596.A O no hydrogen 2.529 N/A GLU 600.A N ARG 596.A O no hydrogen 2.979 N/A ILE 601.A N ALA 597.A O no hydrogen 2.959 N/A ALA 602.A N LEU 598.A O no hydrogen 2.949 N/A MET 604.A N SER 599.A O no hydrogen 2.981 N/A LEU 606.A N SER 599.A OG no hydrogen 3.342 N/A TYR 608.A N LEU 606.A O no hydrogen 2.748 N/A ASP 609.A N GLN 613.A OE1 no hydrogen 2.589 N/A GLN 613.A N THR 610.A O no hydrogen 3.203 N/A VAL 614.A N THR 610.A O no hydrogen 3.211 N/A ARG 615.A N LEU 611.A O no hydrogen 2.961 N/A ARG 615.A NE GLU 321.A OE2 no hydrogen 3.141 N/A ARG 615.A NH2 GLU 321.A OE2 no hydrogen 3.433 N/A ARG 615.A NH2 SER 565.A OG no hydrogen 3.229 N/A ASN 616.A N ASP 612.A O no hydrogen 2.867 N/A ARG 617.A N GLN 613.A O no hydrogen 2.992 N/A ARG 617.A NE ASP 328.A OD1 no hydrogen 3.277 N/A ARG 617.A NE ASP 328.A OD2 no hydrogen 2.811 N/A ARG 617.A NH2 ASP 328.A OD1 no hydrogen 2.802 N/A LEU 618.A N VAL 614.A O no hydrogen 2.860 N/A GLU 619.A N ARG 615.A O no hydrogen 2.880 N/A GLU 620.A N ASN 616.A O no hydrogen 2.970 N/A VAL 621.A N ARG 617.A O no hydrogen 2.990 N/A SER 622.A N LEU 618.A O no hydrogen 3.165 N/A SER 622.A OG ASN 624.A OD1 no hydrogen 3.245 N/A LEU 625.A N SER 622.A O no hydrogen 3.235 N/A TYR 628.A OH THR 567.A OG1 no hydrogen 2.869 N/A ASP 629.A N ALA 575.A O no hydrogen 2.822 N/A TYR 636.A N ASN 635.A OD1 no hydrogen 2.811 N/A GLN 638.A NE2 GLU 642.A OE2 no hydrogen 3.428 N/A ALA 640.A N TYR 636.A O no hydrogen 3.454 N/A SER 641.A N PHE 637.A O no hydrogen 2.910 N/A GLU 642.A N GLN 638.A O no hydrogen 2.908 N/A LEU 643.A N GLN 639.A O no hydrogen 2.939 N/A SER 644.A N ALA 640.A O no hydrogen 2.931 N/A SER 644.A OG ALA 640.A O no hydrogen 3.430 N/A SER 644.A OG SER 641.A O no hydrogen 2.558 N/A LYS 645.A N SER 641.A O no hydrogen 3.198 N/A GLN 650.A N GLN 649.A OE1 no hydrogen 3.165 N/A LEU 652.A N ASP 457.A OD2 no hydrogen 2.459 N/A LEU 656.A N ASP 419.A O no hydrogen 2.867 N/A ASP 665.A N THR 662.A O no hydrogen 3.310 N/A PHE 666.A N ILE 663.A O no hydrogen 3.280 N/A SER 673.A N ASP 670.A OD1 no hydrogen 3.340 N/A SER 673.A OG ASP 670.A OD1 no hydrogen 2.833 N/A ARG 674.A N ASP 670.A O no hydrogen 2.934 N/A ARG 674.A NE ASP 546.A OD2 no hydrogen 2.570 N/A ARG 674.A NH2 ASP 546.A OD2 no hydrogen 3.030 N/A SER 676.A N SER 673.A O no hydrogen 3.143 N/A SER 676.A OG ASP 267.A OD1 no hydrogen 2.504 N/A THR 678.A N ASP 267.A OD2 no hydrogen 3.290 N/A THR 678.A OG1 ASP 267.A OD2 no hydrogen 2.386 N/A MET 679.A N SER 676.A OG no hydrogen 3.214 N/A ALA 680.A N SER 676.A O no hydrogen 3.147 N/A LYS 681.A N GLN 677.A O no hydrogen 2.930 N/A LYS 681.A NZ GLN 677.A O no hydrogen 3.304 N/A CYS 682.A N THR 678.A O no hydrogen 2.909 N/A CYS 682.A SG THR 678.A O no hydrogen 3.250 N/A VAL 683.A N MET 679.A O no hydrogen 2.920 N/A LYS 684.A N ALA 680.A O no hydrogen 2.959 N/A ALA 685.A N LYS 681.A O no hydrogen 2.875 N/A VAL 686.A N CYS 682.A O no hydrogen 2.927 N/A THR 687.A N VAL 683.A O no hydrogen 2.985 N/A THR 687.A OG1 VAL 683.A O no hydrogen 3.138 N/A THR 687.A OG1 LYS 684.A O no hydrogen 3.017 N/A GLU 688.A N LYS 684.A O no hydrogen 3.318 N/A