Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1s0v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ALA 254.A O no hydrogen 3.390 N/A ILE 5.A N GLU 47.A OE2 no hydrogen 2.926 N/A ALA 6.A N GLU 47.A OE2 no hydrogen 3.340 N/A LYS 7.A N ILE 5.A O no hydrogen 2.220 N/A SER 11.A N LYS 7.A O no hydrogen 3.032 N/A ASP 12.A N ASN 8.A O no hydrogen 3.091 N/A ASP 12.A N ASP 9.A O no hydrogen 2.845 N/A GLU 14.A N ASP 12.A O no hydrogen 2.648 N/A PHE 20.A N ILE 18.A O no hydrogen 2.495 N/A THR 22.A OG1 PRO 19.A O no hydrogen 3.069 N/A ALA 24.A N PHE 20.A O no hydrogen 2.971 N/A ASP 25.A N ASN 21.A O no hydrogen 2.914 N/A HIS 26.A N THR 22.A O no hydrogen 3.199 N/A TYR 27.A N LEU 23.A O no hydrogen 2.708 N/A TYR 27.A N ALA 24.A O no hydrogen 3.176 N/A GLY 28.A N ALA 24.A O no hydrogen 2.316 N/A ARG 30.A NE GLU 34.A OE2 no hydrogen 3.481 N/A ARG 30.A NH2 GLU 34.A OE2 no hydrogen 3.326 N/A ALA 32.A N GLY 28.A O no hydrogen 3.090 N/A ARG 33.A N GLU 29.A O no hydrogen 2.712 N/A GLU 34.A N ARG 30.A O no hydrogen 2.571 N/A GLN 35.A N LEU 31.A O no hydrogen 2.601 N/A ALA 37.A N ARG 33.A O no hydrogen 3.379 N/A LEU 38.A N GLU 34.A O no hydrogen 2.908 N/A GLU 39.A N GLN 35.A O no hydrogen 3.034 N/A HIS 40.A N LEU 36.A O no hydrogen 2.988 N/A GLU 41.A N ALA 37.A O no hydrogen 3.008 N/A SER 42.A N LEU 38.A O no hydrogen 2.881 N/A SER 42.A OG MET 266.A O no hydrogen 2.296 N/A TYR 43.A N GLU 39.A O no hydrogen 3.297 N/A GLU 44.A N HIS 40.A O no hydrogen 2.887 N/A MET 45.A N GLU 41.A O no hydrogen 2.439 N/A GLY 46.A N TYR 43.A O no hydrogen 2.641 N/A GLU 47.A N TYR 43.A O no hydrogen 2.792 N/A ALA 48.A N GLU 44.A O no hydrogen 3.422 N/A ARG 49.A N MET 45.A O no hydrogen 3.343 N/A PHE 50.A N GLY 46.A O no hydrogen 3.139 N/A ARG 51.A N GLU 47.A O no hydrogen 3.055 N/A ARG 51.A NH2 THR 2.A OG1 no hydrogen 2.788 N/A LYS 52.A N ALA 48.A O no hydrogen 3.319 N/A MET 53.A N ARG 49.A O no hydrogen 3.428 N/A PHE 54.A N PHE 50.A O no hydrogen 2.825 N/A GLU 55.A N ARG 51.A O no hydrogen 2.654 N/A ARG 56.A N LYS 52.A O no hydrogen 3.480 N/A GLN 57.A N PHE 54.A O no hydrogen 3.223 N/A LEU 58.A N PHE 54.A O no hydrogen 3.348 N/A LYS 59.A N GLU 55.A O no hydrogen 2.970 N/A LYS 59.A NZ LYS 59.A O no hydrogen 2.180 N/A GLY 61.A N LEU 58.A O no hydrogen 2.720 N/A ASP 65.A N GLU 62.A O no hydrogen 2.872 N/A ASN 66.A ND2 GLN 57.A OE1 no hydrogen 3.006 N/A ALA 68.A N ASN 66.A OD1 no hydrogen 3.056 N/A ALA 69.A N ASN 66.A O no hydrogen 2.745 N/A THR 74.A OG1 LYS 70.A O no hydrogen 2.635 N/A THR 74.A OG1 PRO 71.A O no hydrogen 3.324 N/A THR 75.A N LEU 72.A O no hydrogen 2.818 N/A THR 75.A OG1 LEU 72.A O no hydrogen 3.459 N/A LEU 76.A N LEU 72.A O no hydrogen 2.695 N/A ILE 81.A N LEU 77.A O no hydrogen 3.040 N/A ALA 82.A N PRO 78.A O no hydrogen 3.202 N/A ARG 83.A N LYS 79.A O no hydrogen 3.321 N/A ARG 83.A NH1 ARG 83.A O no hydrogen 2.885 N/A ARG 83.A NH2 GLU 90.A OE1 no hydrogen 2.784 N/A ILE 84.A N MET 80.A O no hydrogen 3.404 N/A ASN 85.A N ALA 82.A O no hydrogen 2.709 N/A ASP 86.A N ALA 82.A O no hydrogen 2.927 N/A TRP 87.A N ARG 83.A O no hydrogen 3.185 N/A GLU 89.A N ASP 86.A O no hydrogen 2.993 N/A ALA 93.A N GLU 89.A O no hydrogen 3.287 N/A LYS 94.A N VAL 91.A O no hydrogen 3.347 N/A PHE 104.A N ALA 101.A O no hydrogen 3.107 N/A LEU 105.A N ALA 101.A O no hydrogen 3.006 N/A GLN 106.A NE2 PHE 102.A O no hydrogen 2.443 N/A GLU 107.A N PHE 104.A O no hydrogen 2.609 N/A VAL 113.A N LYS 109.A O no hydrogen 3.063 N/A ALA 114.A N PRO 110.A O no hydrogen 2.775 N/A TYR 115.A N GLU 111.A O no hydrogen 3.059 N/A ILE 116.A N ALA 112.A O no hydrogen 2.710 N/A THR 117.A N VAL 113.A O no hydrogen 3.026 N/A THR 117.A OG1 VAL 113.A O no hydrogen 3.044 N/A LYS 119.A N TYR 115.A O no hydrogen 3.255 N/A LYS 119.A NZ ASP 65.A OD1 no hydrogen 3.538 N/A LYS 119.A NZ ASP 65.A OD2 no hydrogen 3.453 N/A THR 120.A OG1 ILE 116.A O no hydrogen 2.704 N/A THR 121.A N THR 117.A O no hydrogen 2.894 N/A THR 121.A OG1 THR 117.A O no hydrogen 2.033 N/A LEU 122.A N ILE 118.A O no hydrogen 3.112 N/A ALA 123.A N LYS 119.A O no hydrogen 2.803 N/A CYS 124.A N THR 120.A O no hydrogen 3.097 N/A CYS 124.A SG THR 120.A O no hydrogen 3.306 N/A LEU 125.A N THR 121.A O no hydrogen 2.852 N/A THR 126.A N ALA 123.A O no hydrogen 3.293 N/A THR 126.A OG1 LEU 122.A O no hydrogen 2.620 N/A THR 126.A OG1 ALA 123.A O no hydrogen 2.764 N/A SER 127.A N CYS 124.A O no hydrogen 3.013 N/A THR 131.A OG1 ASP 129.A O no hydrogen 3.150 N/A ALA 135.A N THR 132.A OG1 no hydrogen 3.257 N/A VAL 136.A N THR 132.A O no hydrogen 3.068 N/A ALA 137.A N VAL 133.A O no hydrogen 2.879 N/A SER 138.A N GLN 134.A O no hydrogen 3.234 N/A ALA 139.A N ALA 135.A O no hydrogen 2.820 N/A ILE 140.A N VAL 136.A O no hydrogen 3.141 N/A GLY 141.A N ALA 137.A O no hydrogen 3.206 N/A ARG 142.A N SER 138.A O no hydrogen 3.188 N/A ARG 142.A NH1 SER 208.A OG no hydrogen 2.980 N/A ALA 143.A N ALA 139.A O no hydrogen 3.170 N/A ILE 144.A N ILE 140.A O no hydrogen 2.974 N/A GLU 145.A N GLY 141.A O no hydrogen 2.881 N/A GLU 147.A N ALA 143.A O no hydrogen 3.340 N/A ALA 148.A N ILE 144.A O no hydrogen 3.238 N/A ALA 148.A N GLU 145.A O no hydrogen 3.200 N/A ARG 149.A N GLU 145.A O no hydrogen 3.103 N/A ARG 149.A NE GLU 186.A OE1 no hydrogen 3.134 N/A ARG 149.A NE GLU 186.A OE2 no hydrogen 3.244 N/A ARG 149.A NH2 GLU 186.A OE1 no hydrogen 2.948 N/A PHE 150.A N ASP 146.A O no hydrogen 2.642 N/A ILE 153.A N PHE 150.A O no hydrogen 3.342 N/A ASP 155.A N ARG 152.A O no hydrogen 3.280 N/A LEU 156.A N ARG 152.A O no hydrogen 3.075 N/A ALA 158.A N ILE 153.A O no hydrogen 2.826 N/A LYS 159.A N LEU 156.A O no hydrogen 3.300 N/A LYS 159.A NZ LYS 159.A O no hydrogen 2.721 N/A LYS 162.A N ALA 158.A O no hydrogen 2.556 N/A LYS 163.A N HIS 160.A O no hydrogen 2.876 N/A LYS 163.A NZ GLU 166.A OE1 no hydrogen 3.489 N/A ASN 164.A N PHE 161.A O no hydrogen 3.179 N/A VAL 165.A N LYS 162.A O no hydrogen 2.707 N/A GLU 166.A N LYS 162.A O no hydrogen 2.678 N/A LEU 169.A N VAL 165.A O no hydrogen 2.875 N/A ASN 170.A N GLU 166.A O no hydrogen 2.890 N/A LYS 171.A N GLU 167.A O no hydrogen 3.260 N/A ARG 172.A N LEU 169.A O no hydrogen 2.630 N/A LYS 178.A N GLY 174.A O no hydrogen 3.469 N/A LYS 178.A NZ LEU 732.A O no hydrogen 2.793 N/A LYS 179.A N HIS 175.A O no hydrogen 3.174 N/A LYS 179.A N VAL 176.A O no hydrogen 2.677 N/A LYS 179.A NZ ASP 146.A OD1 no hydrogen 2.958 N/A ALA 180.A N VAL 176.A O no hydrogen 2.882 N/A PHE 181.A N TYR 177.A O no hydrogen 2.659 N/A MET 182.A N LYS 178.A O no hydrogen 3.113 N/A GLN 183.A N LYS 179.A O no hydrogen 3.040 N/A VAL 185.A N PHE 181.A O no hydrogen 3.156 N/A GLU 186.A N MET 182.A O no hydrogen 3.049 N/A ALA 187.A N GLN 183.A O no hydrogen 3.015 N/A MET 189.A N VAL 185.A O no hydrogen 2.851 N/A LEU 190.A N GLU 186.A O no hydrogen 3.161 N/A LYS 192.A N MET 189.A O no hydrogen 3.393 N/A TRP 200.A N GLU 198.A O no hydrogen 2.444 N/A SER 201.A N GLU 198.A O no hydrogen 3.152 N/A SER 202.A OG ALA 199.A O no hydrogen 3.551 N/A SER 208.A N HIS 204.A O no hydrogen 2.892 N/A SER 208.A OG GLU 145.A OE1 no hydrogen 3.381 N/A ILE 209.A N LYS 205.A O no hydrogen 3.035 N/A HIS 210.A N GLU 206.A O no hydrogen 2.800 N/A VAL 211.A N ASP 207.A O no hydrogen 3.046 N/A GLY 212.A N SER 208.A O no hydrogen 3.103 N/A VAL 213.A N HIS 210.A O no hydrogen 3.156 N/A ARG 214.A N HIS 210.A O no hydrogen 3.059 N/A ARG 214.A NH1 GLU 217.A OE2 no hydrogen 2.468 N/A CYS 215.A N VAL 211.A O no hydrogen 3.192 N/A CYS 215.A SG VAL 211.A O no hydrogen 2.989 N/A GLU 217.A N VAL 213.A O no hydrogen 3.177 N/A MET 218.A N ARG 214.A O no hydrogen 3.117 N/A LEU 219.A N CYS 215.A O no hydrogen 2.898 N/A ILE 220.A N ILE 216.A O no hydrogen 3.009 N/A GLU 221.A N GLU 217.A O no hydrogen 3.191 N/A SER 222.A N MET 218.A O no hydrogen 3.042 N/A SER 222.A OG MET 218.A O no hydrogen 3.441 N/A SER 222.A OG LEU 219.A O no hydrogen 3.470 N/A THR 223.A N LEU 219.A O no hydrogen 3.176 N/A THR 223.A OG1 LEU 219.A O no hydrogen 3.001 N/A ARG 230.A NH1 ASP 239.A OD1 no hydrogen 3.452 N/A GLY 234.A N ASP 239.A OD2 no hydrogen 3.384 N/A ASP 239.A N VAL 235.A O no hydrogen 3.338 N/A ALA 246.A N MET 225.A O no hydrogen 2.447 N/A ALA 250.A N ALA 246.A O no hydrogen 2.949 N/A GLU 251.A N PRO 247.A O no hydrogen 3.091 N/A ALA 252.A N GLU 248.A O no hydrogen 3.140 N/A ILE 253.A N TYR 249.A O no hydrogen 3.275 N/A ALA 254.A N ALA 250.A O no hydrogen 2.925 N/A THR 255.A N GLU 251.A O no hydrogen 2.823 N/A THR 255.A OG1 GLU 251.A O no hydrogen 2.571 N/A ARG 256.A N ALA 252.A O no hydrogen 2.750 N/A ALA 257.A N ILE 253.A O no hydrogen 2.830 N/A GLY 258.A N ALA 254.A O no hydrogen 3.064 N/A ALA 259.A N THR 255.A O no hydrogen 3.027 N/A LEU 260.A N ARG 256.A O no hydrogen 3.105 N/A ALA 261.A N ALA 257.A O no hydrogen 3.023 N/A GLY 262.A N ALA 259.A O no hydrogen 3.260 N/A ILE 263.A N LEU 260.A O no hydrogen 2.839 N/A MET 266.A N SER 42.A O no hydrogen 2.757 N/A GLN 268.A N SER 42.A OG no hydrogen 3.296 N/A GLN 268.A NE2 GLN 387.A OE1 no hydrogen 2.959 N/A CYS 270.A N TRP 398.A O no hydrogen 2.388 N/A CYS 270.A SG TRP 398.A O no hydrogen 3.049 N/A LYS 275.A N GLY 284.A O no hydrogen 2.757 N/A LYS 275.A NZ GLY 282.A O no hydrogen 3.327 N/A TRP 277.A N ASN 320.A OD1 no hydrogen 2.511 N/A GLY 284.A N LYS 275.A O no hydrogen 3.149 N/A TYR 285.A OH GLN 268.A O no hydrogen 2.379 N/A TRP 286.A N GLU 39.A OE2 no hydrogen 2.959 N/A TRP 286.A NE1 PRO 273.A O no hydrogen 3.173 N/A ALA 287.A N GLU 39.A OE2 no hydrogen 2.810 N/A ASN 288.A ND2 ALA 287.A O no hydrogen 3.360 N/A ARG 290.A NE ASP 12.A OD2 no hydrogen 2.824 N/A ARG 290.A NH2 ASP 12.A OD1 no hydrogen 2.801 N/A ARG 290.A NH2 ASP 12.A OD2 no hydrogen 2.499 N/A ARG 291.A NH1 ILE 263.A O no hydrogen 2.987 N/A LEU 295.A N ILE 280.A O no hydrogen 2.629 N/A ARG 297.A N MET 403.A O no hydrogen 2.890 N/A THR 298.A OG1 VAL 296.A O no hydrogen 3.239 N/A LEU 304.A N SER 300.A O no hydrogen 3.284 N/A LEU 304.A N LYS 301.A O no hydrogen 3.148 N/A MET 305.A N LYS 301.A O no hydrogen 3.260 N/A ARG 306.A N LYS 302.A O no hydrogen 3.241 N/A ARG 306.A NH1 GLU 721.A OE2 no hydrogen 3.009 N/A TYR 307.A N LEU 304.A O no hydrogen 3.161 N/A TYR 307.A OH PRO 717.A O no hydrogen 2.136 N/A VAL 310.A N TYR 307.A O no hydrogen 2.347 N/A TYR 316.A N MET 312.A O no hydrogen 3.242 N/A LYS 317.A N PRO 313.A O no hydrogen 2.770 N/A LYS 317.A NZ GLU 314.A OE2 no hydrogen 3.364 N/A LYS 317.A NZ GLU 774.A OE1 no hydrogen 3.519 N/A LYS 317.A NZ GLU 774.A OE2 no hydrogen 2.853 N/A ALA 318.A N GLU 314.A O no hydrogen 3.188 N/A ILE 319.A N VAL 315.A O no hydrogen 3.272 N/A ASN 320.A N TYR 316.A O no hydrogen 3.256 N/A ASN 320.A ND2 TRP 277.A O no hydrogen 3.239 N/A ASN 320.A ND2 TYR 316.A O no hydrogen 2.335 N/A ILE 321.A N LYS 317.A O no hydrogen 2.538 N/A ALA 322.A N ALA 318.A O no hydrogen 2.714 N/A GLN 323.A N ILE 319.A O no hydrogen 2.665 N/A ASN 324.A N ASN 320.A O no hydrogen 3.048 N/A ASN 324.A N ILE 321.A O no hydrogen 2.833 N/A THR 325.A N ALA 322.A O no hydrogen 3.411 N/A THR 325.A OG1 ALA 322.A O no hydrogen 2.814 N/A THR 325.A OG1 PHE 781.A O no hydrogen 3.286 N/A TRP 327.A N ILE 397.A O no hydrogen 2.921 N/A LYS 328.A N THR 428.A O no hydrogen 2.286 N/A ASN 330.A N LEU 426.A O no hydrogen 2.801 N/A LYS 331.A N ILE 329.A O no hydrogen 2.881 N/A VAL 333.A N ASN 330.A OD1 no hydrogen 3.402 N/A LEU 334.A N ASN 330.A O no hydrogen 3.082 N/A ALA 335.A N LYS 331.A O no hydrogen 3.278 N/A VAL 336.A N VAL 333.A O no hydrogen 2.929 N/A ALA 337.A N VAL 333.A O no hydrogen 3.432 N/A ASN 338.A N LEU 334.A O no hydrogen 2.821 N/A ASN 338.A ND2 ASN 389.A OD1 no hydrogen 3.405 N/A VAL 339.A N VAL 336.A O no hydrogen 2.648 N/A ILE 340.A N VAL 336.A O no hydrogen 2.993 N/A THR 341.A N ALA 337.A O no hydrogen 2.953 N/A THR 341.A OG1 ALA 337.A O no hydrogen 3.132 N/A LYS 342.A N VAL 339.A O no hydrogen 2.569 N/A TRP 343.A N ILE 340.A O no hydrogen 2.728 N/A GLU 349.A N CYS 346.A O no hydrogen 2.549 N/A THR 358.A OG1 GLU 355.A OE1 no hydrogen 3.271 N/A THR 358.A OG1 GLU 355.A OE2 no hydrogen 3.186 N/A ALA 359.A N ALA 356.A O no hydrogen 3.348 N/A TRP 360.A N ALA 356.A O no hydrogen 2.897 N/A LYS 361.A N LEU 357.A O no hydrogen 2.651 N/A ARG 362.A N ALA 359.A O no hydrogen 2.979 N/A ALA 363.A N ALA 359.A O no hydrogen 3.194 N/A ALA 364.A N TRP 360.A O no hydrogen 3.344 N/A ALA 365.A N LYS 361.A O no hydrogen 3.330 N/A VAL 367.A N ALA 363.A O no hydrogen 2.982 N/A TYR 368.A N ALA 365.A O no hydrogen 3.037 N/A ARG 369.A N ALA 365.A O no hydrogen 3.219 N/A LYS 370.A N ALA 366.A O no hydrogen 3.323 N/A ASP 371.A N TYR 368.A O no hydrogen 2.913 N/A LYS 372.A N ARG 369.A O no hydrogen 2.088 N/A ALA 373.A N ARG 369.A O no hydrogen 3.103 N/A LYS 375.A N LYS 372.A O no hydrogen 2.996 N/A SER 376.A N LYS 372.A O no hydrogen 2.854 N/A ARG 377.A N ALA 373.A O no hydrogen 2.596 N/A ARG 378.A NH1 THR 341.A O no hydrogen 3.443 N/A ARG 378.A NH2 THR 341.A O no hydrogen 3.457 N/A ILE 379.A N SER 376.A O no hydrogen 2.453 N/A SER 380.A N SER 376.A O no hydrogen 3.167 N/A SER 380.A OG ARG 377.A O no hydrogen 3.225 N/A LEU 381.A N ARG 377.A O no hydrogen 3.363 N/A GLU 382.A N ARG 378.A O no hydrogen 3.068 N/A PHE 383.A N SER 380.A O no hydrogen 3.131 N/A MET 384.A N SER 380.A O no hydrogen 3.083 N/A GLU 386.A N PHE 383.A O no hydrogen 2.467 N/A GLN 387.A N PHE 383.A O no hydrogen 3.026 N/A ALA 388.A N MET 384.A O no hydrogen 2.999 N/A LYS 390.A N GLU 386.A O no hydrogen 2.941 N/A LYS 390.A N GLN 387.A O no hydrogen 2.586 N/A LYS 390.A NZ GLU 41.A OE1 no hydrogen 3.060 N/A LYS 390.A NZ GLN 268.A OE1 no hydrogen 3.138 N/A PHE 391.A N GLN 387.A O no hydrogen 3.257 N/A HIS 394.A NE2 GLU 34.A OE1 no hydrogen 2.847 N/A ILE 397.A N TRP 327.A O no hydrogen 2.569 N/A TRP 398.A N CYS 270.A O no hydrogen 2.671 N/A ASP 404.A N ARG 408.A O no hydrogen 2.889 N/A ARG 406.A N ASP 404.A OD1 no hydrogen 2.543 N/A ARG 406.A NH1 ASP 404.A OD1 no hydrogen 3.134 N/A ARG 406.A NH2 HIS 758.A ND1 no hydrogen 2.185 N/A GLY 407.A N ASP 404.A O no hydrogen 2.696 N/A ARG 408.A NE ASP 761.A OD2 no hydrogen 2.909 N/A TYR 410.A N ASN 402.A O no hydrogen 3.327 N/A TYR 410.A OH ASP 404.A OD2 no hydrogen 2.837 N/A MET 414.A N PHE 267.A O no hydrogen 2.739 N/A GLN 418.A N ASN 416.A OD1 no hydrogen 2.409 N/A ASN 420.A N THR 423.A OG1 no hydrogen 2.465 N/A THR 423.A OG1 ASN 420.A O no hydrogen 3.115 N/A LYS 424.A N ASN 420.A O no hydrogen 2.872 N/A GLY 425.A N ASP 421.A O no hydrogen 2.839 N/A LEU 426.A N THR 423.A O no hydrogen 2.868 N/A LEU 427.A N LYS 424.A O no hydrogen 3.073 N/A THR 428.A N LYS 328.A O no hydrogen 2.945 N/A ALA 430.A N ALA 326.A O no hydrogen 2.690 N/A LYS 431.A NZ GLU 779.A O no hydrogen 2.637 N/A LYS 433.A NZ ASP 794.A OD1 no hydrogen 3.350 N/A ILE 435.A N TYR 511.A O no hydrogen 2.868 N/A TYR 440.A N GLY 436.A O no hydrogen 2.671 N/A LEU 443.A N GLY 439.A O no hydrogen 3.111 N/A LYS 444.A N TYR 440.A O no hydrogen 3.119 N/A ILE 445.A N TYR 441.A O no hydrogen 3.173 N/A HIS 446.A N TRP 442.A O no hydrogen 2.894 N/A GLY 447.A N LEU 443.A O no hydrogen 3.224 N/A ALA 448.A N LYS 444.A O no hydrogen 2.967 N/A ALA 448.A N ILE 445.A O no hydrogen 2.448 N/A ASN 449.A N ILE 445.A O no hydrogen 3.143 N/A ASN 449.A ND2 HIS 446.A O no hydrogen 3.265 N/A CYS 450.A N HIS 446.A O no hydrogen 2.992 N/A CYS 450.A SG HIS 446.A O no hydrogen 3.942 N/A ALA 451.A N ALA 448.A O no hydrogen 3.102 N/A GLY 452.A N ASN 449.A O no hydrogen 2.797 N/A VAL 453.A N ALA 448.A O no hydrogen 3.125 N/A ARG 461.A N PRO 457.A O no hydrogen 3.038 N/A ARG 461.A NE VAL 456.A O no hydrogen 3.124 N/A ARG 461.A NH1 ASN 449.A OD1 no hydrogen 3.173 N/A ILE 462.A N PHE 458.A O no hydrogen 2.927 N/A LYS 463.A N PRO 459.A O no hydrogen 2.530 N/A PHE 464.A N GLU 460.A O no hydrogen 2.849 N/A ILE 465.A N ARG 461.A O no hydrogen 3.252 N/A GLU 466.A N ILE 462.A O no hydrogen 2.890 N/A GLU 467.A N LYS 463.A O no hydrogen 2.685 N/A ASN 468.A N PHE 464.A O no hydrogen 3.256 N/A HIS 469.A N GLU 466.A O no hydrogen 3.177 N/A ILE 472.A N ASN 468.A O no hydrogen 3.086 N/A MET 473.A N HIS 469.A O no hydrogen 3.023 N/A ALA 474.A N GLU 470.A O no hydrogen 2.765 N/A CYS 475.A N ASN 471.A O no hydrogen 3.169 N/A CYS 475.A SG ASN 471.A O no hydrogen 3.448 N/A ALA 476.A N ILE 472.A O no hydrogen 3.038 N/A LYS 477.A N MET 473.A O no hydrogen 2.759 N/A SER 478.A N ALA 474.A O no hydrogen 2.844 N/A GLU 481.A N SER 478.A O no hydrogen 3.336 N/A ASN 482.A N PRO 479.A O no hydrogen 3.320 N/A THR 483.A OG1 GLU 487.A OE1 no hydrogen 2.830 N/A TRP 485.A NE1 PRO 479.A O no hydrogen 3.081 N/A GLU 487.A N THR 483.A O no hydrogen 3.381 N/A GLN 488.A N TRP 485.A O no hydrogen 2.651 N/A GLN 488.A NE2 TRP 484.A O no hydrogen 3.698 N/A SER 490.A OG ASP 489.A O no hydrogen 2.771 N/A CYS 493.A N ASP 421.A OD2 no hydrogen 2.863 N/A PHE 494.A N SER 490.A O no hydrogen 2.834 N/A LEU 495.A N PRO 491.A O no hydrogen 2.760 N/A ALA 496.A N CYS 493.A O no hydrogen 2.262 N/A PHE 497.A N CYS 493.A O no hydrogen 3.164 N/A CYS 498.A N PHE 494.A O no hydrogen 3.380 N/A CYS 498.A SG PHE 494.A O no hydrogen 2.711 N/A GLU 500.A N PHE 497.A O no hydrogen 2.451 N/A TYR 501.A N PHE 497.A O no hydrogen 2.938 N/A ALA 502.A N CYS 498.A O no hydrogen 3.286 N/A GLY 503.A N GLU 500.A O no hydrogen 2.419 N/A VAL 504.A N GLU 500.A O no hydrogen 3.058 N/A HIS 506.A N GLY 503.A O no hydrogen 3.204 N/A HIS 507.A N GLY 503.A O no hydrogen 2.813 N/A HIS 507.A N VAL 504.A O no hydrogen 2.757 N/A HIS 507.A ND1 GLY 503.A O no hydrogen 3.121 N/A GLY 508.A N VAL 504.A O no hydrogen 2.511 N/A SER 510.A OG HIS 507.A O no hydrogen 3.418 N/A TYR 511.A N GLY 508.A O no hydrogen 3.092 N/A CYS 513.A N LYS 433.A O no hydrogen 3.191 N/A CYS 513.A SG GLU 500.A OE2 no hydrogen 3.794 N/A LEU 517.A N THR 790.A O no hydrogen 2.692 N/A PHE 519.A N PHE 788.A O no hydrogen 2.536 N/A GLY 521.A N ASP 786.A O no hydrogen 3.442 N/A SER 522.A OG GLN 527.A OE1 no hydrogen 3.345 N/A SER 522.A OG VAL 542.A O no hydrogen 2.183 N/A SER 524.A OG ASP 786.A OD2 no hydrogen 3.036 N/A GLN 527.A N CYS 523.A O no hydrogen 3.225 N/A HIS 528.A N SER 524.A O no hydrogen 3.052 N/A PHE 529.A N GLY 525.A O no hydrogen 3.270 N/A SER 530.A N ILE 526.A O no hydrogen 2.477 N/A ALA 531.A N GLN 527.A O no hydrogen 2.673 N/A MET 532.A N HIS 528.A O no hydrogen 2.811 N/A LEU 533.A N ALA 531.A O no hydrogen 2.178 N/A ARG 534.A N ALA 531.A O no hydrogen 2.479 N/A ARG 534.A NH2 TYR 810.A O no hydrogen 2.919 N/A ASP 535.A N SER 530.A O no hydrogen 2.780 N/A VAL 537.A N GLU 536.A OE1 no hydrogen 2.940 N/A GLY 538.A N ASP 535.A OD1 no hydrogen 3.120 N/A GLY 539.A N ASP 535.A O no hydrogen 2.645 N/A ARG 540.A N GLU 536.A O no hydrogen 2.983 N/A ALA 541.A N VAL 537.A O no hydrogen 3.359 N/A ALA 541.A N GLY 538.A O no hydrogen 2.720 N/A VAL 542.A N GLY 538.A O no hydrogen 3.180 N/A ASN 543.A N ARG 540.A O no hydrogen 3.226 N/A ASN 543.A ND2 SER 522.A OG no hydrogen 3.055 N/A ASN 543.A ND2 GLN 551.A O no hydrogen 3.096 N/A LEU 544.A N GLY 539.A O no hydrogen 2.644 N/A GLN 551.A N ASN 543.A OD1 no hydrogen 2.957 N/A GLN 551.A NE2 THR 549.A O no hydrogen 3.610 N/A GLY 555.A N ASP 552.A OD2 no hydrogen 2.480 N/A ILE 556.A N ASP 552.A O no hydrogen 3.118 N/A VAL 557.A N ILE 553.A O no hydrogen 3.012 N/A ALA 558.A N TYR 554.A O no hydrogen 2.650 N/A LYS 559.A N GLY 555.A O no hydrogen 3.076 N/A LYS 560.A N ILE 556.A O no hydrogen 3.052 N/A VAL 561.A N VAL 557.A O no hydrogen 3.076 N/A VAL 561.A N ALA 558.A O no hydrogen 2.710 N/A ASN 562.A N ALA 558.A O no hydrogen 2.877 N/A ASN 562.A ND2 VAL 608.A O no hydrogen 3.442 N/A GLU 563.A N LYS 559.A O no hydrogen 2.989 N/A ILE 564.A N VAL 561.A O no hydrogen 2.505 N/A LEU 565.A N VAL 561.A O no hydrogen 2.972 N/A GLN 566.A N ASN 562.A O no hydrogen 3.161 N/A ALA 567.A N ILE 564.A O no hydrogen 2.800 N/A ASP 568.A N LEU 565.A O no hydrogen 2.664 N/A ALA 569.A N LEU 565.A O no hydrogen 2.634 N/A THR 573.A N THR 596.A OG1 no hydrogen 2.698 N/A THR 573.A OG1 THR 596.A OG1 no hydrogen 2.197 N/A VAL 578.A N LYS 591.A O no hydrogen 2.904 N/A VAL 580.A N SER 589.A O no hydrogen 3.381 N/A ASP 582.A N GLU 587.A O no hydrogen 3.456 N/A THR 585.A N ASP 582.A OD2 no hydrogen 3.232 N/A THR 585.A OG1 ASP 582.A OD2 no hydrogen 2.716 N/A GLY 586.A N ASP 582.A O no hydrogen 3.131 N/A LYS 591.A N VAL 578.A O no hydrogen 3.286 N/A LYS 593.A N GLU 576.A O no hydrogen 2.406 N/A THR 596.A N THR 573.A OG1 no hydrogen 3.324 N/A THR 596.A OG1 THR 573.A OG1 no hydrogen 2.197 N/A LYS 597.A N THR 573.A O no hydrogen 2.930 N/A LEU 599.A N GLY 595.A O no hydrogen 2.968 N/A ALA 600.A N THR 596.A O no hydrogen 3.132 N/A GLN 602.A N ALA 598.A O no hydrogen 2.909 N/A TRP 603.A N LEU 599.A O no hydrogen 2.919 N/A TRP 603.A NE1 ALA 656.A O no hydrogen 3.052 N/A LEU 604.A N ALA 600.A O no hydrogen 2.668 N/A ALA 605.A N GLY 601.A O no hydrogen 2.481 N/A TYR 606.A N GLN 602.A O no hydrogen 2.369 N/A TYR 606.A OH THR 637.A OG1 no hydrogen 3.006 N/A GLY 607.A N TRP 603.A O no hydrogen 2.791 N/A SER 611.A N THR 609.A OG1 no hydrogen 3.004 N/A VAL 612.A N THR 609.A O no hydrogen 2.871 N/A THR 613.A N ARG 610.A O no hydrogen 2.745 N/A THR 613.A OG1 THR 609.A O no hydrogen 3.401 N/A THR 613.A OG1 ARG 610.A O no hydrogen 2.380 N/A LYS 614.A N ARG 610.A O no hydrogen 2.847 N/A VAL 617.A N THR 613.A O no hydrogen 3.057 N/A MET 618.A N LYS 614.A O no hydrogen 2.989 N/A THR 619.A N ARG 615.A O no hydrogen 2.948 N/A THR 619.A N SER 616.A O no hydrogen 3.087 N/A THR 619.A OG1 ARG 615.A O no hydrogen 3.312 N/A THR 619.A OG1 SER 616.A O no hydrogen 2.882 N/A THR 619.A OG1 SER 624.A OG no hydrogen 2.673 N/A LEU 620.A N VAL 617.A O no hydrogen 3.071 N/A TYR 622.A N THR 619.A O no hydrogen 2.508 N/A SER 624.A OG THR 619.A OG1 no hydrogen 2.673 N/A PHE 629.A N GLU 626.A O no hydrogen 3.311 N/A GLN 632.A NE2 THR 619.A OG1 no hydrogen 3.382 N/A VAL 633.A N PHE 629.A O no hydrogen 2.447 N/A LEU 634.A N ARG 630.A O no hydrogen 2.995 N/A GLU 635.A N GLN 631.A O no hydrogen 3.050 N/A ASP 636.A N GLN 632.A O no hydrogen 2.461 N/A THR 637.A N VAL 633.A O no hydrogen 2.728 N/A THR 637.A OG1 TYR 606.A OH no hydrogen 3.006 N/A ILE 638.A N VAL 633.A O no hydrogen 3.423 N/A GLN 639.A N LEU 634.A O no hydrogen 2.659 N/A ILE 642.A N ILE 638.A O no hydrogen 3.242 N/A ASP 643.A N GLN 639.A O no hydrogen 3.015 N/A SER 644.A N ALA 641.A O no hydrogen 2.758 N/A SER 644.A OG PRO 640.A O no hydrogen 2.133 N/A GLY 645.A N ILE 642.A O no hydrogen 3.008 N/A LYS 646.A NZ ALA 605.A O no hydrogen 3.347 N/A PHE 650.A N GLY 647.A O no hydrogen 2.539 N/A THR 651.A N MET 649.A O no hydrogen 2.738 N/A GLN 655.A NE2 VAL 592.A O no hydrogen 3.480 N/A ALA 656.A N GLN 652.A O no hydrogen 2.913 N/A ALA 657.A N PRO 653.A O no hydrogen 2.866 N/A GLY 658.A N ASN 654.A O no hydrogen 2.568 N/A TYR 659.A N GLN 655.A O no hydrogen 3.110 N/A TYR 659.A OH ASP 568.A OD2 no hydrogen 3.099 N/A MET 660.A N ALA 656.A O no hydrogen 3.162 N/A LYS 662.A NZ GLU 626.A OE1 no hydrogen 3.278 N/A LEU 663.A N TYR 659.A O no hydrogen 3.115 N/A ILE 664.A N MET 660.A O no hydrogen 2.760 N/A TRP 665.A N ALA 661.A O no hydrogen 2.743 N/A GLU 666.A N LYS 662.A O no hydrogen 2.691 N/A GLU 666.A N LEU 663.A O no hydrogen 2.764 N/A SER 667.A N LEU 663.A O no hydrogen 2.782 N/A VAL 668.A N ILE 664.A O no hydrogen 2.799 N/A SER 669.A N TRP 665.A O no hydrogen 3.380 N/A SER 669.A OG TRP 665.A O no hydrogen 2.929 N/A SER 669.A OG GLU 666.A O no hydrogen 3.435 N/A THR 671.A N VAL 668.A O no hydrogen 2.643 N/A VAL 672.A N VAL 668.A O no hydrogen 2.940 N/A VAL 676.A N VAL 672.A O no hydrogen 3.133 N/A GLU 677.A N VAL 673.A O no hydrogen 2.818 N/A ALA 678.A N ALA 674.A O no hydrogen 2.743 N/A MET 679.A N ALA 675.A O no hydrogen 3.136 N/A ASN 680.A N VAL 676.A O no hydrogen 3.028 N/A TRP 681.A N GLU 677.A O no hydrogen 2.784 N/A LEU 682.A N ALA 678.A O no hydrogen 2.966 N/A LYS 683.A N MET 679.A O no hydrogen 2.618 N/A LYS 683.A NZ ASN 680.A OD1 no hydrogen 2.904 N/A SER 684.A N ASN 680.A O no hydrogen 2.815 N/A ALA 685.A N TRP 681.A O no hydrogen 3.088 N/A ALA 686.A N LEU 682.A O no hydrogen 3.034 N/A LYS 687.A N LYS 683.A O no hydrogen 3.025 N/A LYS 687.A NZ GLU 749.A OE1 no hydrogen 3.401 N/A LEU 688.A N SER 684.A O no hydrogen 3.028 N/A LEU 689.A N ALA 685.A O no hydrogen 3.128 N/A ALA 690.A N LYS 687.A O no hydrogen 2.474 N/A ALA 691.A N LYS 687.A O no hydrogen 2.810 N/A THR 698.A N ASP 695.A O no hydrogen 2.863 N/A THR 698.A OG1 ASP 695.A OD2 no hydrogen 3.458 N/A GLY 699.A N ASP 695.A O no hydrogen 2.363 N/A LEU 702.A N VAL 693.A O no hydrogen 3.346 N/A ARG 703.A NH2 LEU 688.A O no hydrogen 3.047 N/A CYS 706.A SG GLN 826.A OE1 no hydrogen 3.349 N/A VAL 708.A N GLN 720.A O no hydrogen 2.806 N/A TRP 710.A N VAL 718.A O no hydrogen 3.071 N/A THR 712.A N PHE 716.A O no hydrogen 2.309 N/A THR 712.A OG1 ASP 714.A OD1 no hydrogen 3.284 N/A THR 712.A OG1 PHE 716.A O no hydrogen 2.493 N/A GLY 715.A N THR 712.A O no hydrogen 2.952 N/A VAL 718.A N TRP 710.A O no hydrogen 2.825 N/A GLN 720.A N VAL 708.A O no hydrogen 2.652 N/A GLN 720.A NE2 GLY 751.A O no hydrogen 2.793 N/A TYR 722.A N GLN 748.A OE1 no hydrogen 3.053 N/A LYS 724.A N GLU 742.A O no hydrogen 2.707 N/A THR 728.A OG1 GLN 727.A O no hydrogen 2.275 N/A ARG 729.A NH1 GLN 737.A O no hydrogen 2.651 N/A LEU 732.A N GLU 147.A OE1 no hydrogen 3.291 N/A SER 741.A N ASP 740.A OD1 no hydrogen 3.291 N/A GLU 742.A N LYS 724.A O no hydrogen 3.021 N/A ASP 744.A N TYR 722.A O no hydrogen 2.640 N/A ALA 745.A N ILE 743.A O no hydrogen 3.202 N/A HIS 746.A N ASP 744.A OD1 no hydrogen 3.452 N/A LYS 747.A N ASP 744.A OD2 no hydrogen 2.733 N/A GLN 748.A N ASP 744.A O no hydrogen 2.946 N/A GLU 749.A N ALA 745.A O no hydrogen 2.864 N/A SER 750.A N HIS 746.A O no hydrogen 2.792 N/A SER 750.A N LYS 747.A O no hydrogen 3.087 N/A GLY 751.A N LYS 747.A O no hydrogen 3.045 N/A ASN 755.A N GLY 751.A O no hydrogen 3.214 N/A PHE 756.A N ILE 752.A O no hydrogen 2.732 N/A VAL 757.A N ALA 753.A O no hydrogen 3.284 N/A HIS 758.A N PRO 754.A O no hydrogen 2.797 N/A SER 759.A N ASN 755.A O no hydrogen 2.691 N/A SER 759.A N PHE 756.A O no hydrogen 2.919 N/A SER 759.A OG PHE 756.A O no hydrogen 3.294 N/A GLN 760.A N PHE 756.A O no hydrogen 2.844 N/A ASP 761.A N VAL 757.A O no hydrogen 2.661 N/A SER 763.A N SER 759.A O no hydrogen 2.923 N/A HIS 764.A N GLN 760.A O no hydrogen 3.104 N/A LEU 765.A N ASP 761.A O no hydrogen 2.928 N/A ARG 766.A N GLY 762.A O no hydrogen 3.009 N/A LYS 767.A N SER 763.A O no hydrogen 2.934 N/A LYS 767.A NZ THR 809.A OG1 no hydrogen 3.277 N/A THR 768.A N HIS 764.A O no hydrogen 3.001 N/A THR 768.A OG1 HIS 764.A O no hydrogen 3.208 N/A VAL 769.A N LEU 765.A O no hydrogen 2.851 N/A VAL 770.A N ARG 766.A O no hydrogen 3.209 N/A TRP 771.A N LYS 767.A O no hydrogen 2.786 N/A ALA 772.A N THR 768.A O no hydrogen 3.017 N/A HIS 773.A N VAL 770.A O no hydrogen 2.403 N/A HIS 773.A ND1 ILE 778.A O no hydrogen 3.102 N/A GLU 774.A N VAL 770.A O no hydrogen 2.904 N/A ILE 778.A N TYR 776.A O no hydrogen 2.133 N/A PHE 781.A N THR 325.A OG1 no hydrogen 3.357 N/A ALA 782.A N GLY 789.A O no hydrogen 2.834 N/A ILE 784.A N SER 787.A O no hydrogen 2.456 N/A SER 787.A OG ASP 520.A OD1 no hydrogen 2.562 N/A GLY 789.A N ALA 782.A O no hydrogen 2.862 N/A THR 790.A N LEU 517.A O no hydrogen 3.077 N/A ALA 795.A N ILE 791.A O no hydrogen 2.842 N/A LEU 798.A N ASP 794.A O no hydrogen 2.893 N/A PHE 799.A N ALA 795.A O no hydrogen 3.165 N/A LYS 800.A N ASN 797.A O no hydrogen 2.631 N/A ALA 801.A N ASN 797.A O no hydrogen 2.686 N/A VAL 802.A N LEU 798.A O no hydrogen 2.997 N/A ARG 803.A NE SER 852.A O no hydrogen 2.420 N/A ARG 803.A NH2 SER 852.A O no hydrogen 2.473 N/A GLU 804.A N LYS 800.A O no hydrogen 2.805 N/A THR 805.A N ALA 801.A O no hydrogen 2.493 N/A MET 806.A N VAL 802.A O no hydrogen 2.575 N/A ASP 808.A N GLU 804.A O no hydrogen 3.169 N/A THR 809.A N THR 805.A O no hydrogen 3.508 N/A THR 809.A OG1 THR 805.A O no hydrogen 3.218 N/A TYR 810.A N MET 806.A O no hydrogen 3.377 N/A TYR 810.A OH HIS 528.A ND1 no hydrogen 3.258 N/A GLU 811.A N VAL 807.A O no hydrogen 2.989 N/A SER 812.A N ASP 808.A O no hydrogen 3.030 N/A SER 812.A OG ASP 808.A O no hydrogen 3.249 N/A SER 812.A OG ASP 808.A OD1 no hydrogen 3.422 N/A CYS 813.A N THR 809.A O no hydrogen 3.269 N/A CYS 813.A SG THR 809.A O no hydrogen 3.449 N/A ASP 814.A N ASP 818.A OD2 no hydrogen 3.178 N/A ALA 817.A N ASP 814.A OD2 no hydrogen 2.892 N/A ASP 818.A N ASP 814.A O no hydrogen 2.942 N/A PHE 819.A N VAL 815.A O no hydrogen 2.530 N/A TYR 820.A N ALA 817.A O no hydrogen 2.268 N/A ASP 821.A N ALA 817.A O no hydrogen 3.042 N/A GLN 822.A N ASP 818.A O no hydrogen 3.237 N/A GLN 822.A NE2 HIS 709.A O no hydrogen 3.444 N/A PHE 823.A N PHE 819.A O no hydrogen 3.459 N/A ALA 824.A N TYR 820.A O no hydrogen 2.881 N/A GLN 826.A NE2 GLN 822.A O no hydrogen 3.518 N/A LEU 827.A N ALA 824.A O no hydrogen 3.232 N/A GLN 831.A N HIS 828.A O no hydrogen 2.998 N/A LEU 832.A N GLU 829.A O no hydrogen 3.147 N/A LYS 834.A N GLN 831.A O no hydrogen 2.919 N/A LYS 841.A NZ ASP 814.A OD1 no hydrogen 3.269 N/A LEU 844.A N ARG 534.A O no hydrogen 3.111 N/A ASN 845.A ND2 ASP 848.A OD2 no hydrogen 3.115 N/A ASP 848.A N ASN 845.A O no hydrogen 2.432 N/A ILE 849.A N LEU 846.A O no hydrogen 2.620 N/A LEU 850.A N ARG 847.A O no hydrogen 3.254 N/A GLU 851.A N ASP 848.A O no hydrogen 2.416 N/A SER 852.A N ILE 849.A O no hydrogen 2.947 N/A SER 852.A OG ASN 543.A O no hydrogen 3.561 N/A SER 852.A OG LEU 544.A O no hydrogen 2.470 N/A ALA 855.A N SER 852.A O no hydrogen 3.345 N/A