Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hfz_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LEU 158.A O no hydrogen 2.939 N/A VAL 3.A N LEU 156.A O no hydrogen 2.640 N/A PHE 5.A N VAL 154.A O no hydrogen 3.006 N/A SER 6.A N GLU 153.A OE1 no hydrogen 3.386 N/A SER 6.A N GLU 153.A OE2 no hydrogen 2.766 N/A SER 6.A OG GLU 153.A OE2 no hydrogen 2.162 N/A TRP 7.A N PRO 4.A O no hydrogen 3.039 N/A TRP 7.A NE1 TYR 11.A OH no hydrogen 2.595 N/A LEU 8.A N PRO 4.A O no hydrogen 3.006 N/A LYS 9.A N PHE 5.A O no hydrogen 2.961 N/A LYS 9.A NZ PRO 13.A O no hydrogen 3.160 N/A LYS 9.A NZ LEU 15.A O no hydrogen 3.241 N/A ALA 10.A N TRP 7.A O no hydrogen 2.620 N/A TYR 11.A N LEU 8.A O no hydrogen 3.368 N/A TYR 11.A OH GLU 255.A OE1 no hydrogen 3.184 N/A VAL 12.A N LEU 8.A O no hydrogen 3.104 N/A LEU 15.A N VAL 12.A O no hydrogen 3.224 N/A SER 17.A OG GLU 19.A OE1 no hydrogen 3.288 N/A VAL 20.A N SER 17.A OG no hydrogen 3.396 N/A LEU 21.A N SER 17.A O no hydrogen 2.897 N/A GLU 22.A N PRO 18.A O no hydrogen 2.895 N/A GLU 23.A N GLU 19.A O no hydrogen 3.074 N/A ARG 24.A N VAL 20.A O no hydrogen 2.809 N/A LEU 25.A N LEU 21.A O no hydrogen 2.729 N/A ALA 26.A N GLU 22.A O no hydrogen 3.072 N/A GLY 27.A N ARG 24.A O no hydrogen 3.241 N/A LEU 28.A N ARG 24.A O no hydrogen 3.129 N/A GLY 29.A N LEU 25.A O no hydrogen 2.908 N/A PHE 30.A N LEU 25.A O no hydrogen 3.077 N/A THR 32.A OG1 GLU 22.A OE2 no hydrogen 3.311 N/A ASP 33.A N ASP 157.A O no hydrogen 2.887 N/A ARG 34.A NE GLU 36.A OE2 no hydrogen 2.855 N/A ARG 34.A NH1 ASP 157.A OD2 no hydrogen 2.553 N/A ARG 34.A NH2 GLU 36.A OE2 no hydrogen 3.034 N/A GLU 36.A N VAL 155.A O no hydrogen 3.046 N/A ARG 37.A NH1 GLU 152.A OE1 no hydrogen 3.217 N/A VAL 38.A N GLU 153.A O no hydrogen 2.537 N/A PHE 47.A N THR 144.A O no hydrogen 3.094 N/A ALA 48.A N VAL 87.A O no hydrogen 3.025 N/A ARG 49.A N ASP 67.A O no hydrogen 2.919 N/A VAL 50.A N ILE 85.A O no hydrogen 2.907 N/A LEU 51.A N VAL 65.A O no hydrogen 2.715 N/A HIS 54.A N ARG 63.A O no hydrogen 3.074 N/A ILE 56.A N LEU 61.A O no hydrogen 2.772 N/A THR 59.A N ILE 56.A O no hydrogen 2.783 N/A THR 59.A OG1 ILE 56.A O no hydrogen 2.845 N/A THR 59.A OG1 LEU 61.A O no hydrogen 3.271 N/A ARG 60.A NE ARG 60.A O no hydrogen 2.549 N/A LEU 61.A N THR 59.A OG1 no hydrogen 2.949 N/A LYS 62.A N SER 76.A O no hydrogen 2.399 N/A LYS 62.A NZ SER 76.A O no hydrogen 3.463 N/A LYS 62.A NZ ALA 78.A O no hydrogen 3.210 N/A ARG 63.A N HIS 54.A O no hydrogen 2.479 N/A LEU 64.A N VAL 74.A O no hydrogen 2.669 N/A VAL 65.A N GLU 52.A O no hydrogen 3.036 N/A LEU 66.A N VAL 72.A O no hydrogen 2.616 N/A ASP 67.A N ARG 49.A O no hydrogen 2.842 N/A ALA 68.A N ARG 70.A O no hydrogen 2.849 N/A GLY 69.A N ASP 67.A OD1 no hydrogen 3.277 N/A VAL 72.A N LEU 66.A O no hydrogen 2.798 N/A VAL 74.A N LEU 64.A O no hydrogen 2.974 N/A VAL 75.A N SER 113.A OG no hydrogen 3.294 N/A SER 76.A N LYS 62.A O no hydrogen 2.603 N/A ALA 81.A N ALA 78.A O no hydrogen 2.664 N/A ARG 82.A NH1 ASN 80.A O no hydrogen 2.707 N/A ARG 82.A NH1 GLU 134.A OE2 no hydrogen 2.943 N/A ARG 82.A NH2 GLU 134.A OE1 no hydrogen 2.620 N/A GLY 84.A N VAL 50.A O no hydrogen 3.165 N/A GLY 86.A N PHE 135.A O no hydrogen 2.857 N/A VAL 87.A N ALA 48.A O no hydrogen 2.873 N/A LEU 89.A N VAL 46.A O no hydrogen 2.852 N/A ALA 90.A N MET 116.A O no hydrogen 3.077 N/A LEU 91.A N GLY 44.A O no hydrogen 2.995 N/A GLY 93.A N VAL 103.A O no hydrogen 2.319 N/A THR 94.A N LEU 91.A O no hydrogen 3.176 N/A THR 94.A OG1 LEU 91.A O no hydrogen 3.000 N/A VAL 103.A N THR 94.A O no hydrogen 2.910 N/A ILE 108.A N VAL 111.A O no hydrogen 2.870 N/A VAL 111.A N ILE 108.A O no hydrogen 3.129 N/A ARG 112.A NE GLU 105.A OE2 no hydrogen 3.067 N/A ARG 112.A NH2 GLU 105.A OE2 no hydrogen 3.426 N/A SER 113.A N ARG 106.A O no hydrogen 2.878 N/A SER 113.A OG GLY 115.A O no hydrogen 2.752 N/A PHE 114.A N GLU 73.A O no hydrogen 2.997 N/A SER 119.A N GLU 122.A OE1 no hydrogen 2.968 N/A SER 119.A OG GLU 122.A OE1 no hydrogen 3.219 N/A GLU 122.A N SER 119.A OG no hydrogen 3.397 N/A LEU 123.A N SER 119.A O no hydrogen 3.057 N/A GLY 124.A N PRO 120.A O no hydrogen 3.231 N/A GLY 126.A N PRO 120.A O no hydrogen 2.788 N/A PHE 135.A N GLY 86.A O no hydrogen 3.036 N/A ALA 139.A N PRO 136.A O no hydrogen 3.223 N/A GLY 143.A N PHE 47.A O no hydrogen 2.806 N/A THR 144.A N PRO 141.A O no hydrogen 3.094 N/A THR 144.A OG1 PRO 141.A O no hydrogen 3.184 N/A LEU 146.A N VAL 45.A O no hydrogen 3.108 N/A SER 147.A OG ILE 41.A O no hydrogen 3.024 N/A GLU 148.A N PRO 145.A O no hydrogen 3.088 N/A ALA 149.A N LEU 146.A O no hydrogen 2.691 N/A TRP 150.A N SER 147.A O no hydrogen 2.906 N/A VAL 154.A N GLU 153.A OE1 no hydrogen 2.455 N/A VAL 155.A N GLU 36.A O no hydrogen 2.673 N/A LEU 156.A N VAL 3.A O no hydrogen 3.110 N/A ASP 157.A N ARG 34.A O no hydrogen 2.827 N/A THR 161.A OG1 ASN 163.A OD1 no hydrogen 2.406 N/A ARG 164.A N THR 161.A O no hydrogen 2.530 N/A ARG 164.A NE ASP 166.A OD1 no hydrogen 3.017 N/A ARG 164.A NH1 ASP 176.A OD2 no hydrogen 3.113 N/A ARG 164.A NH2 ASP 166.A OD2 no hydrogen 2.974 N/A ARG 164.A NH2 ASP 176.A OD1 no hydrogen 3.175 N/A ARG 164.A NH2 ASP 176.A OD2 no hydrogen 3.532 N/A ALA 167.A N ARG 164.A O no hydrogen 3.087 N/A LEU 168.A N PRO 165.A O no hydrogen 2.687 N/A GLY 169.A N ASP 166.A O no hydrogen 3.153 N/A LEU 170.A N LEU 254.A O no hydrogen 2.863 N/A LEU 171.A N GLU 255.A O no hydrogen 3.100 N/A GLY 172.A N GLY 169.A O no hydrogen 2.461 N/A LEU 173.A N GLY 169.A O no hydrogen 3.120 N/A ALA 174.A N LEU 170.A O no hydrogen 2.936 N/A ARG 175.A N GLY 172.A O no hydrogen 3.113 N/A ARG 175.A NH1 GLU 186.A OE2 no hydrogen 2.999 N/A ARG 175.A NH2 GLU 186.A OE2 no hydrogen 2.973 N/A ASP 176.A N GLY 172.A O no hydrogen 3.347 N/A LEU 177.A N LEU 173.A O no hydrogen 3.187 N/A ALA 179.A N ARG 175.A O no hydrogen 3.157 N/A ALA 179.A N ASP 176.A O no hydrogen 3.103 N/A LEU 180.A N LEU 177.A O no hydrogen 2.624 N/A GLY 181.A N HIS 178.A O no hydrogen 3.223 N/A TYR 182.A OH GLU 16.A OE1 no hydrogen 3.421 N/A TYR 182.A OH GLU 16.A OE2 no hydrogen 2.751 N/A ALA 183.A N GLU 14.A OE1 no hydrogen 3.200 N/A VAL 185.A N TYR 11.A O no hydrogen 2.539 N/A ALA 190.A N GLU 188.A O no hydrogen 3.157 N/A LYS 192.A N GLN 381.A OE1 no hydrogen 3.023 N/A GLU 194.A N VAL 388.A O no hydrogen 2.988 N/A PHE 200.A N LEU 198.A O no hydrogen 2.444 N/A ALA 201.A N GLU 270.A O no hydrogen 3.109 N/A LYS 203.A N ILE 272.A O no hydrogen 2.923 N/A GLU 205.A N VAL 274.A O no hydrogen 2.762 N/A GLU 208.A N ASP 206.A OD1 no hydrogen 3.013 N/A GLY 209.A N ASP 206.A OD1 no hydrogen 2.715 N/A PHE 213.A N ALA 395.A O no hydrogen 2.775 N/A THR 214.A OG1 VAL 335.A O no hydrogen 2.611 N/A LEU 215.A N LEU 393.A O no hydrogen 2.976 N/A PHE 219.A N ARG 387.A O no hydrogen 3.062 N/A GLY 220.A N GLU 329.A O no hydrogen 2.715 N/A LEU 221.A N GLU 329.A O no hydrogen 3.154 N/A ARG 222.A N ALA 384.A O no hydrogen 2.889 N/A SER 226.A OG ASP 247.A OD2 no hydrogen 2.379 N/A GLN 231.A N PRO 227.A O no hydrogen 3.207 N/A ARG 232.A N LEU 228.A O no hydrogen 3.040 N/A ARG 232.A NE PRO 151.A O no hydrogen 3.079 N/A ARG 232.A NH1 SER 6.A OG no hydrogen 2.956 N/A ARG 232.A NH2 PRO 151.A O no hydrogen 2.690 N/A ALA 233.A N TRP 229.A O no hydrogen 2.916 N/A LEU 234.A N MET 230.A O no hydrogen 2.774 N/A PHE 235.A N GLN 231.A O no hydrogen 2.792 N/A ALA 236.A N ARG 232.A O no hydrogen 2.793 N/A ALA 237.A N ALA 233.A O no hydrogen 3.259 N/A GLY 238.A N PHE 235.A O no hydrogen 3.167 N/A MET 239.A N LEU 234.A O no hydrogen 3.158 N/A ILE 242.A N ASP 247.A OD1 no hydrogen 2.703 N/A ASN 244.A N ALA 224.A O no hydrogen 2.670 N/A VAL 246.A N ASN 243.A OD1 no hydrogen 3.292 N/A ASP 247.A N ASN 243.A O no hydrogen 2.876 N/A VAL 248.A N ASN 244.A O no hydrogen 2.965 N/A THR 249.A N VAL 246.A O no hydrogen 3.176 N/A THR 249.A OG1 VAL 246.A O no hydrogen 2.331 N/A ASN 250.A N ASP 247.A O no hydrogen 2.714 N/A TYR 251.A N ASP 247.A O no hydrogen 2.888 N/A VAL 252.A N VAL 248.A O no hydrogen 3.501 N/A MET 253.A N THR 249.A O no hydrogen 3.258 N/A LEU 254.A N ASN 250.A O no hydrogen 2.920 N/A GLU 255.A N TYR 251.A O no hydrogen 2.630 N/A ARG 256.A N VAL 252.A O no hydrogen 2.997 N/A ARG 256.A N MET 253.A O no hydrogen 3.065 N/A ARG 256.A NE GLU 255.A OE2 no hydrogen 3.171 N/A ARG 256.A NH2 GLU 255.A OE2 no hydrogen 3.033 N/A GLN 258.A N MET 253.A O no hydrogen 3.404 N/A HIS 261.A N GLU 334.A O no hydrogen 3.293 N/A PHE 263.A N ALA 332.A O no hydrogen 2.883 N/A ASP 264.A N SER 322.A O no hydrogen 2.842 N/A LEU 265.A N ALA 330.A O no hydrogen 3.290 N/A ARG 266.A N ASP 264.A OD1 no hydrogen 3.340 N/A ARG 266.A NH1 ASP 264.A OD2 no hydrogen 3.282 N/A PHE 267.A N ASP 264.A O no hydrogen 3.257 N/A VAL 268.A N LEU 265.A O no hydrogen 2.535 N/A GLU 270.A N TRP 303.A O no hydrogen 2.911 N/A ILE 272.A N ALA 201.A O no hydrogen 2.700 N/A ALA 273.A N ALA 301.A O no hydrogen 2.429 N/A VAL 274.A N LYS 203.A O no hydrogen 2.909 N/A ARG 275.A N VAL 299.A O no hydrogen 3.092 N/A ARG 275.A NE SER 308.A OG no hydrogen 2.930 N/A ARG 275.A NH1 ARG 276.A O no hydrogen 2.983 N/A ARG 275.A NH1 GLU 281.A OE1 no hydrogen 3.235 N/A ARG 275.A NH2 GLU 281.A OE2 no hydrogen 2.823 N/A ARG 275.A NH2 SER 308.A OG no hydrogen 3.240 N/A ARG 276.A NE GLU 296.A O no hydrogen 3.113 N/A ARG 276.A NH1 ASP 206.A OD2 no hydrogen 2.379 N/A ARG 276.A NH2 GLU 296.A O no hydrogen 3.427 N/A ARG 278.A N GLU 281.A OE1 no hydrogen 2.612 N/A GLU 281.A N ARG 278.A O no hydrogen 2.727 N/A LEU 283.A N ARG 291.A O no hydrogen 3.207 N/A LYS 284.A NZ GLU 290.A OE1 no hydrogen 3.151 N/A THR 285.A N VAL 289.A O no hydrogen 3.015 N/A THR 285.A OG1 ASP 287.A OD1 no hydrogen 2.948 N/A THR 285.A OG1 ASP 287.A OD2 no hydrogen 3.562 N/A THR 285.A OG1 VAL 289.A O no hydrogen 2.889 N/A LEU 286.A N GLY 318.A O no hydrogen 3.027 N/A GLY 288.A N THR 285.A O no hydrogen 2.707 N/A VAL 289.A N ASP 287.A OD1 no hydrogen 2.745 N/A ARG 291.A N LEU 283.A O no hydrogen 2.834 N/A ARG 291.A NE THR 285.A OG1 no hydrogen 2.709 N/A ARG 291.A NH2 ASP 287.A OD2 no hydrogen 2.868 N/A HIS 294.A N ASP 297.A OD2 no hydrogen 2.958 N/A GLU 296.A N HIS 294.A ND1 no hydrogen 2.666 N/A ASP 297.A N HIS 294.A O no hydrogen 2.912 N/A VAL 299.A N ARG 275.A O no hydrogen 2.861 N/A ILE 300.A N GLY 312.A O no hydrogen 2.911 N/A ALA 301.A N ALA 273.A O no hydrogen 2.657 N/A GLY 302.A N PHE 309.A O no hydrogen 2.830 N/A TRP 303.A N GLY 271.A O no hydrogen 3.308 N/A ARG 304.A N GLU 307.A O no hydrogen 2.973 N/A GLY 305.A N GLU 270.A OE2 no hydrogen 2.522 N/A GLU 307.A N ARG 304.A O no hydrogen 3.100 N/A PHE 309.A N GLY 302.A O no hydrogen 2.836 N/A LEU 311.A N ILE 300.A O no hydrogen 2.498 N/A GLY 312.A N ILE 300.A O no hydrogen 3.132 N/A ALA 314.A N LEU 298.A O no hydrogen 3.331 N/A MET 317.A N LEU 313.A O no hydrogen 3.128 N/A ALA 320.A N LYS 284.A O no hydrogen 2.745 N/A SER 322.A OG LEU 311.A O no hydrogen 2.892 N/A ARG 325.A N THR 328.A OG1 no hydrogen 2.969 N/A ARG 325.A NH2 GLU 321.A O no hydrogen 2.911 N/A THR 328.A N ARG 325.A O no hydrogen 3.294 N/A THR 328.A OG1 ASP 264.A OD2 no hydrogen 3.149 N/A THR 328.A OG1 ARG 325.A O no hydrogen 3.044 N/A ILE 331.A N ALA 218.A O no hydrogen 2.952 N/A ALA 332.A N PHE 263.A O no hydrogen 2.794 N/A LEU 333.A N GLY 216.A O no hydrogen 2.976 N/A GLU 334.A N HIS 261.A O no hydrogen 2.787 N/A VAL 335.A N THR 214.A O no hydrogen 3.397 N/A CYS 337.A N HIS 212.A O no hydrogen 3.208 N/A CYS 337.A SG PHE 338.A O no hydrogen 3.601 N/A SER 342.A N ASP 339.A OD2 no hydrogen 2.906 N/A ILE 343.A N ASP 339.A O no hydrogen 3.138 N/A ARG 344.A N PRO 340.A O no hydrogen 2.824 N/A LYS 345.A N VAL 341.A O no hydrogen 2.899 N/A THR 346.A N SER 342.A O no hydrogen 2.668 N/A THR 346.A OG1 ASP 297.A OD1 no hydrogen 3.168 N/A THR 346.A OG1 SER 342.A O no hydrogen 3.300 N/A ALA 347.A N ILE 343.A O no hydrogen 2.816 N/A ARG 348.A N ARG 344.A O no hydrogen 3.004 N/A ARG 349.A N LYS 345.A O no hydrogen 2.777 N/A ARG 349.A NH1 ASP 297.A OD1 no hydrogen 2.652 N/A ARG 349.A NH2 GLU 296.A OE1 no hydrogen 3.451 N/A HIS 350.A N THR 346.A O no hydrogen 3.011 N/A GLY 351.A N ARG 348.A O no hydrogen 2.991 N/A LEU 352.A N ALA 347.A O no hydrogen 3.062 N/A THR 354.A N SER 357.A OG no hydrogen 2.687 N/A THR 354.A OG1 VAL 316.A O no hydrogen 2.846 N/A THR 354.A OG1 SER 357.A OG no hydrogen 2.924 N/A SER 357.A N THR 354.A OG1 no hydrogen 2.960 N/A SER 357.A OG THR 354.A O no hydrogen 3.138 N/A SER 357.A OG THR 354.A OG1 no hydrogen 2.924 N/A HIS 358.A N THR 354.A O no hydrogen 2.947 N/A ARG 359.A N GLU 355.A O no hydrogen 3.240 N/A ARG 359.A NH1 GLU 355.A O no hydrogen 3.070 N/A ARG 359.A NH1 GLU 355.A OE1 no hydrogen 2.916 N/A ARG 359.A NH2 LEU 168.A O no hydrogen 3.298 N/A PHE 360.A N ALA 356.A O no hydrogen 3.077 N/A GLU 361.A N SER 357.A O no hydrogen 2.695 N/A ARG 362.A N HIS 358.A O no hydrogen 3.169 N/A GLY 363.A N ARG 359.A O no hydrogen 2.684 N/A GLY 368.A N ASP 365.A O no hydrogen 2.478 N/A GLN 369.A NE2 ASP 365.A O no hydrogen 3.200 N/A ALA 372.A N GLY 368.A O no hydrogen 2.809 N/A GLN 373.A N GLN 369.A O no hydrogen 3.103 N/A GLN 373.A N VAL 370.A O no hydrogen 2.889 N/A GLN 373.A NE2 THR 214.A OG1 no hydrogen 2.659 N/A GLN 373.A NE2 LEU 333.A O no hydrogen 3.485 N/A ARG 374.A N VAL 370.A O no hydrogen 3.304 N/A ARG 375.A N PRO 371.A O no hydrogen 3.067 N/A ARG 375.A NH1 GLU 255.A OE1 no hydrogen 2.588 N/A ARG 375.A NH1 GLU 255.A OE2 no hydrogen 3.521 N/A ALA 376.A N ALA 372.A O no hydrogen 3.075 N/A LEU 377.A N GLN 373.A O no hydrogen 2.568 N/A SER 378.A N ARG 374.A O no hydrogen 2.793 N/A LEU 379.A N ARG 375.A O no hydrogen 3.065 N/A LEU 380.A N ALA 376.A O no hydrogen 2.970 N/A GLN 381.A N LEU 377.A O no hydrogen 2.803 N/A ALA 382.A N SER 378.A O no hydrogen 3.084 N/A LEU 383.A N LEU 379.A O no hydrogen 2.622 N/A ALA 384.A N LEU 380.A O no hydrogen 2.798 N/A GLY 385.A N GLN 381.A O no hydrogen 3.301 N/A ARG 387.A N PHE 219.A O no hydrogen 2.726 N/A ARG 387.A NE GLU 194.A OE2 no hydrogen 2.877 N/A ARG 387.A NH2 GLU 194.A OE1 no hydrogen 2.673 N/A ARG 387.A NH2 GLU 194.A OE2 no hydrogen 3.059 N/A ALA 389.A N TYR 217.A O no hydrogen 2.990 N/A GLU 390.A N GLU 194.A O no hydrogen 3.080 N/A LEU 393.A N LEU 215.A O no hydrogen 3.147 N/A ALA 395.A N PHE 213.A O no hydrogen 2.698 N/A ILE 404.A N VAL 444.A O no hydrogen 2.328 N/A PHE 406.A N TYR 442.A O no hydrogen 2.724 N/A ARG 407.A N GLU 456.A OE2 no hydrogen 2.710 N/A ARG 407.A NH1 GLU 456.A OE1 no hydrogen 2.609 N/A TYR 410.A N ARG 407.A O no hydrogen 2.805 N/A TYR 410.A OH GLU 457.A OE2 no hydrogen 3.184 N/A ALA 411.A N ARG 407.A O no hydrogen 3.147 N/A ASN 412.A N PRO 408.A O no hydrogen 3.057 N/A ASN 412.A ND2 TYR 419.A O no hydrogen 2.794 N/A ARG 413.A N GLU 409.A O no hydrogen 2.993 N/A LEU 414.A N TYR 410.A O no hydrogen 2.906 N/A LEU 414.A N ALA 411.A O no hydrogen 3.295 N/A LEU 415.A N ALA 411.A O no hydrogen 3.012 N/A GLY 416.A N ASN 412.A O no hydrogen 2.669 N/A THR 417.A OG1 ASN 412.A OD1 no hydrogen 2.776 N/A TYR 419.A N ASN 412.A OD1 no hydrogen 2.989 N/A TYR 419.A OH THR 471.A OG1 no hydrogen 2.757 N/A GLU 423.A N PRO 420.A O no hydrogen 2.871 N/A GLN 424.A N PRO 420.A O no hydrogen 3.296 N/A GLN 424.A N GLU 421.A O no hydrogen 2.483 N/A GLN 424.A NE2 PRO 408.A O no hydrogen 3.198 N/A ILE 425.A N GLU 421.A O no hydrogen 3.116 N/A ALA 426.A N ALA 422.A O no hydrogen 3.281 N/A ILE 427.A N GLN 424.A O no hydrogen 2.921 N/A LEU 428.A N GLN 424.A O no hydrogen 3.245 N/A LYS 429.A N ILE 425.A O no hydrogen 2.945 N/A ARG 430.A N ALA 426.A O no hydrogen 2.888 N/A ARG 430.A NH1 HIS 178.A O no hydrogen 2.428 N/A ARG 430.A NH1 TYR 182.A O no hydrogen 2.963 N/A LEU 431.A N ILE 427.A O no hydrogen 3.131 N/A GLY 432.A N LYS 429.A O no hydrogen 2.940 N/A ARG 434.A N THR 445.A O no hydrogen 3.226 N/A ARG 434.A NH2 GLU 436.A OE1 no hydrogen 2.764 N/A GLU 436.A N ARG 443.A O no hydrogen 2.783 N/A TYR 442.A N PHE 406.A O no hydrogen 2.625 N/A TYR 442.A OH GLU 421.A OE2 no hydrogen 3.398 N/A ARG 443.A N GLU 436.A O no hydrogen 2.894 N/A VAL 444.A N ILE 404.A O no hydrogen 2.702 N/A THR 445.A N ARG 434.A O no hydrogen 3.069 N/A SER 448.A OG ASP 365.A OD1 no hydrogen 2.551 N/A SER 448.A OG ASP 365.A OD2 no hydrogen 3.124 N/A ARG 450.A N PRO 447.A O no hydrogen 3.167 N/A ARG 450.A NE ASP 452.A OD1 no hydrogen 2.733 N/A ARG 450.A NH1 GLU 462.A OE1 no hydrogen 3.422 N/A ARG 450.A NH2 ASP 452.A OD2 no hydrogen 2.409 N/A ARG 450.A NH2 GLU 462.A OE2 no hydrogen 3.494 N/A ARG 454.A N ASP 458.A OD2 no hydrogen 3.215 N/A ARG 454.A NE LEU 453.A O no hydrogen 2.851 N/A ARG 454.A NH2 LEU 453.A O no hydrogen 3.353 N/A LEU 455.A N ASP 458.A OD2 no hydrogen 2.636 N/A GLU 457.A N GLU 457.A OE1 no hydrogen 2.094 N/A VAL 460.A N GLU 456.A O no hydrogen 2.888 N/A GLU 461.A N GLU 457.A O no hydrogen 2.919 N/A GLU 462.A N LEU 459.A O no hydrogen 3.023 N/A VAL 463.A N VAL 460.A O no hydrogen 3.057 N/A ALA 464.A N VAL 460.A O no hydrogen 2.881 N/A ARG 465.A N GLU 461.A O no hydrogen 3.233 N/A ARG 465.A NE LEU 28.A O no hydrogen 2.873 N/A ARG 465.A NH1 GLU 462.A OE2 no hydrogen 3.102 N/A ARG 465.A NH2 LEU 28.A O no hydrogen 3.445 N/A ARG 465.A NH2 ASP 176.A OD1 no hydrogen 2.505 N/A ILE 466.A N VAL 463.A O no hydrogen 3.078 N/A GLN 467.A N VAL 463.A O no hydrogen 2.958 N/A GLY 468.A N ALA 464.A O no hydrogen 2.799 N/A THR 471.A N GLY 468.A O no hydrogen 2.771 N/A THR 471.A OG1 TYR 419.A OH no hydrogen 2.757 N/A THR 471.A OG1 GLY 468.A O no hydrogen 2.812 N/A ILE 472.A N TYR 469.A O no hydrogen 3.213 N/A ASN 485.A N ALA 482.A O no hydrogen 2.942 N/A ASN 485.A ND2 ALA 482.A O no hydrogen 3.144 N/A ARG 486.A N PRO 483.A O no hydrogen 2.879 N/A VAL 488.A N ASN 485.A O no hydrogen 3.263 N/A ALA 490.A N GLY 487.A O no hydrogen 2.886 N/A ARG 493.A N GLU 489.A O no hydrogen 3.094 N/A LYS 494.A N ALA 490.A O no hydrogen 2.742 N/A LYS 494.A NZ LEU 677.A O no hydrogen 3.001 N/A LYS 494.A NZ ASP 679.A OD2 no hydrogen 3.272 N/A GLU 495.A N PRO 491.A O no hydrogen 3.173 N/A GLN 496.A N TYR 492.A O no hydrogen 3.316 N/A ARG 497.A N ARG 493.A O no hydrogen 3.155 N/A ARG 499.A N GLU 495.A O no hydrogen 2.909 N/A ARG 499.A NE GLU 495.A OE2 no hydrogen 3.204 N/A ARG 499.A NH1 GLU 509.A OE2 no hydrogen 3.353 N/A ARG 499.A NH1 TYR 511.A OH no hydrogen 3.214 N/A ARG 499.A NH2 GLU 495.A OE2 no hydrogen 2.824 N/A GLU 500.A N GLN 496.A O no hydrogen 2.701 N/A VAL 501.A N ARG 497.A O no hydrogen 2.696 N/A LEU 502.A N LEU 498.A O no hydrogen 3.074 N/A SER 503.A N ARG 499.A O no hydrogen 2.767 N/A SER 503.A OG ARG 499.A O no hydrogen 3.251 N/A SER 503.A OG GLU 500.A O no hydrogen 2.392 N/A GLY 504.A N GLU 500.A O no hydrogen 2.703 N/A LEU 505.A N VAL 501.A O no hydrogen 2.981 N/A PHE 507.A N LEU 502.A O no hydrogen 3.027 N/A GLN 508.A N LEU 569.A O no hydrogen 2.811 N/A VAL 510.A N PHE 571.A O no hydrogen 2.959 N/A THR 512.A N GLU 572.A OE2 no hydrogen 2.617 N/A THR 512.A OG1 GLU 572.A OE1 no hydrogen 2.625 N/A MET 516.A N ALA 543.A O no hydrogen 2.742 N/A ASP 520.A N ASP 517.A O no hydrogen 2.548 N/A ALA 521.A N PRO 518.A O no hydrogen 3.379 N/A ARG 523.A N GLU 519.A O no hydrogen 3.226 N/A ARG 523.A NH1 ASP 517.A OD2 no hydrogen 3.497 N/A ARG 523.A NH1 ASP 520.A OD1 no hydrogen 3.029 N/A PHE 524.A N ASP 520.A O no hydrogen 2.734 N/A ARG 525.A N ARG 522.A O no hydrogen 3.050 N/A ARG 525.A NH2 GLU 658.A OE1 no hydrogen 3.142 N/A LEU 526.A N ALA 521.A O no hydrogen 2.452 N/A LEU 533.A N ALA 542.A O no hydrogen 2.992 N/A LYS 541.A N ALA 538.A O no hydrogen 2.942 N/A ALA 542.A N PRO 539.A O no hydrogen 3.129 N/A ALA 543.A N MET 516.A O no hydrogen 3.217 N/A LEU 544.A N LEU 531.A O no hydrogen 3.337 N/A ARG 545.A N SER 514.A O no hydrogen 3.060 N/A ARG 545.A NE ARG 575.A O no hydrogen 3.007 N/A ARG 545.A NH1 THR 512.A O no hydrogen 3.189 N/A ARG 545.A NH1 TYR 513.A O no hydrogen 3.232 N/A ARG 545.A NH2 ARG 575.A O no hydrogen 3.408 N/A THR 546.A OG1 HIS 547.A ND1 no hydrogen 3.040 N/A HIS 547.A ND1 THR 546.A OG1 no hydrogen 3.040 N/A LEU 548.A N GLU 672.A OE2 no hydrogen 2.554 N/A PHE 549.A N GLU 672.A OE1 no hydrogen 2.403 N/A GLY 551.A N LEU 548.A O no hydrogen 3.269 N/A VAL 553.A N PHE 549.A O no hydrogen 3.164 N/A ARG 554.A N PRO 550.A O no hydrogen 2.907 N/A ARG 554.A NH2 ASP 520.A OD1 no hydrogen 2.520 N/A VAL 555.A N GLY 551.A O no hydrogen 2.994 N/A LEU 556.A N LEU 552.A O no hydrogen 3.058 N/A LYS 557.A N VAL 553.A O no hydrogen 3.218 N/A LYS 557.A NZ LEU 663.A O no hydrogen 3.428 N/A LYS 557.A NZ GLU 664.A O no hydrogen 3.362 N/A GLU 558.A N ARG 554.A O no hydrogen 2.891 N/A ASN 559.A N VAL 555.A O no hydrogen 2.637 N/A ASN 559.A ND2 VAL 555.A O no hydrogen 3.355 N/A LEU 560.A N LEU 556.A O no hydrogen 2.942 N/A ASP 561.A N LYS 557.A O no hydrogen 3.174 N/A LEU 562.A N ASN 559.A O no hydrogen 2.672 N/A ASP 563.A N ASN 559.A O no hydrogen 2.982 N/A ARG 567.A NH1 GLY 593.A O no hydrogen 2.768 N/A ALA 568.A N PHE 590.A O no hydrogen 3.272 N/A LEU 570.A N LEU 588.A O no hydrogen 3.230 N/A GLU 572.A N ALA 586.A O no hydrogen 2.579 N/A GLY 574.A N HIS 584.A O no hydrogen 2.909 N/A VAL 576.A N GLU 582.A O no hydrogen 2.722 N/A PHE 577.A N ARG 545.A O no hydrogen 2.808 N/A ARG 578.A N ARG 580.A O no hydrogen 3.065 N/A ARG 578.A NE THR 546.A O no hydrogen 2.989 N/A ARG 578.A NH2 THR 546.A O no hydrogen 2.916 N/A GLU 582.A N VAL 576.A O no hydrogen 2.913 N/A HIS 584.A N GLY 574.A O no hydrogen 2.713 N/A LEU 585.A N LEU 673.A O no hydrogen 3.022 N/A ALA 586.A N GLU 572.A O no hydrogen 3.017 N/A LEU 589.A N HIS 669.A O no hydrogen 2.767 N/A GLU 592.A N GLU 566.A O no hydrogen 2.822 N/A VAL 594.A N LEU 603.A O no hydrogen 2.530 N/A ALA 599.A N LEU 596.A O no hydrogen 2.610 N/A ARG 602.A NE GLU 592.A OE2 no hydrogen 3.412 N/A ARG 602.A NH2 GLU 592.A OE2 no hydrogen 3.485 N/A LEU 603.A N VAL 594.A O no hydrogen 2.936 N/A SER 604.A OG GLU 592.A O no hydrogen 2.974 N/A LEU 608.A N SER 604.A O no hydrogen 3.321 N/A LEU 609.A N GLY 605.A O no hydrogen 3.489 N/A LYS 610.A N TYR 606.A O no hydrogen 2.784 N/A GLY 611.A N PHE 607.A O no hydrogen 2.703 N/A GLY 611.A N LEU 608.A O no hydrogen 2.878 N/A TYR 612.A N LEU 608.A O no hydrogen 2.839 N/A LEU 613.A N LEU 609.A O no hydrogen 3.099 N/A GLU 614.A N LYS 610.A O no hydrogen 3.237 N/A ALA 615.A N GLY 611.A O no hydrogen 2.924 N/A LEU 616.A N TYR 612.A O no hydrogen 2.996 N/A PHE 617.A N LEU 613.A O no hydrogen 2.987 N/A ALA 618.A N GLU 614.A O no hydrogen 2.800 N/A ARG 619.A N ALA 615.A O no hydrogen 2.792 N/A LEU 620.A N LEU 616.A O no hydrogen 3.116 N/A GLY 621.A N ALA 618.A O no hydrogen 3.094 N/A LEU 622.A N PHE 617.A O no hydrogen 3.168 N/A ALA 623.A N GLU 645.A OE2 no hydrogen 2.771 N/A ARG 625.A N LEU 643.A O no hydrogen 3.135 N/A HIS 635.A N ALA 654.A O no hydrogen 2.754 N/A VAL 638.A N HIS 635.A ND1 no hydrogen 3.045 N/A SER 639.A OG GLN 629.A O no hydrogen 3.158 N/A GLY 640.A N LEU 652.A O no hydrogen 3.268 N/A ARG 641.A N GLU 627.A O no hydrogen 2.732 N/A ARG 641.A NH1 GLU 648.A OE1 no hydrogen 3.485 N/A VAL 642.A N GLY 650.A O no hydrogen 2.651 N/A LEU 643.A N ARG 625.A O no hydrogen 2.965 N/A VAL 644.A N GLU 647.A O no hydrogen 3.189 N/A GLU 645.A N ALA 623.A O no hydrogen 3.128 N/A VAL 649.A N VAL 642.A O no hydrogen 3.314 N/A PHE 651.A N GLU 672.A O no hydrogen 2.962 N/A LEU 652.A N GLY 640.A O no hydrogen 3.103 N/A GLY 653.A N LEU 670.A O no hydrogen 2.810 N/A ALA 654.A N VAL 638.A O no hydrogen 3.253 N/A LEU 655.A N VAL 668.A O no hydrogen 3.169 N/A ALA 660.A N HIS 656.A O no hydrogen 2.994 N/A GLN 661.A N PRO 657.A O no hydrogen 2.592 N/A GLU 662.A N GLU 658.A O no hydrogen 2.556 N/A LEU 663.A N ALA 660.A O no hydrogen 2.724 N/A LEU 665.A N ALA 660.A O no hydrogen 3.055 N/A LEU 670.A N GLY 653.A O no hydrogen 2.809 N/A GLU 672.A N PHE 651.A O no hydrogen 2.996 N/A LEU 673.A N LEU 585.A O no hydrogen 2.846 N/A ARG 674.A N VAL 649.A O no hydrogen 3.018 N/A LEU 675.A N THR 583.A O no hydrogen 3.030 N/A LYS 680.A NZ GLY 621.A O no hydrogen 3.450 N/A GLN 685.A NE2 ALA 683.A O no hydrogen 3.336 N/A SER 688.A OG HIS 751.A O no hydrogen 2.824 N/A SER 688.A OG PRO 752.A O no hydrogen 2.893 N/A HIS 690.A N HIS 690.A ND1 no hydrogen 2.666 N/A ALA 693.A N PHE 749.A O no hydrogen 2.624 N/A ARG 695.A N LEU 747.A O no hydrogen 2.842 N/A LEU 697.A N PHE 745.A O no hydrogen 3.277 N/A VAL 699.A N LEU 743.A O no hydrogen 2.951 N/A VAL 701.A N LYS 741.A O no hydrogen 2.493 N/A ALA 703.A N GLY 739.A O no hydrogen 3.152 N/A GLU 709.A N PRO 706.A O no hydrogen 3.003 N/A VAL 710.A N PRO 706.A O no hydrogen 3.509 N/A GLU 711.A N TYR 707.A O no hydrogen 2.954 N/A ALA 712.A N GLY 708.A O no hydrogen 2.915 N/A LEU 713.A N GLU 709.A O no hydrogen 2.983 N/A VAL 714.A N VAL 710.A O no hydrogen 2.876 N/A ARG 715.A N GLU 711.A O no hydrogen 2.845 N/A GLU 716.A N ALA 712.A O no hydrogen 2.670 N/A ALA 717.A N LEU 713.A O no hydrogen 3.186 N/A ALA 718.A N ARG 715.A O no hydrogen 2.497 N/A GLY 719.A N ALA 717.A O no hydrogen 2.440 N/A GLU 723.A N ARG 748.A O no hydrogen 2.492 N/A SER 724.A N ARG 748.A O no hydrogen 3.388 N/A ALA 726.A N HIS 746.A O no hydrogen 2.833 N/A PHE 728.A N ALA 744.A O no hydrogen 2.807 N/A TYR 731.A N SER 742.A O no hydrogen 3.101 N/A TYR 731.A OH PRO 734.A O no hydrogen 2.767 N/A GLN 732.A NE2 HIS 740.A O no hydrogen 3.070 N/A HIS 740.A ND1 GLU 738.A O no hydrogen 3.373 N/A LYS 741.A NZ ALA 703.A O no hydrogen 2.805 N/A LYS 741.A NZ THR 705.A O no hydrogen 2.737 N/A SER 742.A N TYR 731.A O no hydrogen 2.865 N/A SER 742.A OG TYR 731.A O no hydrogen 3.492 N/A LEU 743.A N VAL 699.A O no hydrogen 2.754 N/A ALA 744.A N ASP 729.A O no hydrogen 2.454 N/A PHE 745.A N LEU 697.A O no hydrogen 2.567 N/A HIS 746.A N ALA 726.A O no hydrogen 2.507 N/A LEU 747.A N ARG 695.A O no hydrogen 2.897 N/A ARG 748.A NH1 GLU 723.A OE1 no hydrogen 2.948 N/A PHE 749.A N ALA 693.A O no hydrogen 2.917 N/A ARG 750.A N TYR 721.A O no hydrogen 2.894 N/A ARG 750.A NH2 SER 688.A O no hydrogen 2.670 N/A LYS 753.A N HIS 751.A ND1 no hydrogen 3.031 N/A ARG 754.A N HIS 751.A ND1 no hydrogen 3.486 N/A ARG 754.A NH1 GLU 760.A OE2 no hydrogen 2.542 N/A ARG 757.A N GLU 760.A OE1 no hydrogen 2.816 N/A GLU 760.A N ARG 757.A O no hydrogen 3.201 N/A VAL 761.A N ARG 757.A O no hydrogen 3.265 N/A GLU 762.A N ASP 758.A O no hydrogen 2.668 N/A GLU 763.A N GLU 759.A O no hydrogen 3.125 N/A SER 766.A OG GLU 762.A O no hydrogen 3.135 N/A VAL 768.A N VAL 765.A O no hydrogen 2.891 N/A ALA 769.A N VAL 765.A O no hydrogen 2.994 N/A GLU 770.A N SER 766.A O no hydrogen 3.065 N/A ALA 771.A N ARG 767.A O no hydrogen 3.511 N/A ARG 773.A N ALA 769.A O no hydrogen 3.279 N/A ALA 774.A N GLU 770.A O no hydrogen 2.737 N/A ARG 775.A N LEU 772.A O no hydrogen 3.256 N/A ARG 775.A NE ARG 775.A O no hydrogen 3.401 N/A ARG 775.A NH2 GLU 709.A OE2 no hydrogen 2.667 N/A GLY 776.A N LEU 772.A O no hydrogen 3.262 N/A GLY 776.A N ARG 773.A O no hydrogen 2.875 N/A PHE 777.A N LEU 772.A O no hydrogen 2.938 N/A GLY 778.A N VAL 700.A O no hydrogen 3.024 N/A ARG 780.A N ALA 698.A O no hydrogen 3.102 N/A ASP 783.A N ASP 696.A O no hydrogen 3.222 N/A