Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7dag_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N ASP 170.A OD2 no hydrogen 2.616 N/A THR 3.A N GLU 7.A OE2 no hydrogen 3.104 N/A ASN 4.A N GLU 7.A OE2 no hydrogen 2.532 N/A GLU 7.A N GLU 7.A OE1 no hydrogen 2.465 N/A LEU 8.A N ASN 4.A O no hydrogen 2.533 N/A ASP 9.A N LEU 5.A O no hydrogen 2.860 N/A ALA 10.A N ALA 6.A O no hydrogen 2.938 N/A LEU 11.A N GLU 7.A O no hydrogen 2.886 N/A VAL 12.A N LEU 8.A O no hydrogen 2.846 N/A ALA 13.A N ASP 9.A O no hydrogen 2.900 N/A ARG 14.A N ALA 10.A O no hydrogen 2.910 N/A VAL 15.A N LEU 11.A O no hydrogen 2.884 N/A LYS 16.A N VAL 12.A O no hydrogen 2.822 N/A ALA 17.A N ALA 13.A O no hydrogen 2.880 N/A ALA 18.A N ARG 14.A O no hydrogen 2.915 N/A GLN 19.A N VAL 15.A O no hydrogen 2.814 N/A GLN 19.A NE2 GLY 104.A O no hydrogen 2.795 N/A ALA 20.A N LYS 16.A O no hydrogen 2.965 N/A GLU 21.A N ALA 17.A O no hydrogen 3.053 N/A PHE 22.A N ALA 18.A O no hydrogen 2.832 N/A ALA 23.A N GLN 19.A O no hydrogen 2.904 N/A THR 24.A OG1 GLU 21.A O no hydrogen 2.531 N/A SER 26.A N GLN 29.A OE1 no hydrogen 2.975 N/A SER 26.A OG GLU 28.A OE2 no hydrogen 2.421 N/A GLU 28.A N GLU 28.A OE1 no hydrogen 2.481 N/A GLN 29.A N SER 26.A O no hydrogen 3.111 N/A VAL 30.A N SER 26.A O no hydrogen 3.176 N/A ASP 31.A N GLN 27.A O no hydrogen 3.001 N/A LYS 32.A N ASP 31.A OD1 no hydrogen 2.360 N/A PHE 34.A N VAL 30.A O no hydrogen 2.866 N/A ARG 35.A N ASP 31.A O no hydrogen 2.888 N/A ALA 36.A N LYS 32.A O no hydrogen 2.945 N/A ALA 37.A N ILE 33.A O no hydrogen 2.858 N/A SER 38.A N PHE 34.A O no hydrogen 2.920 N/A SER 38.A OG PHE 34.A O no hydrogen 2.806 N/A SER 38.A OG ARG 35.A O no hydrogen 2.393 N/A LEU 39.A N ARG 35.A O no hydrogen 2.904 N/A ALA 40.A N ALA 36.A O no hydrogen 2.874 N/A ALA 41.A N ALA 37.A O no hydrogen 2.898 N/A ASN 42.A N LEU 39.A O no hydrogen 2.714 N/A GLN 43.A N LEU 39.A O no hydrogen 3.137 N/A GLN 43.A N GLN 43.A OE1 no hydrogen 1.993 N/A GLN 43.A NE2 ALA 40.A O no hydrogen 2.703 N/A ALA 44.A N GLN 43.A OE1 no hydrogen 3.171 N/A ARG 45.A N GLN 43.A O no hydrogen 2.825 N/A ALA 49.A N ARG 45.A O no hydrogen 2.959 N/A GLN 50.A N ILE 46.A O no hydrogen 2.860 N/A MET 51.A N PRO 47.A O no hydrogen 2.876 N/A ALA 52.A N LEU 48.A O no hydrogen 2.804 N/A VAL 53.A N ALA 49.A O no hydrogen 2.851 N/A GLU 54.A N GLN 50.A O no hydrogen 3.018 N/A GLU 55.A N MET 51.A O no hydrogen 2.909 N/A SER 56.A N ALA 52.A O no hydrogen 2.868 N/A SER 56.A OG ALA 52.A O no hydrogen 2.940 N/A VAL 65.A N VAL 61.A O no hydrogen 2.898 N/A ILE 66.A N GLU 62.A O no hydrogen 2.874 N/A LYS 67.A N ASP 63.A O no hydrogen 2.862 N/A LYS 67.A NZ ASN 114.A OD1 no hydrogen 2.817 N/A ASN 68.A N LYS 64.A O no hydrogen 3.052 N/A HIS 69.A N VAL 65.A O no hydrogen 2.881 N/A PHE 70.A N ILE 66.A O no hydrogen 2.801 N/A ALA 71.A N LYS 67.A O no hydrogen 2.734 N/A SER 72.A N ASN 68.A O no hydrogen 2.910 N/A SER 72.A OG ASN 42.A OD1 no hydrogen 3.425 N/A GLU 73.A N HIS 69.A O no hydrogen 2.987 N/A PHE 74.A N PHE 70.A O no hydrogen 2.756 N/A ILE 75.A N ALA 71.A O no hydrogen 2.847 N/A TYR 76.A N SER 72.A O no hydrogen 2.991 N/A ASN 77.A N GLU 73.A O no hydrogen 2.854 N/A ASN 77.A ND2 GLU 73.A O no hydrogen 2.526 N/A LYS 78.A N PHE 74.A O no hydrogen 2.752 N/A TYR 79.A N ILE 75.A O no hydrogen 3.152 N/A TYR 79.A N TYR 76.A O no hydrogen 3.206 N/A LYS 80.A NZ ASN 77.A O no hydrogen 3.115 N/A LYS 80.A NZ ASN 77.A OD1 no hydrogen 3.102 N/A LYS 83.A NZ CYS 85.A O no hydrogen 2.641 N/A THR 84.A OG1 GLU 82.A O no hydrogen 3.460 N/A CYS 85.A SG PHE 25.A O no hydrogen 3.027 N/A LEU 88.A N THR 98.A O no hydrogen 2.551 N/A GLU 89.A N THR 98.A O no hydrogen 2.935 N/A ASP 91.A N THR 96.A O no hydrogen 2.874 N/A LEU 94.A N ASP 91.A OD1 no hydrogen 3.239 N/A THR 96.A N ASP 91.A O no hydrogen 2.902 N/A MET 97.A N VAL 444.A O no hydrogen 2.949 N/A THR 98.A N GLU 89.A O no hydrogen 2.918 N/A THR 98.A OG1 THR 443.A OG1 no hydrogen 3.264 N/A ILE 99.A N LYS 442.A O no hydrogen 2.878 N/A ALA 100.A N GLY 86.A O no hydrogen 3.273 N/A GLU 101.A N ASN 440.A O no hydrogen 2.922 N/A ILE 106.A N GLY 132.A O no hydrogen 3.145 N/A CYS 107.A N LEU 188.A O no hydrogen 2.884 N/A CYS 107.A SG ILE 134.A O no hydrogen 3.807 N/A GLY 108.A N ILE 134.A O no hydrogen 2.280 N/A ILE 109.A N LEU 190.A O no hydrogen 2.898 N/A VAL 110.A N SER 136.A O no hydrogen 3.180 N/A THR 113.A OG1 VAL 243.A O no hydrogen 3.036 N/A THR 118.A OG1 ASN 114.A O no hydrogen 2.877 N/A ILE 120.A N THR 116.A O no hydrogen 3.258 N/A PHE 121.A N SER 117.A O no hydrogen 2.911 N/A LYS 122.A N THR 118.A O no hydrogen 2.910 N/A LYS 122.A NZ LEU 190.A O no hydrogen 3.045 N/A SER 123.A N ALA 119.A O no hydrogen 2.918 N/A SER 123.A OG ALA 119.A O no hydrogen 2.855 N/A SER 123.A OG ILE 120.A O no hydrogen 2.776 N/A LEU 124.A N ILE 120.A O no hydrogen 2.868 N/A ILE 125.A N PHE 121.A O no hydrogen 3.024 N/A SER 126.A N LYS 122.A O no hydrogen 2.848 N/A SER 126.A OG LYS 122.A O no hydrogen 3.326 N/A SER 126.A OG SER 123.A O no hydrogen 2.177 N/A LEU 127.A N SER 123.A O no hydrogen 2.944 N/A LYS 128.A N LEU 124.A O no hydrogen 2.971 N/A THR 129.A N ILE 125.A O no hydrogen 2.981 N/A THR 129.A OG1 SER 126.A O no hydrogen 2.931 N/A THR 129.A OG1 ASN 131.A OD1 no hydrogen 2.422 N/A ARG 130.A N LEU 127.A O no hydrogen 3.246 N/A ARG 130.A NH1 THR 84.A O no hydrogen 2.883 N/A ASN 131.A N SER 126.A O no hydrogen 3.129 N/A ASN 131.A ND2 GLN 19.A OE1 no hydrogen 3.452 N/A ILE 133.A N ILE 165.A O no hydrogen 3.351 N/A ILE 134.A N ILE 106.A O no hydrogen 2.630 N/A PHE 135.A N GLY 167.A O no hydrogen 2.837 N/A SER 136.A N GLY 108.A O no hydrogen 2.508 N/A SER 136.A OG GLY 108.A O no hydrogen 3.272 N/A SER 136.A OG SER 136.A O no hydrogen 2.303 N/A ARG 140.A N HIS 138.A ND1 no hydrogen 2.941 N/A LYS 142.A N GLU 55.A OE2 no hydrogen 2.513 N/A LYS 142.A NZ PRO 139.A O no hydrogen 2.167 N/A ASN 143.A N GLU 55.A OE2 no hydrogen 2.454 N/A SER 144.A N GLU 55.A OE1 no hydrogen 2.434 N/A SER 144.A OG MET 51.A O no hydrogen 2.990 N/A SER 144.A OG GLU 55.A OE1 no hydrogen 2.831 N/A THR 145.A OG1 LYS 142.A O no hydrogen 2.334 N/A THR 145.A OG1 ASN 146.A OD1 no hydrogen 3.279 N/A ASN 146.A N LYS 142.A O no hydrogen 2.641 N/A ALA 147.A N ASN 143.A O no hydrogen 2.858 N/A ALA 148.A N SER 144.A O no hydrogen 2.898 N/A ALA 149.A N THR 145.A O no hydrogen 2.872 N/A LYS 150.A N ASN 146.A O no hydrogen 2.903 N/A LEU 151.A N ALA 147.A O no hydrogen 2.891 N/A VAL 152.A N ALA 148.A O no hydrogen 2.865 N/A LEU 153.A N ALA 149.A O no hydrogen 2.969 N/A ASP 154.A N LYS 150.A O no hydrogen 2.803 N/A ALA 155.A N LEU 151.A O no hydrogen 2.960 N/A ALA 156.A N VAL 152.A O no hydrogen 2.929 N/A ILE 157.A N LEU 153.A O no hydrogen 2.783 N/A ALA 158.A N ASP 154.A O no hydrogen 2.937 N/A GLY 160.A N ILE 157.A O no hydrogen 3.204 N/A LYS 163.A NZ ASP 164.A OD2 no hydrogen 2.782 N/A GLY 167.A N ILE 133.A O no hydrogen 2.979 N/A ASP 170.A N VAL 2.A O no hydrogen 3.125 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.508 N/A SER 177.A N SER 173.A O no hydrogen 3.012 N/A SER 177.A OG SER 173.A O no hydrogen 3.468 N/A SER 177.A OG VAL 174.A O no hydrogen 2.267 N/A ASN 178.A N VAL 174.A O no hydrogen 2.878 N/A ALA 179.A N GLU 175.A O no hydrogen 2.863 N/A LEU 180.A N LEU 176.A O no hydrogen 2.971 N/A MET 181.A N SER 177.A O no hydrogen 2.848 N/A LYS 182.A N ASN 178.A O no hydrogen 2.737 N/A LYS 182.A NZ SER 204.A O no hydrogen 2.824 N/A HIS 183.A N LEU 180.A O no hydrogen 2.885 N/A HIS 183.A NE2 ASP 9.A OD1 no hydrogen 2.470 N/A GLY 185.A N HIS 183.A ND1 no hydrogen 3.128 N/A GLY 185.A N ASP 184.A OD1 no hydrogen 2.624 N/A ALA 187.A N ILE 105.A O no hydrogen 2.150 N/A LEU 188.A N ILE 105.A O no hydrogen 2.904 N/A LEU 190.A N CYS 107.A O no hydrogen 2.895 N/A THR 192.A OG1 VAL 211.A O no hydrogen 2.333 N/A MET 197.A N GLY 194.A O no hydrogen 3.017 N/A VAL 198.A N GLY 194.A O no hydrogen 3.473 N/A LYS 199.A N PRO 195.A O no hydrogen 3.357 N/A ALA 200.A N GLY 196.A O no hydrogen 3.512 N/A ALA 201.A N MET 197.A O no hydrogen 2.992 N/A TYR 202.A N VAL 198.A O no hydrogen 2.833 N/A TYR 202.A OH CYS 421.A O no hydrogen 2.240 N/A SER 203.A N LYS 199.A O no hydrogen 2.952 N/A SER 203.A OG LYS 199.A O no hydrogen 3.073 N/A SER 204.A N TYR 202.A O no hydrogen 2.788 N/A SER 204.A OG ALA 201.A O no hydrogen 3.138 N/A LYS 206.A N SER 204.A OG no hydrogen 3.068 N/A LYS 206.A NZ HIS 183.A O no hydrogen 3.443 N/A LYS 206.A NZ ILE 186.A O no hydrogen 3.556 N/A GLY 210.A N CYS 421.A O no hydrogen 3.356 N/A VAL 211.A N ALA 191.A O no hydrogen 3.127 N/A ASN 215.A ND2 ALA 333.A O no hydrogen 3.282 N/A ASN 215.A ND2 MET 359.A O no hydrogen 2.390 N/A VAL 218.A N ALA 250.A O no hydrogen 3.093 N/A VAL 219.A N GLY 370.A O no hydrogen 2.993 N/A ILE 220.A N ILE 252.A O no hydrogen 2.848 N/A ASP 221.A N TYR 372.A O no hydrogen 3.331 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.519 N/A ARG 228.A NH1 ASP 225.A OD2 no hydrogen 2.231 N/A VAL 230.A N ILE 226.A O no hydrogen 2.954 N/A ALA 231.A N LYS 227.A O no hydrogen 2.805 N/A SER 232.A N ARG 228.A O no hydrogen 2.931 N/A SER 232.A OG TYR 372.A OH no hydrogen 2.569 N/A ILE 233.A N ALA 229.A O no hydrogen 2.923 N/A LEU 234.A N VAL 230.A O no hydrogen 2.950 N/A MET 235.A N ALA 231.A O no hydrogen 3.051 N/A SER 236.A N SER 232.A O no hydrogen 2.993 N/A SER 236.A OG SER 232.A O no hydrogen 3.322 N/A SER 236.A OG ILE 233.A O no hydrogen 3.314 N/A LYS 237.A N ILE 233.A O no hydrogen 2.747 N/A LYS 237.A NZ SER 338.A O no hydrogen 3.295 N/A THR 238.A N LEU 234.A O no hydrogen 2.932 N/A THR 238.A OG1 LEU 234.A O no hydrogen 2.800 N/A THR 238.A OG1 MET 235.A O no hydrogen 2.973 N/A PHE 239.A N SER 236.A O no hydrogen 3.154 N/A ASN 241.A N THR 238.A O no hydrogen 3.104 N/A GLY 242.A N PHE 239.A O no hydrogen 2.500 N/A CYS 245.A SG HIS 367.A NE2 no hydrogen 3.941 N/A CYS 245.A SG SER 416.A O no hydrogen 3.160 N/A SER 247.A OG GLU 248.A O no hydrogen 3.510 N/A GLN 249.A N VAL 216.A O no hydrogen 2.948 N/A ALA 250.A N VAL 216.A O no hydrogen 3.396 N/A ALA 250.A N GLU 248.A OE2 no hydrogen 3.149 N/A ALA 251.A N GLY 342.A O no hydrogen 3.143 N/A ILE 252.A N VAL 218.A O no hydrogen 2.960 N/A VAL 254.A N ILE 220.A O no hydrogen 3.167 N/A SER 255.A OG ASP 347.A O no hydrogen 3.140 N/A GLU 260.A N GLU 260.A OE1 no hydrogen 2.527 N/A VAL 261.A N VAL 257.A O no hydrogen 3.404 N/A LYS 262.A N TYR 258.A O no hydrogen 2.986 N/A LYS 262.A NZ GLU 321.A OE2 no hydrogen 3.073 N/A GLU 263.A N ASP 259.A O no hydrogen 2.888 N/A ARG 264.A N GLU 260.A O no hydrogen 2.953 N/A ARG 264.A NH2 THR 267.A OG1 no hydrogen 3.389 N/A PHE 265.A N VAL 261.A O no hydrogen 3.017 N/A ALA 266.A N LYS 262.A O no hydrogen 2.873 N/A THR 267.A N GLU 263.A O no hydrogen 2.355 N/A THR 267.A OG1 GLU 263.A O no hydrogen 3.343 N/A THR 267.A OG1 ARG 264.A O no hydrogen 2.256 N/A HIS 268.A N PHE 265.A O no hydrogen 2.679 N/A HIS 271.A N VAL 317.A O no hydrogen 2.907 N/A ALA 278.A N LYS 275.A O no hydrogen 2.522 N/A LYS 280.A N ALA 276.A O no hydrogen 2.839 N/A LYS 280.A NZ GLY 308.A O no hydrogen 2.403 N/A VAL 281.A N ASP 277.A O no hydrogen 2.898 N/A VAL 281.A N ALA 278.A O no hydrogen 3.266 N/A ARG 282.A N ALA 278.A O no hydrogen 2.855 N/A LYS 283.A N ASP 279.A O no hydrogen 2.883 N/A LYS 283.A NZ LYS 280.A O no hydrogen 3.097 N/A LYS 283.A NZ ALA 307.A O no hydrogen 3.323 N/A LEU 285.A N VAL 281.A O no hydrogen 2.882 N/A LEU 286.A N ARG 282.A O no hydrogen 3.292 N/A ASP 288.A N ASP 288.A OD1 no hydrogen 2.457 N/A ALA 290.A N ASP 288.A OD1 no hydrogen 2.957 N/A ASN 292.A ND2 VAL 284.A O no hydrogen 2.823 N/A LYS 294.A N ASN 292.A OD1 no hydrogen 3.402 N/A ILE 303.A N PRO 299.A O no hydrogen 2.844 N/A ALA 304.A N ALA 300.A O no hydrogen 2.890 N/A GLU 305.A N ALA 301.A O no hydrogen 3.007 N/A MET 306.A N ALA 302.A O no hydrogen 2.831 N/A ALA 307.A N ILE 303.A O no hydrogen 2.849 N/A ALA 307.A N ALA 304.A O no hydrogen 3.140 N/A GLY 308.A N GLU 305.A O no hydrogen 2.648 N/A VAL 309.A N ALA 304.A O no hydrogen 2.778 N/A THR 315.A N PRO 312.A O no hydrogen 3.290 N/A THR 315.A OG1 LYS 269.A O no hydrogen 2.208 N/A LYS 316.A N LYS 269.A O no hydrogen 3.268 N/A VAL 319.A N HIS 271.A O no hydrogen 2.870 N/A GLY 320.A N LEU 341.A O no hydrogen 2.825 N/A LEU 323.A N GLU 321.A O no hydrogen 2.350 N/A LYS 325.A NZ ASP 329.A OD1 no hydrogen 2.560 N/A SER 327.A OG ASP 329.A OD1 no hydrogen 2.106 N/A GLU 331.A N GLU 331.A OE2 no hydrogen 2.961 N/A PHE 332.A N ASP 330.A OD1 no hydrogen 2.915 N/A ALA 333.A N ASP 330.A O no hydrogen 3.141 N/A LYS 336.A NZ GLN 249.A O no hydrogen 2.616 N/A SER 338.A OG LYS 336.A O no hydrogen 3.204 N/A SER 338.A OG THR 340.A OG1 no hydrogen 3.376 N/A THR 340.A N SER 338.A O no hydrogen 2.418 N/A THR 340.A OG1 SER 338.A OG no hydrogen 3.376 N/A LEU 341.A N LEU 318.A O no hydrogen 2.891 N/A LEU 343.A N GLY 320.A O no hydrogen 2.936 N/A PHE 344.A N ALA 251.A O no hydrogen 2.449 N/A ALA 346.A N VAL 253.A O no hydrogen 2.504 N/A ASP 347.A N ASP 351.A OD2 no hydrogen 2.370 N/A GLU 350.A N GLU 350.A OE1 no hydrogen 2.593 N/A ASP 351.A N ASN 348.A OD1 no hydrogen 2.346 N/A ALA 352.A N ASN 348.A O no hydrogen 3.005 N/A VAL 353.A N PHE 349.A O no hydrogen 2.931 N/A ALA 354.A N GLU 350.A O no hydrogen 2.896 N/A GLN 355.A N ASP 351.A O no hydrogen 2.940 N/A ALA 356.A N ALA 352.A O no hydrogen 2.816 N/A VAL 357.A N VAL 353.A O no hydrogen 2.939 N/A THR 358.A N ALA 354.A O no hydrogen 2.995 N/A THR 358.A OG1 ALA 354.A O no hydrogen 3.025 N/A THR 358.A OG1 GLN 355.A O no hydrogen 2.574 N/A MET 359.A N GLN 355.A O no hydrogen 2.779 N/A VAL 360.A N ALA 356.A O no hydrogen 2.856 N/A GLU 361.A N VAL 357.A O no hydrogen 3.147 N/A GLY 363.A N VAL 360.A O no hydrogen 2.751 N/A GLY 364.A N GLU 361.A O no hydrogen 2.938 N/A SER 369.A N ARG 393.A O no hydrogen 2.999 N/A SER 369.A OG THR 391.A OG1 no hydrogen 2.793 N/A GLY 370.A N PRO 217.A O no hydrogen 2.984 N/A LEU 371.A N LEU 395.A O no hydrogen 2.900 N/A TYR 372.A N VAL 219.A O no hydrogen 2.971 N/A TYR 372.A OH SER 232.A OG no hydrogen 2.569 N/A THR 373.A N ASN 397.A OD1 no hydrogen 2.748 N/A THR 373.A OG1 ASP 221.A OD1 no hydrogen 3.190 N/A THR 373.A OG1 ASP 221.A OD2 no hydrogen 2.263 N/A THR 373.A OG1 ASN 374.A O no hydrogen 3.185 N/A ASN 374.A ND2 THR 223.A OG1 no hydrogen 3.079 N/A GLN 375.A N GLN 375.A OE1 no hydrogen 2.260 N/A ARG 381.A N ASP 380.A OD1 no hydrogen 2.383 N/A ARG 381.A NH2 GLU 222.A OE2 no hydrogen 2.302 N/A ARG 383.A N ALA 379.A O no hydrogen 3.027 N/A TYR 384.A N ASP 380.A O no hydrogen 2.851 N/A PHE 385.A N ARG 381.A O no hydrogen 2.975 N/A GLY 386.A N ILE 382.A O no hydrogen 2.896 N/A ASP 387.A N ARG 383.A O no hydrogen 2.799 N/A LYS 388.A N TYR 384.A O no hydrogen 3.127 N/A LYS 388.A NZ TYR 384.A O no hydrogen 2.654 N/A LEU 389.A N PHE 385.A O no hydrogen 3.098 N/A LYS 390.A NZ ASP 387.A O no hydrogen 2.906 N/A LYS 390.A NZ LYS 388.A O no hydrogen 2.898 N/A THR 391.A OG1 SER 369.A OG no hydrogen 2.793 N/A THR 391.A OG1 ARG 393.A O no hydrogen 3.192 N/A ARG 393.A N THR 391.A OG1 no hydrogen 3.344 N/A LEU 395.A N SER 369.A O no hydrogen 2.938 N/A ASN 397.A N LEU 371.A O no hydrogen 2.475 N/A ASN 397.A ND2 THR 373.A O no hydrogen 2.658 N/A THR 400.A OG1 ALA 246.A O no hydrogen 2.454 N/A THR 400.A OG1 THR 400.A O no hydrogen 2.140 N/A HIS 402.A NE2 ALA 414.A O no hydrogen 3.153 N/A LEU 408.A N ASP 407.A OD1 no hydrogen 2.681 N/A SER 416.A OG CYS 245.A O no hydrogen 2.653 N/A THR 418.A OG1 LEU 417.A O no hydrogen 2.434 N/A GLY 420.A N GLU 431.A O no hydrogen 3.165 N/A CYS 421.A SG SER 423.A OG no hydrogen 3.719 N/A CYS 421.A SG ILE 429.A O no hydrogen 3.999 N/A CYS 421.A SG GLU 431.A OE1 no hydrogen 3.731 N/A CYS 421.A SG GLU 431.A OE2 no hydrogen 3.896 N/A SER 428.A OG GLY 364.A O no hydrogen 3.496 N/A SER 428.A OG SER 423.A O no hydrogen 3.498 N/A SER 428.A OG TRP 424.A O no hydrogen 2.593 N/A GLU 431.A N GLY 420.A O no hydrogen 2.768 N/A GLY 434.A N HIS 437.A ND1 no hydrogen 2.714 N/A HIS 437.A N GLY 434.A O no hydrogen 2.816 N/A HIS 437.A ND1 GLY 434.A O no hydrogen 2.600 N/A LEU 438.A N PRO 435.A O no hydrogen 2.584 N/A ILE 439.A N LYS 436.A O no hydrogen 3.442 N/A ASN 440.A N GLU 101.A O no hydrogen 2.879 N/A LYS 442.A N ILE 99.A O no hydrogen 2.918 N/A THR 443.A OG1 THR 98.A OG1 no hydrogen 3.264 N/A VAL 444.A N MET 97.A O no hydrogen 2.860 N/A LYS 446.A N LEU 94.A O no hydrogen 3.180 N/A GLU 449.A N GLU 449.A OE1 no hydrogen 2.923 N/A SER 459.A OG GLN 628.A O no hydrogen 2.360 N/A TYR 461.A N ALA 630.A O no hydrogen 2.985 N/A SER 466.A N ARG 463.A O no hydrogen 2.793 N/A SER 466.A N ASP 633.A OD2 no hydrogen 3.287 N/A SER 466.A OG ASP 633.A OD2 no hydrogen 3.260 N/A ALA 470.A N SER 466.A O no hydrogen 2.450 N/A LEU 471.A N LEU 467.A O no hydrogen 2.836 N/A SER 472.A OG PRO 468.A O no hydrogen 2.272 N/A LEU 474.A N LEU 471.A O no hydrogen 3.027 N/A LYS 478.A N ASP 536.A OD2 no hydrogen 3.028 N/A ARG 479.A N ASP 536.A OD2 no hydrogen 2.330 N/A ALA 480.A N GLU 507.A O no hydrogen 3.162 N/A PHE 481.A N VAL 537.A O no hydrogen 2.886 N/A LEU 482.A N GLN 509.A O no hydrogen 3.042 N/A VAL 483.A N LEU 539.A O no hydrogen 2.829 N/A THR 484.A N PHE 511.A O no hydrogen 2.820 N/A THR 484.A OG1 ASP 485.A O no hydrogen 3.310 N/A ARG 486.A N ASP 485.A OD1 no hydrogen 2.683 N/A PHE 489.A N ASP 485.A O no hydrogen 2.746 N/A ASN 490.A N ARG 486.A O no hydrogen 2.802 N/A ASN 491.A N PHE 487.A O no hydrogen 2.944 N/A TYR 493.A N ASN 491.A O no hydrogen 2.697 N/A ASP 496.A N TYR 493.A O no hydrogen 3.023 N/A ASP 496.A N ASP 495.A OD1 no hydrogen 2.462 N/A VAL 498.A N ALA 494.A O no hydrogen 2.909 N/A ALA 499.A N ASP 495.A O no hydrogen 2.901 N/A LEU 500.A N ASP 496.A O no hydrogen 2.944 N/A LEU 501.A N VAL 497.A O no hydrogen 2.809 N/A LYS 502.A N VAL 498.A O no hydrogen 2.853 N/A LYS 502.A NZ MET 506.A O no hydrogen 2.071 N/A GLN 504.A N GLN 504.A OE1 no hydrogen 2.124 N/A GLY 505.A N LEU 501.A O no hydrogen 2.664 N/A GLU 507.A N GLU 507.A OE1 no hydrogen 2.534 N/A ASP 517.A N GLU 515.A OE1 no hydrogen 2.369 N/A THR 519.A OG1 SER 521.A OG no hydrogen 2.342 N/A SER 521.A N THR 519.A OG1 no hydrogen 2.465 N/A SER 521.A OG THR 519.A OG1 no hydrogen 2.342 N/A VAL 522.A N THR 519.A OG1 no hydrogen 2.876 N/A GLU 524.A N GLU 524.A OE1 no hydrogen 2.467 N/A LYS 525.A NZ SER 521.A O no hydrogen 3.566 N/A GLY 526.A N VAL 522.A O no hydrogen 2.835 N/A ALA 527.A N VAL 523.A O no hydrogen 2.916 N/A ALA 528.A N GLU 524.A O no hydrogen 2.847 N/A ALA 529.A N LYS 525.A O no hydrogen 2.838 N/A MET 530.A N GLY 526.A O no hydrogen 2.948 N/A GLN 531.A N ALA 527.A O no hydrogen 2.877 N/A GLN 531.A NE2 ALA 528.A O no hydrogen 2.800 N/A SER 532.A N ALA 528.A O no hydrogen 2.864 N/A SER 532.A OG ALA 528.A O no hydrogen 3.467 N/A SER 532.A OG ALA 529.A O no hydrogen 2.071 N/A PHE 533.A N ALA 529.A O no hydrogen 2.936 N/A GLN 534.A N MET 530.A O no hydrogen 2.437 N/A ASP 536.A N ARG 479.A O no hydrogen 3.278 N/A ILE 538.A N GLU 589.A O no hydrogen 2.891 N/A LEU 539.A N PHE 481.A O no hydrogen 2.767 N/A ALA 540.A N VAL 591.A O no hydrogen 2.860 N/A LEU 541.A N VAL 483.A O no hydrogen 2.876 N/A GLY 542.A N ILE 593.A O no hydrogen 2.916 N/A SER 545.A OG ALA 516.A O no hydrogen 2.382 N/A MET 547.A N GLY 544.A O no hydrogen 3.023 N/A ALA 549.A N SER 545.A O no hydrogen 3.397 N/A ALA 550.A N PRO 546.A O no hydrogen 3.473 N/A LYS 551.A N MET 547.A O no hydrogen 2.996 N/A LYS 551.A NZ SER 601.A O no hydrogen 3.483 N/A LYS 551.A NZ PHE 606.A O no hydrogen 3.429 N/A ILE 552.A N ASP 548.A O no hydrogen 2.851 N/A MET 553.A N ALA 549.A O no hydrogen 2.823 N/A TRP 554.A N ALA 550.A O no hydrogen 2.342 N/A VAL 555.A N LYS 551.A O no hydrogen 2.746 N/A MET 556.A N ILE 552.A O no hydrogen 2.900 N/A TYR 557.A N MET 553.A O no hydrogen 2.906 N/A TYR 557.A OH PRO 535.A O no hydrogen 3.356 N/A GLU 558.A N TRP 554.A O no hydrogen 3.274 N/A HIS 559.A N VAL 555.A O no hydrogen 3.070 N/A ASP 561.A N ASP 561.A OD1 no hydrogen 2.192 N/A THR 562.A OG1 HIS 563.A O no hydrogen 3.207 N/A PHE 564.A N GLU 565.A OE1 no hydrogen 2.980 N/A GLU 565.A N GLU 565.A OE1 no hydrogen 2.085 N/A GLU 566.A N GLU 566.A OE1 no hydrogen 2.261 N/A ALA 568.A N PHE 564.A O no hydrogen 3.065 N/A MET 569.A N GLU 565.A O no hydrogen 2.478 N/A ARG 570.A N GLU 566.A O no hydrogen 2.811 N/A PHE 571.A N ALA 568.A O no hydrogen 3.190 N/A LYS 576.A NZ ASP 573.A OD1 no hydrogen 2.038 N/A ILE 578.A N LYS 576.A O no hydrogen 2.617 N/A LYS 586.A NZ HIS 559.A NE2 no hydrogen 2.892 N/A LYS 586.A NZ LYS 583.A O no hydrogen 2.781 N/A LYS 587.A NZ TYR 557.A O no hydrogen 2.755 N/A GLU 589.A N ASP 536.A O no hydrogen 3.347 N/A LEU 590.A N GLN 628.A OE1 no hydrogen 2.783 N/A VAL 591.A N ILE 538.A O no hydrogen 2.976 N/A CYS 592.A N MET 629.A O no hydrogen 2.898 N/A ILE 593.A N ALA 540.A O no hydrogen 2.903 N/A THR 594.A OG1 THR 596.A O no hydrogen 3.426 N/A SER 597.A OG VAL 701.A O no hydrogen 3.344 N/A THR 599.A OG1 SER 601.A OG no hydrogen 2.867 N/A SER 601.A N THR 599.A OG1 no hydrogen 3.084 N/A SER 601.A OG THR 599.A OG1 no hydrogen 2.867 N/A GLU 602.A N GLU 602.A OE1 no hydrogen 2.415 N/A VAL 603.A N GLY 600.A O no hydrogen 3.271 N/A THR 604.A N GLY 600.A O no hydrogen 3.226 N/A THR 604.A OG1 GLY 600.A O no hydrogen 3.499 N/A THR 604.A OG1 SER 601.A O no hydrogen 2.891 N/A ALA 607.A N LEU 620.A O no hydrogen 2.893 N/A VAL 609.A N TYR 618.A O no hydrogen 3.000 N/A THR 610.A N PRO 518.A O no hydrogen 3.166 N/A THR 610.A OG1 ASP 517.A OD2 no hydrogen 2.184 N/A THR 610.A OG1 PRO 518.A O no hydrogen 3.235 N/A ASP 611.A N ALA 616.A O no hydrogen 2.753 N/A ASP 612.A N ASP 611.A OD1 no hydrogen 2.342 N/A LYS 613.A NZ ASP 611.A OD2 no hydrogen 2.759 N/A LYS 617.A NZ ASP 837.A OD1 no hydrogen 2.447 N/A LYS 617.A NZ ASP 837.A OD2 no hydrogen 3.149 N/A TYR 618.A N VAL 609.A O no hydrogen 2.862 N/A TYR 618.A OH ASP 611.A OD2 no hydrogen 3.350 N/A LEU 620.A N ALA 607.A O no hydrogen 2.814 N/A ASP 622.A N PRO 605.A O no hydrogen 3.306 N/A GLU 624.A N GLU 624.A OE1 no hydrogen 2.777 N/A LEU 625.A N ASP 622.A O no hydrogen 2.869 N/A THR 626.A N TYR 623.A O no hydrogen 3.097 N/A THR 626.A OG1 TYR 623.A O no hydrogen 2.879 N/A GLN 628.A N GLN 628.A OE1 no hydrogen 2.489 N/A ALA 630.A N SER 459.A O no hydrogen 2.927 N/A ILE 631.A N CYS 592.A O no hydrogen 3.001 N/A VAL 632.A N TYR 461.A O no hydrogen 2.850 N/A ALA 634.A N ASP 633.A OD1 no hydrogen 2.340 N/A ASN 635.A N ASP 633.A OD1 no hydrogen 2.924 N/A ASN 635.A ND2 ASP 633.A OD2 no hydrogen 2.977 N/A MET 638.A N LEU 636.A O no hydrogen 3.236 N/A ASN 639.A ND2 TYR 493.A OH no hydrogen 3.356 N/A LYS 642.A NZ MET 640.A O no hydrogen 3.524 N/A SER 643.A OG TYR 688.A OH no hydrogen 3.064 N/A THR 645.A N PRO 641.A O no hydrogen 3.515 N/A PHE 647.A N SER 643.A O no hydrogen 2.817 N/A GLY 648.A N LEU 644.A O no hydrogen 2.966 N/A GLY 649.A N THR 645.A O no hydrogen 2.938 N/A TYR 650.A N ALA 646.A O no hydrogen 2.829 N/A ASP 651.A N PHE 647.A O no hydrogen 2.963 N/A ALA 652.A N GLY 648.A O no hydrogen 2.962 N/A VAL 653.A N GLY 649.A O no hydrogen 2.842 N/A THR 654.A N TYR 650.A O no hydrogen 2.923 N/A THR 654.A OG1 TYR 650.A O no hydrogen 3.325 N/A THR 654.A OG1 ASP 651.A O no hydrogen 2.251 N/A THR 654.A OG1 ASP 651.A OD1 no hydrogen 3.480 N/A HIS 655.A N ASP 651.A O no hydrogen 2.909 N/A ALA 656.A N ALA 652.A O no hydrogen 2.902 N/A LEU 657.A N VAL 653.A O no hydrogen 2.990 N/A GLU 658.A N THR 654.A O no hydrogen 2.977 N/A ALA 659.A N HIS 655.A O no hydrogen 2.945 N/A TYR 660.A N ALA 656.A O no hydrogen 2.991 N/A TYR 660.A OH GLU 775.A OE1 no hydrogen 2.594 N/A SER 662.A N ALA 659.A O no hydrogen 3.175 N/A SER 662.A OG ALA 659.A O no hydrogen 2.520 N/A VAL 663.A N ALA 842.A O no hydrogen 2.946 N/A ALA 665.A N SER 662.A O no hydrogen 2.956 N/A SER 669.A N ASN 666.A OD1 no hydrogen 2.945 N/A SER 669.A OG ASN 666.A O no hydrogen 3.390 N/A SER 669.A OG ASN 666.A OD1 no hydrogen 2.988 N/A ASP 670.A N GLU 667.A O no hydrogen 3.241 N/A ALA 673.A N SER 669.A O no hydrogen 2.998 N/A ALA 673.A N GLN 672.A OE1 no hydrogen 2.659 N/A LEU 674.A N ASP 670.A O no hydrogen 2.878 N/A GLN 675.A N GLY 671.A O no hydrogen 2.912 N/A ALA 676.A N GLN 672.A O no hydrogen 2.878 N/A LEU 677.A N ALA 673.A O no hydrogen 2.987 N/A LYS 678.A N LEU 674.A O no hydrogen 2.874 N/A LYS 678.A NZ HIS 779.A O no hydrogen 2.455 N/A MET 679.A N GLN 675.A O no hydrogen 2.893 N/A LEU 680.A N ALA 676.A O no hydrogen 2.962 N/A LEU 680.A N LEU 677.A O no hydrogen 3.396 N/A GLU 682.A N GLU 682.A OE1 no hydrogen 2.393 N/A TYR 683.A N LEU 680.A O no hydrogen 3.102 N/A LEU 684.A N LEU 680.A O no hydrogen 3.012 N/A SER 686.A OG GLU 682.A O no hydrogen 3.454 N/A SER 686.A OG TYR 683.A O no hydrogen 2.967 N/A SER 687.A N TYR 683.A O no hydrogen 2.984 N/A TYR 688.A N LEU 684.A O no hydrogen 2.886 N/A TYR 688.A OH SER 643.A OG no hydrogen 3.064 N/A ALA 689.A N PRO 685.A O no hydrogen 2.898 N/A ASN 690.A N SER 686.A O no hydrogen 2.316 N/A LYS 693.A NZ GLY 691.A O no hydrogen 3.266 N/A ILE 696.A N ASP 694.A OD1 no hydrogen 3.117 N/A ARG 698.A NE VAL 637.A O no hydrogen 2.899 N/A ARG 698.A NH2 MET 640.A O no hydrogen 3.169 N/A GLU 699.A N GLU 699.A OE1 no hydrogen 2.640 N/A LYS 700.A N ILE 696.A O no hydrogen 3.144 N/A VAL 701.A N ALA 697.A O no hydrogen 2.851 N/A HIS 702.A N ARG 698.A O no hydrogen 2.935 N/A ASN 703.A N GLU 699.A O no hydrogen 2.880 N/A ALA 704.A N LYS 700.A O no hydrogen 2.889 N/A ALA 705.A N VAL 701.A O no hydrogen 2.863 N/A THR 706.A N HIS 702.A O no hydrogen 3.002 N/A THR 706.A OG1 HIS 702.A O no hydrogen 3.566 N/A THR 706.A OG1 ASN 703.A O no hydrogen 2.274 N/A ILE 707.A N ASN 703.A O no hydrogen 2.859 N/A ALA 708.A N ALA 704.A O no hydrogen 2.875 N/A GLY 709.A N ALA 705.A O no hydrogen 2.947 N/A ILE 710.A N THR 706.A O no hydrogen 2.908 N/A ALA 711.A N ILE 707.A O no hydrogen 2.854 N/A PHE 712.A N ALA 708.A O no hydrogen 2.979 N/A ALA 713.A N ILE 710.A O no hydrogen 3.362 N/A ASN 714.A N ALA 711.A O no hydrogen 3.329 N/A HIS 721.A N GLY 718.A O no hydrogen 2.904 N/A SER 722.A OG VAL 719.A O no hydrogen 3.411 N/A SER 722.A OG ASP 837.A O no hydrogen 2.908 N/A MET 723.A N VAL 719.A O no hydrogen 3.009 N/A ALA 724.A N CYS 720.A O no hydrogen 2.810 N/A HIS 725.A N HIS 721.A O no hydrogen 2.868 N/A LYS 726.A N SER 722.A O no hydrogen 2.945 N/A ILE 727.A N MET 723.A O no hydrogen 3.034 N/A GLY 728.A N ALA 724.A O no hydrogen 2.896 N/A ALA 729.A N HIS 725.A O no hydrogen 2.875 N/A GLU 730.A N LYS 726.A O no hydrogen 3.039 N/A GLU 730.A N GLU 730.A OE1 no hydrogen 2.594 N/A PHE 731.A N ILE 727.A O no hydrogen 3.348 N/A ASN 739.A ND2 ASP 651.A OD1 no hydrogen 3.278 N/A LEU 741.A N ALA 738.A O no hydrogen 3.149 N/A LEU 742.A N ASN 739.A O no hydrogen 2.707 N/A ILE 743.A N ASN 739.A O no hydrogen 3.175 N/A ASN 745.A ND2 LYS 863.A O no hydrogen 3.275 N/A VAL 746.A N LEU 742.A O no hydrogen 3.173 N/A VAL 747.A N ILE 743.A O no hydrogen 3.054 N/A VAL 747.A N ALA 744.A O no hydrogen 3.028 N/A ARG 748.A N ALA 744.A O no hydrogen 3.263 N/A ARG 748.A NH1 ASN 745.A OD1 no hydrogen 3.049 N/A TYR 749.A N ASN 745.A O no hydrogen 2.748 N/A TYR 749.A OH TYR 846.A O no hydrogen 2.382 N/A TYR 749.A OH GLU 851.A OE1 no hydrogen 2.521 N/A ASN 750.A N VAL 746.A O no hydrogen 3.081 N/A ASN 750.A ND2 TYR 773.A OH no hydrogen 2.591 N/A ALA 751.A N ARG 748.A O no hydrogen 3.039 N/A ASN 754.A N ASP 753.A OD1 no hydrogen 2.494 N/A THR 759.A OG1 SER 762.A OG no hydrogen 2.997 N/A SER 762.A OG THR 759.A OG1 no hydrogen 2.997 N/A GLN 763.A N GLN 763.A OE1 no hydrogen 2.486 N/A GLN 768.A NE2 ASN 752.A O no hydrogen 2.832 N/A ARG 770.A N GLN 768.A OE1 no hydrogen 2.903 N/A ARG 771.A NE GLN 768.A O no hydrogen 2.585 N/A ARG 771.A NH2 GLN 768.A O no hydrogen 2.579 N/A TYR 773.A N ALA 769.A O no hydrogen 2.866 N/A ALA 774.A N ARG 770.A O no hydrogen 2.928 N/A GLU 775.A N ARG 771.A O no hydrogen 2.842 N/A VAL 776.A N ARG 772.A O no hydrogen 2.971 N/A ALA 777.A N TYR 773.A O no hydrogen 2.867 N/A ASP 778.A N ALA 774.A O no hydrogen 2.939 N/A HIS 779.A N GLU 775.A O no hydrogen 2.832 N/A LEU 780.A N VAL 776.A O no hydrogen 2.829 N/A GLY 781.A N ASP 778.A O no hydrogen 2.713 N/A LEU 782.A N ALA 777.A O no hydrogen 2.592 N/A LYS 792.A N ARG 788.A O no hydrogen 3.222 N/A ILE 793.A N THR 789.A O no hydrogen 2.873 N/A GLU 794.A N ALA 790.A O no hydrogen 2.907 N/A ARG 795.A N GLN 791.A O no hydrogen 2.976 N/A LEU 796.A N LYS 792.A O no hydrogen 2.806 N/A LEU 797.A N ILE 793.A O no hydrogen 2.973 N/A THR 798.A N GLU 794.A O no hydrogen 2.851 N/A THR 798.A OG1 GLU 794.A O no hydrogen 2.237 N/A TRP 799.A N ARG 795.A O no hydrogen 2.875 N/A LEU 800.A N LEU 796.A O no hydrogen 3.024 N/A ASP 801.A N LEU 797.A O no hydrogen 2.814 N/A GLU 802.A N THR 798.A O no hydrogen 3.071 N/A LEU 803.A N TRP 799.A O no hydrogen 2.895 N/A LYS 804.A N LEU 800.A O no hydrogen 2.858 N/A VAL 805.A N ASP 801.A O no hydrogen 2.905 N/A ASN 806.A N GLU 802.A O no hydrogen 2.952 N/A ASN 806.A N LEU 803.A O no hydrogen 2.882 N/A LEU 807.A N LYS 804.A O no hydrogen 3.382 N/A ASP 808.A N VAL 805.A O no hydrogen 2.985 N/A GLN 814.A N TYR 860.A O no hydrogen 3.202 N/A GLN 814.A NE2 SER 812.A OG no hydrogen 3.418 N/A ALA 815.A N SER 812.A OG no hydrogen 3.190 N/A ALA 816.A N SER 812.A O no hydrogen 2.911 N/A GLY 817.A N GLN 814.A O no hydrogen 2.893 N/A PHE 823.A N ALA 819.A O no hydrogen 3.458 N/A LEU 824.A N GLU 820.A O no hydrogen 2.916 N/A ALA 825.A N ALA 821.A O no hydrogen 2.914 N/A LYS 826.A N ASP 822.A O no hydrogen 2.851 N/A LYS 826.A N PHE 823.A O no hydrogen 3.252 N/A VAL 827.A N PHE 823.A O no hydrogen 2.807 N/A GLU 829.A N GLU 829.A OE1 no hydrogen 2.585 N/A LEU 830.A N LYS 826.A O no hydrogen 3.062 N/A ALA 831.A N VAL 827.A O no hydrogen 2.810 N/A VAL 832.A N ASP 828.A O no hydrogen 3.416 N/A GLU 833.A N GLU 829.A O no hydrogen 3.047 N/A ALA 834.A N LEU 830.A O no hydrogen 2.828 N/A PHE 835.A N ALA 831.A O no hydrogen 2.893 N/A PHE 835.A N VAL 832.A O no hydrogen 3.206 N/A ASP 836.A N ASP 836.A OD1 no hydrogen 2.514 N/A ASP 837.A N GLU 833.A O no hydrogen 3.116 N/A GLN 838.A N ASP 836.A O no hydrogen 2.551 N/A CYS 839.A SG GLY 718.A O no hydrogen 3.294 N/A CYS 839.A SG SER 722.A OG no hydrogen 2.426 N/A CYS 839.A SG ASP 837.A O no hydrogen 3.082 N/A ARG 845.A N ASN 843.A OD1 no hydrogen 3.403 N/A LEU 848.A N GLU 851.A OE1 no hydrogen 3.370 N/A LEU 852.A N LEU 848.A O no hydrogen 3.529 N/A LYS 853.A N ILE 849.A O no hydrogen 3.367 N/A LYS 853.A NZ ASP 828.A OD1 no hydrogen 2.347 N/A GLU 854.A N ALA 850.A O no hydrogen 3.129 N/A VAL 855.A N GLU 851.A O no hydrogen 2.921 N/A LEU 856.A N LEU 852.A O no hydrogen 2.848 N/A LEU 857.A N LYS 853.A O no hydrogen 2.992 N/A ALA 858.A N GLU 854.A O no hydrogen 2.916 N/A SER 859.A N VAL 855.A O no hydrogen 2.861 N/A SER 859.A OG VAL 855.A O no hydrogen 2.812 N/A SER 859.A OG LEU 856.A O no hydrogen 2.730 N/A TYR 860.A N LEU 856.A O no hydrogen 2.933 N/A TYR 860.A OH VAL 818.A O no hydrogen 2.183 N/A TYR 861.A N LEU 857.A O no hydrogen 3.086 N/A GLY 862.A N SER 859.A O no hydrogen 2.879 N/A LYS 863.A N ALA 858.A O no hydrogen 2.373 N/A PHE 865.A N ASN 745.A OD1 no hydrogen 2.630 N/A