Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wjv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N PRO 4.A O no hydrogen 3.227 N/A CYS 8.A N ILE 13.A O no hydrogen 2.875 N/A CYS 8.A SG HIS 40.A ND1 no hydrogen 3.559 N/A SER 9.A N TRP 28.A O no hydrogen 2.679 N/A SER 9.A OG TRP 28.A O no hydrogen 3.315 N/A TYR 10.A OH GLU 148.A OE1 no hydrogen 2.644 N/A CYS 11.A SG HIS 40.A ND1 no hydrogen 3.604 N/A GLY 12.A N CYS 8.A O no hydrogen 2.807 N/A ALA 17.A N ASP 15.A OD1 no hydrogen 3.093 N/A CYS 18.A N ASP 15.A O no hydrogen 2.689 N/A CYS 18.A SG LYS 126.A O no hydrogen 3.495 N/A VAL 20.A N PHE 29.A O no hydrogen 2.989 N/A TYR 21.A N THR 54.A O no hydrogen 2.744 N/A CYS 22.A N LYS 27.A O no hydrogen 2.974 N/A CYS 22.A SG SER 25.A OG no hydrogen 3.314 N/A CYS 22.A SG HIS 44.A NE2 no hydrogen 3.665 N/A ASN 23.A N GLU 52.A O no hydrogen 2.829 N/A ASN 23.A ND2 THR 54.A OG1 no hydrogen 2.989 N/A SER 25.A OG HIS 44.A NE2 no hydrogen 2.988 N/A LYS 26.A N CYS 22.A O no hydrogen 3.123 N/A LYS 27.A NZ PRO 155.A O no hydrogen 2.892 N/A PHE 29.A N VAL 20.A O no hydrogen 3.132 N/A CYS 30.A SG GLY 32.A O no hydrogen 3.958 N/A CYS 30.A SG HIS 40.A ND1 no hydrogen 3.137 N/A GLY 34.A N GLN 133.A OE1 no hydrogen 2.696 N/A ASN 35.A ND2 GLN 138.A OE1 no hydrogen 3.246 N/A ASN 35.A ND2 ILE 139.A O no hydrogen 3.259 N/A THR 36.A N ARG 33.A O no hydrogen 2.955 N/A THR 36.A OG1 ARG 33.A O no hydrogen 2.637 N/A THR 36.A OG1 GLY 38.A O no hydrogen 2.683 N/A SER 39.A N ARG 118.A O no hydrogen 2.881 N/A SER 39.A OG ARG 118.A O no hydrogen 3.428 N/A HIS 40.A N GLY 32.A O no hydrogen 2.906 N/A ILE 41.A N CYS 30.A O no hydrogen 2.948 N/A VAL 42.A N SER 39.A OG no hydrogen 3.395 N/A ASN 43.A N SER 39.A O no hydrogen 2.839 N/A ASN 43.A ND2 THR 36.A OG1 no hydrogen 2.834 N/A ASN 43.A ND2 SER 39.A O no hydrogen 3.041 N/A HIS 44.A N HIS 40.A O no hydrogen 3.062 N/A HIS 44.A ND1 GLU 148.A OE1 no hydrogen 2.833 N/A HIS 44.A NE2 SER 25.A OG no hydrogen 2.988 N/A LEU 45.A N ILE 41.A O no hydrogen 2.745 N/A VAL 46.A N VAL 42.A O no hydrogen 3.015 N/A ARG 47.A N ASN 43.A O no hydrogen 3.267 N/A ARG 47.A NH1 ASN 43.A O no hydrogen 3.083 N/A ARG 47.A NH1 ASN 43.A OD1 no hydrogen 2.704 N/A ARG 47.A NH2 ASN 43.A OD1 no hydrogen 3.408 N/A ALA 48.A N HIS 44.A O no hydrogen 2.713 N/A CYS 50.A N LEU 45.A O no hydrogen 3.205 N/A CYS 50.A SG SER 25.A OG no hydrogen 3.497 N/A CYS 50.A SG ALA 48.A O no hydrogen 3.837 N/A THR 54.A N TYR 21.A O no hydrogen 2.857 N/A LEU 55.A N THR 64.A O no hydrogen 3.015 N/A GLY 59.A N HIS 56.A O no hydrogen 2.765 N/A THR 64.A OG1 GLY 62.A O no hydrogen 3.459 N/A LEU 66.A N VAL 53.A O no hydrogen 3.223 N/A CYS 68.A N CYS 73.A O no hydrogen 2.811 N/A TYR 69.A N LEU 92.A O no hydrogen 2.815 N/A GLY 72.A N CYS 68.A O no hydrogen 2.744 N/A VAL 76.A N LYS 51.A O no hydrogen 2.960 N/A PHE 77.A N ASN 75.A OD1 no hydrogen 3.152 N/A LEU 78.A N ASN 75.A O no hydrogen 2.768 N/A LEU 79.A N VAL 76.A O no hydrogen 3.280 N/A GLY 80.A N LEU 93.A O no hydrogen 3.008 N/A PHE 81.A N GLN 112.A O no hydrogen 2.848 N/A ILE 82.A N VAL 91.A O no hydrogen 3.033 N/A ALA 84.A N VAL 89.A O no hydrogen 3.276 N/A LYS 85.A NZ ASP 107.A OD2 no hydrogen 3.568 N/A VAL 91.A N ILE 82.A O no hydrogen 3.020 N/A LEU 93.A N GLY 80.A O no hydrogen 2.827 N/A CYS 94.A SG GLN 96.A O no hydrogen 4.018 N/A ARG 95.A N LEU 78.A O no hydrogen 3.006 N/A CYS 98.A SG ASN 70.A OD1 no hydrogen 3.070 N/A ALA 99.A N CYS 94.A O no hydrogen 2.850 N/A SER 100.A N PRO 97.A O no hydrogen 2.708 N/A SER 100.A OG PRO 97.A O no hydrogen 3.364 N/A SER 100.A OG SER 103.A OG no hydrogen 3.388 N/A SER 103.A OG PRO 97.A O no hydrogen 2.921 N/A SER 103.A OG CYS 98.A O no hydrogen 3.051 N/A SER 103.A OG SER 100.A O no hydrogen 2.737 N/A SER 103.A OG SER 100.A OG no hydrogen 3.388 N/A LEU 104.A N SER 100.A O no hydrogen 2.913 N/A LEU 104.A N GLN 101.A O no hydrogen 2.850 N/A ASP 107.A N PRO 83.A O no hydrogen 3.206 N/A SER 108.A OG ALA 99.A O no hydrogen 3.467 N/A SER 109.A OG ASP 107.A OD1 no hydrogen 2.602 N/A SER 109.A OG ASP 107.A OD2 no hydrogen 3.495 N/A GLN 110.A N ASP 107.A O no hydrogen 3.171 N/A TRP 111.A NE1 LEU 93.A O no hydrogen 3.356 N/A GLN 112.A N PHE 81.A O no hydrogen 2.893 N/A GLN 112.A NE2 GLN 116.A OE1 no hydrogen 3.526 N/A LEU 114.A N LEU 79.A O no hydrogen 2.916 N/A GLN 116.A N CYS 119.A O no hydrogen 2.750 N/A ARG 118.A NH1 SER 37.A O no hydrogen 2.459 N/A CYS 119.A N GLN 116.A O no hydrogen 2.841 N/A CYS 119.A SG ASP 117.A O no hydrogen 3.491 N/A LEU 121.A N LEU 114.A O no hydrogen 2.734 N/A LEU 124.A N LEU 121.A O no hydrogen 2.923 N/A VAL 125.A N LEU 121.A O no hydrogen 3.062 N/A LYS 126.A N ALA 17.A O no hydrogen 2.862 N/A SER 129.A N GLU 132.A OE2 no hydrogen 3.208 N/A SER 129.A OG GLU 132.A OE2 no hydrogen 3.174 N/A GLU 132.A N SER 129.A OG no hydrogen 3.368 N/A GLN 133.A N SER 129.A O no hydrogen 3.164 N/A GLN 133.A NE2 PRO 128.A O no hydrogen 2.883 N/A LEU 134.A N GLU 130.A O no hydrogen 2.845 N/A ARG 135.A N GLN 131.A O no hydrogen 3.192 N/A ARG 135.A N GLU 132.A O no hydrogen 3.104 N/A ALA 136.A N GLN 133.A O no hydrogen 3.091 N/A ARG 137.A N CYS 11.A O no hydrogen 3.075 N/A ARG 137.A NE TYR 10.A O no hydrogen 3.174 N/A GLN 138.A N ASP 175.A OD1 no hydrogen 2.935 N/A GLN 138.A NE2 GLN 133.A O no hydrogen 2.893 N/A GLN 138.A NE2 ALA 136.A O no hydrogen 2.961 N/A ILE 139.A N ARG 137.A O no hydrogen 3.142 N/A GLN 143.A N THR 140.A OG1 no hydrogen 3.382 N/A GLN 143.A NE2 THR 140.A OG1 no hydrogen 2.912 N/A ILE 144.A N THR 140.A O no hydrogen 3.022 N/A ASN 145.A N ALA 141.A O no hydrogen 2.991 N/A LYS 146.A N GLN 142.A O no hydrogen 2.924 N/A LEU 147.A N GLN 143.A O no hydrogen 2.630 N/A GLU 148.A N ILE 144.A O no hydrogen 2.714 N/A GLU 149.A N ASN 145.A O no hydrogen 3.291 N/A GLU 149.A N LYS 146.A O no hydrogen 3.048 N/A LEU 150.A N LYS 146.A O no hydrogen 2.877 N/A TRP 151.A NE1 ALA 157.A O no hydrogen 3.057 N/A LYS 152.A N GLU 149.A O no hydrogen 3.097 N/A ASN 154.A ND2 LEU 150.A O no hydrogen 3.688 N/A ALA 157.A N ASN 154.A O no hydrogen 2.872 N/A THR 158.A OG1 ASP 161.A OD1 no hydrogen 2.393 N/A ASP 161.A N THR 158.A O no hydrogen 3.071 N/A GLN 167.A NE2 HIS 168.A O no hydrogen 2.920 N/A VAL 169.A N ALA 539.A O no hydrogen 2.765 N/A TYR 173.A N LEU 307.A O no hydrogen 2.775 N/A TYR 173.A OH LEU 170.A O no hydrogen 2.811 N/A GLU 174.A N GLN 178.A OE1 no hydrogen 2.666 N/A ALA 176.A N TYR 303.A OH no hydrogen 2.971 N/A GLN 178.A N ASP 175.A OD2 no hydrogen 2.899 N/A TYR 179.A N ASP 175.A O no hydrogen 3.322 N/A TYR 179.A OH GLU 504.A OE2 no hydrogen 2.458 N/A GLN 180.A N ALA 176.A O no hydrogen 2.906 N/A ASN 181.A N TYR 177.A O no hydrogen 3.062 N/A ILE 182.A N GLN 178.A O no hydrogen 3.010 N/A PHE 183.A N TYR 179.A O no hydrogen 3.075 N/A GLY 184.A N GLN 180.A O no hydrogen 2.708 N/A VAL 187.A N PHE 183.A O no hydrogen 2.825 N/A LYS 188.A N GLY 184.A O no hydrogen 3.053 N/A LYS 188.A NZ ASP 192.A OD2 no hydrogen 3.135 N/A LEU 189.A N PRO 185.A O no hydrogen 2.992 N/A GLU 190.A N LEU 186.A O no hydrogen 3.216 N/A ALA 191.A N VAL 187.A O no hydrogen 3.019 N/A ASP 192.A N LYS 188.A O no hydrogen 3.021 N/A TYR 193.A N LEU 189.A O no hydrogen 2.879 N/A ASP 194.A N GLU 190.A O no hydrogen 2.883 N/A LYS 195.A N ALA 191.A O no hydrogen 2.990 N/A LYS 196.A N ASP 192.A O no hydrogen 3.226 N/A LEU 197.A N TYR 193.A O no hydrogen 2.891 N/A LYS 198.A N ASP 194.A O no hydrogen 2.803 N/A GLU 199.A N LYS 195.A O no hydrogen 3.125 N/A SER 200.A N LEU 197.A O no hydrogen 2.857 N/A SER 200.A OG LYS 196.A O no hydrogen 3.453 N/A SER 200.A OG LEU 197.A O no hydrogen 2.597 N/A GLN 201.A N LEU 197.A O no hydrogen 2.967 N/A GLN 201.A N LYS 198.A O no hydrogen 3.191 N/A THR 202.A OG1 VAL 272.A O no hydrogen 3.265 N/A THR 202.A OG1 ASP 273.A OD1 no hydrogen 2.858 N/A GLN 203.A N VAL 272.A O no hydrogen 2.860 N/A ILE 206.A N PHE 270.A O no hydrogen 2.943 N/A THR 207.A OG1 HIS 268.A ND1 no hydrogen 3.182 N/A VAL 208.A N THR 267.A O no hydrogen 2.763 N/A ARG 209.A N TYR 221.A O no hydrogen 2.822 N/A TRP 210.A NE1 VAL 266.A O no hydrogen 2.919 N/A ASP 211.A N ILE 219.A O no hydrogen 3.471 N/A ALA 220.A N ILE 259.A O no hydrogen 2.700 N/A TYR 221.A N ARG 209.A O no hydrogen 2.923 N/A PHE 222.A N ILE 257.A O no hydrogen 2.998 N/A GLN 228.A NE2 ILE 251.A O no hydrogen 2.769 N/A GLY 229.A N VAL 250.A O no hydrogen 2.687 N/A ASP 230.A N MET 227.A O no hydrogen 3.300 N/A ILE 232.A N GLY 248.A O no hydrogen 2.786 N/A CYS 233.A N ASP 273.A O no hydrogen 2.768 N/A LEU 234.A N GLY 246.A O no hydrogen 2.902 N/A ARG 235.A N GLN 271.A O no hydrogen 3.038 N/A TYR 236.A N TRP 244.A O no hydrogen 3.252 N/A LYS 237.A N ASN 269.A O no hydrogen 2.991 N/A LYS 237.A NZ GLN 271.A OE1 no hydrogen 2.679 N/A GLY 246.A N LEU 234.A O no hydrogen 2.978 N/A GLY 248.A N ILE 232.A O no hydrogen 2.938 N/A HIS 249.A N GLU 260.A O no hydrogen 3.078 N/A VAL 250.A N ASP 230.A O no hydrogen 2.998 N/A ILE 251.A N ALA 258.A O no hydrogen 2.765 N/A LYS 252.A N ALA 258.A O no hydrogen 3.381 N/A ILE 257.A N PHE 222.A O no hydrogen 2.735 N/A ALA 258.A N LYS 252.A O no hydrogen 3.342 N/A ILE 259.A N ALA 220.A O no hydrogen 2.791 N/A HIS 268.A ND1 THR 207.A OG1 no hydrogen 3.182 N/A PHE 270.A N ILE 206.A O no hydrogen 3.017 N/A GLN 271.A N ARG 235.A O no hydrogen 2.647 N/A GLN 271.A NE2 ASP 273.A OD2 no hydrogen 2.553 N/A VAL 272.A N GLN 203.A O no hydrogen 3.003 N/A ASP 273.A N CYS 233.A O no hydrogen 2.975 N/A VAL 275.A N GLU 231.A O no hydrogen 2.874 N/A TRP 276.A NE1 ASP 194.A OD2 no hydrogen 2.782 N/A SER 278.A OG ASP 282.A OD2 no hydrogen 2.397 N/A ASP 282.A N SER 278.A O no hydrogen 2.691 N/A ARG 283.A N THR 279.A O no hydrogen 2.797 N/A ARG 283.A NH1 VAL 479.A O no hydrogen 2.903 N/A MET 284.A N SER 280.A O no hydrogen 3.031 N/A GLN 285.A N PHE 281.A O no hydrogen 3.079 N/A GLN 285.A NE2 GLY 184.A O no hydrogen 2.835 N/A SER 286.A N ASP 282.A O no hydrogen 3.041 N/A ALA 287.A N ARG 283.A O no hydrogen 2.835 N/A LEU 288.A N MET 284.A O no hydrogen 3.042 N/A LYS 289.A N GLN 285.A O no hydrogen 2.909 N/A LYS 289.A NZ ASP 2.A OD2 no hydrogen 2.845 N/A THR 290.A N SER 286.A O no hydrogen 2.902 N/A PHE 291.A N ALA 287.A O no hydrogen 2.810 N/A ALA 292.A N LEU 288.A O no hydrogen 3.156 N/A VAL 293.A N LYS 289.A O no hydrogen 2.881 N/A ASP 294.A N THR 290.A O no hydrogen 2.973 N/A GLU 295.A N GLU 295.A OE1 no hydrogen 2.673 N/A THR 296.A N ASP 294.A OD1 no hydrogen 3.166 N/A THR 296.A OG1 ASP 294.A OD1 no hydrogen 2.795 N/A THR 296.A OG1 ASP 294.A OD2 no hydrogen 3.064 N/A SER 297.A N ASP 294.A O no hydrogen 3.209 N/A SER 297.A OG ASP 294.A O no hydrogen 3.233 N/A SER 299.A N ALA 515.A O no hydrogen 2.874 N/A ILE 302.A N SER 299.A OG no hydrogen 3.162 N/A TYR 303.A N SER 299.A O no hydrogen 2.835 N/A HIS 304.A N GLY 300.A O no hydrogen 3.029 N/A HIS 304.A ND1 GLY 300.A O no hydrogen 3.027 N/A LYS 305.A N TYR 301.A O no hydrogen 2.881 N/A LEU 306.A N ILE 302.A O no hydrogen 2.861 N/A LEU 307.A N TYR 303.A O no hydrogen 3.206 N/A GLY 308.A N LYS 305.A O no hydrogen 3.128 N/A HIS 309.A N HIS 304.A O no hydrogen 2.911 N/A HIS 309.A NE2 TYR 173.A O no hydrogen 2.655 N/A ILE 316.A N GLN 345.A O no hydrogen 2.838 N/A CYS 318.A SG LEU 344.A O no hydrogen 3.479 N/A ARG 323.A NH2 ASP 331.A OD2 no hydrogen 3.397 N/A LEU 329.A N ALA 326.A O no hydrogen 3.308 N/A LEU 332.A N THR 325.A OG1 no hydrogen 3.152 N/A ASN 333.A N GLN 336.A OE1 no hydrogen 2.978 N/A ASN 333.A ND2 TYR 563.A OH no hydrogen 2.839 N/A GLN 336.A N ASN 333.A OD1 no hydrogen 2.831 N/A GLN 336.A NE2 THR 357.A O no hydrogen 3.183 N/A VAL 337.A N ASN 333.A O no hydrogen 2.876 N/A TYR 338.A N HIS 334.A O no hydrogen 2.998 N/A ALA 339.A N SER 335.A O no hydrogen 3.159 N/A VAL 340.A N GLN 336.A O no hydrogen 2.910 N/A LYS 341.A N VAL 337.A O no hydrogen 2.788 N/A THR 342.A N TYR 338.A O no hydrogen 3.053 N/A THR 342.A OG1 TYR 338.A O no hydrogen 2.768 N/A VAL 343.A N ALA 339.A O no hydrogen 2.924 N/A LEU 344.A N VAL 340.A O no hydrogen 3.123 N/A GLN 345.A N THR 342.A O no hydrogen 3.238 N/A ARG 346.A N VAL 343.A O no hydrogen 3.453 N/A ARG 346.A NH2 LEU 348.A O no hydrogen 3.363 N/A SER 349.A N LEU 518.A O no hydrogen 3.058 N/A ILE 351.A N LEU 520.A O no hydrogen 2.698 N/A GLN 352.A N ILE 557.A O no hydrogen 2.700 N/A GLN 352.A NE2 ASP 523.A OD1 no hydrogen 2.720 N/A GLY 353.A N GLY 522.A O no hydrogen 2.872 N/A THR 357.A N PRO 354.A O no hydrogen 3.127 N/A THR 357.A OG1 PRO 354.A O no hydrogen 2.637 N/A LYS 359.A NZ ASP 497.A OD1 no hydrogen 2.898 N/A THR 362.A N GLY 358.A O no hydrogen 2.948 N/A THR 362.A OG1 GLY 358.A O no hydrogen 2.855 N/A SER 363.A N LYS 359.A O no hydrogen 2.661 N/A SER 363.A OG LYS 359.A O no hydrogen 2.715 N/A SER 363.A OG ASP 497.A OD2 no hydrogen 3.339 N/A ALA 364.A N THR 360.A O no hydrogen 2.707 N/A THR 365.A N VAL 361.A O no hydrogen 2.955 N/A THR 365.A OG1 VAL 361.A O no hydrogen 2.798 N/A ILE 366.A N THR 362.A O no hydrogen 2.876 N/A VAL 367.A N SER 363.A O no hydrogen 2.785 N/A TYR 368.A N ALA 364.A O no hydrogen 2.894 N/A TYR 368.A OH GLN 327.A OE1 no hydrogen 3.254 N/A HIS 369.A N THR 365.A O no hydrogen 3.244 N/A HIS 369.A NE2 PHE 324.A O no hydrogen 2.631 N/A LEU 370.A N ILE 366.A O no hydrogen 2.984 N/A ALA 371.A N VAL 367.A O no hydrogen 2.828 N/A ARG 372.A N TYR 368.A O no hydrogen 3.262 N/A ARG 372.A N HIS 369.A O no hydrogen 3.250 N/A GLN 373.A N LEU 370.A O no hydrogen 2.943 N/A VAL 378.A N ASP 472.A O no hydrogen 2.930 N/A LEU 379.A N SER 493.A O no hydrogen 3.152 N/A VAL 380.A N ILE 474.A O no hydrogen 2.956 N/A CYS 381.A N LEU 495.A O no hydrogen 2.791 N/A CYS 381.A SG CYS 476.A O no hydrogen 3.424 N/A ALA 387.A N SER 384.A OG no hydrogen 3.265 N/A VAL 388.A N SER 384.A O no hydrogen 3.078 N/A ASP 389.A N ASN 385.A O no hydrogen 2.900 N/A GLN 390.A N ILE 386.A O no hydrogen 3.030 N/A LEU 391.A N ALA 387.A O no hydrogen 3.107 N/A THR 392.A N VAL 388.A O no hydrogen 2.636 N/A THR 392.A OG1 VAL 388.A O no hydrogen 3.034 N/A GLU 393.A N ASP 389.A O no hydrogen 2.980 N/A LYS 394.A N GLN 390.A O no hydrogen 3.353 N/A ILE 395.A N LEU 391.A O no hydrogen 3.023 N/A HIS 396.A N THR 392.A O no hydrogen 3.065 N/A GLN 397.A N GLU 393.A O no hydrogen 3.292 N/A GLN 397.A N LYS 394.A O no hydrogen 3.026 N/A THR 398.A N ILE 395.A O no hydrogen 2.929 N/A THR 398.A OG1 ILE 395.A O no hydrogen 2.640 N/A GLY 399.A N HIS 396.A O no hydrogen 3.079 N/A LYS 401.A N ASP 472.A OD2 no hydrogen 2.892 N/A VAL 403.A N VAL 473.A O no hydrogen 2.934 N/A ARG 404.A N LEU 420.A O no hydrogen 2.934 N/A ARG 404.A NE ASP 389.A OD1 no hydrogen 2.919 N/A ARG 404.A NH1 LEU 405.A O no hydrogen 2.947 N/A ARG 404.A NH2 ASP 389.A OD1 no hydrogen 2.639 N/A LEU 405.A N CYS 475.A O no hydrogen 2.819 N/A ARG 410.A N ALA 407.A O no hydrogen 2.954 N/A ILE 413.A N ARG 410.A O no hydrogen 3.174 N/A SER 415.A N SER 418.A OG no hydrogen 3.125 N/A VAL 417.A N SER 415.A OG no hydrogen 3.207 N/A SER 418.A N SER 415.A O no hydrogen 3.052 N/A SER 418.A OG SER 415.A O no hydrogen 3.309 N/A LEU 420.A N VAL 417.A O no hydrogen 3.151 N/A ALA 421.A N SER 418.A O no hydrogen 2.803 N/A LEU 422.A N ARG 404.A O no hydrogen 2.804 N/A ASN 424.A N ALA 421.A O no hydrogen 2.919 N/A ASN 424.A ND2 SER 418.A O no hydrogen 2.972 N/A GLN 425.A N ALA 421.A O no hydrogen 2.791 N/A GLN 425.A NE2 VAL 402.A O no hydrogen 3.219 N/A GLN 425.A NE2 LEU 420.A O no hydrogen 2.694 N/A ILE 426.A N LEU 422.A O no hydrogen 2.896 N/A ARG 427.A N HIS 423.A O no hydrogen 3.212 N/A ARG 427.A NH1 ASP 443.A OD2 no hydrogen 3.101 N/A ARG 427.A NH2 ASP 443.A OD1 no hydrogen 3.020 N/A ARG 427.A NH2 ASP 443.A OD2 no hydrogen 2.659 N/A ASN 428.A N ASN 424.A O no hydrogen 3.207 N/A ASN 428.A N GLN 425.A O no hydrogen 3.247 N/A MET 429.A N ILE 426.A O no hydrogen 3.129 N/A MET 432.A N MET 429.A O no hydrogen 3.403 N/A GLN 436.A N MET 432.A O no hydrogen 3.296 N/A GLN 436.A NE2 ARG 427.A O no hydrogen 2.876 N/A GLN 436.A NE2 ASP 430.A OD1 no hydrogen 3.439 N/A LYS 437.A N PRO 433.A O no hydrogen 3.130 N/A LEU 438.A N GLU 434.A O no hydrogen 3.010 N/A GLN 439.A N LEU 435.A O no hydrogen 2.793 N/A GLN 439.A NE2 GLN 439.A O no hydrogen 3.219 N/A GLN 439.A NE2 ASP 443.A OD2 no hydrogen 3.280 N/A GLN 440.A N GLN 436.A O no hydrogen 2.838 N/A LEU 441.A N LYS 437.A O no hydrogen 3.271 N/A LYS 442.A N LEU 438.A O no hydrogen 3.164 N/A ASP 443.A N GLN 439.A O no hydrogen 3.155 N/A GLU 444.A N GLN 440.A O no hydrogen 3.223 N/A THR 445.A N LYS 442.A O no hydrogen 3.218 N/A GLU 453.A N SER 449.A O no hydrogen 2.844 N/A LYS 454.A N SER 450.A O no hydrogen 3.061 N/A ARG 455.A N ALA 451.A O no hydrogen 3.226 N/A ARG 455.A NE GLU 434.A OE2 no hydrogen 3.222 N/A ARG 455.A NH2 GLU 434.A OE1 no hydrogen 2.901 N/A TYR 456.A N ASP 452.A O no hydrogen 2.993 N/A TYR 456.A OH GLN 439.A OE1 no hydrogen 3.227 N/A ARG 457.A N GLU 453.A O no hydrogen 2.939 N/A ALA 458.A N LYS 454.A O no hydrogen 2.933 N/A LEU 459.A N ARG 455.A O no hydrogen 3.035 N/A LYS 460.A N TYR 456.A O no hydrogen 2.854 N/A LYS 460.A NZ TYR 456.A OH no hydrogen 2.923 N/A ARG 461.A N ARG 457.A O no hydrogen 2.919 N/A THR 462.A N ALA 458.A O no hydrogen 3.078 N/A THR 462.A OG1 ALA 458.A O no hydrogen 3.459 N/A ALA 463.A N LEU 459.A O no hydrogen 2.859 N/A GLU 464.A N LYS 460.A O no hydrogen 2.985 N/A ARG 465.A N ARG 461.A O no hydrogen 2.978 N/A GLU 466.A N THR 462.A O no hydrogen 2.876 N/A LEU 467.A N ALA 463.A O no hydrogen 3.010 N/A LEU 468.A N GLU 464.A O no hydrogen 2.970 N/A MET 469.A N ARG 465.A O no hydrogen 2.980 N/A ASN 470.A N GLU 466.A O no hydrogen 3.315 N/A ALA 471.A N LEU 468.A O no hydrogen 3.044 N/A VAL 473.A N LYS 401.A O no hydrogen 3.140 N/A ILE 474.A N VAL 378.A O no hydrogen 2.900 N/A CYS 475.A N VAL 403.A O no hydrogen 2.926 N/A CYS 476.A N VAL 380.A O no hydrogen 3.171 N/A CYS 476.A SG THR 477.A O no hydrogen 3.547 N/A CYS 478.A N ALA 382.A O no hydrogen 3.036 N/A GLY 480.A N THR 477.A OG1 no hydrogen 2.981 N/A ALA 481.A N THR 477.A O no hydrogen 2.878 N/A ALA 481.A N CYS 478.A O no hydrogen 2.844 N/A GLY 482.A N VAL 479.A O no hydrogen 2.938 N/A ASP 483.A N GLY 480.A O no hydrogen 3.049 N/A ARG 485.A N ASP 483.A OD1 no hydrogen 2.787 N/A ARG 485.A NE ASP 483.A OD1 no hydrogen 2.817 N/A ARG 485.A NH2 CYS 406.A O no hydrogen 3.208 N/A ARG 485.A NH2 ASP 483.A OD2 no hydrogen 2.967 N/A LEU 486.A N ASP 483.A O no hydrogen 3.149 N/A ALA 487.A N ASP 483.A O no hydrogen 3.345 N/A ALA 487.A N PRO 484.A O no hydrogen 3.087 N/A GLN 490.A NE2 LEU 513.A O no hydrogen 3.510 N/A PHE 491.A N LEU 513.A O no hydrogen 2.754 N/A ILE 494.A N GLN 517.A O no hydrogen 2.886 N/A LEU 495.A N LEU 379.A O no hydrogen 2.839 N/A ILE 496.A N ILE 519.A O no hydrogen 2.982 N/A ASP 497.A N CYS 381.A O no hydrogen 2.680 N/A SER 499.A N VAL 521.A O no hydrogen 2.961 N/A SER 499.A OG VAL 521.A O no hydrogen 3.113 N/A THR 500.A OG1 ASP 523.A O no hydrogen 3.519 N/A GLN 501.A N GLU 498.A O no hydrogen 3.055 N/A GLN 501.A NE2 GLN 691.A OE1 no hydrogen 2.437 N/A ALA 502.A N SER 499.A O no hydrogen 3.045 N/A CYS 507.A N THR 503.A O no hydrogen 3.063 N/A MET 508.A N GLU 504.A O no hydrogen 2.796 N/A VAL 509.A N GLU 506.A O no hydrogen 3.010 N/A VAL 512.A N MET 508.A O no hydrogen 3.210 N/A LEU 513.A N PRO 510.A O no hydrogen 2.958 N/A GLY 514.A N SER 297.A O no hydrogen 2.776 N/A ALA 515.A N VAL 511.A O no hydrogen 3.364 N/A LYS 516.A N ARG 492.A O no hydrogen 2.752 N/A GLN 517.A N ARG 492.A O no hydrogen 2.899 N/A GLN 517.A NE2 VAL 343.A O no hydrogen 3.137 N/A GLN 517.A NE2 LEU 344.A O no hydrogen 3.168 N/A GLN 517.A NE2 ARG 346.A O no hydrogen 2.764 N/A LEU 518.A N PRO 347.A O no hydrogen 2.799 N/A ILE 519.A N ILE 494.A O no hydrogen 3.036 N/A LEU 520.A N SER 349.A O no hydrogen 2.878 N/A VAL 521.A N ILE 496.A O no hydrogen 2.879 N/A GLY 522.A N ILE 351.A O no hydrogen 2.932 N/A ASP 523.A N THR 500.A OG1 no hydrogen 3.091 N/A CYS 525.A N ASP 523.A OD1 no hydrogen 2.913 N/A CYS 525.A SG PHE 577.A O no hydrogen 3.670 N/A GLN 526.A N ASP 523.A O no hydrogen 3.059 N/A GLN 526.A NE2 ASP 523.A OD2 no hydrogen 2.828 N/A CYS 533.A N GLU 190.A OE2 no hydrogen 2.666 N/A ALA 537.A N CYS 533.A O no hydrogen 2.841 N/A LYS 538.A N LYS 534.A O no hydrogen 2.698 N/A ALA 539.A N LYS 535.A O no hydrogen 3.054 N/A GLY 540.A N ALA 537.A O no hydrogen 2.956 N/A LEU 541.A N ALA 536.A O no hydrogen 3.085 N/A SER 542.A OG ALA 537.A O no hydrogen 3.256 N/A GLN 543.A N GLY 540.A O no hydrogen 3.131 N/A SER 544.A N GLU 547.A OE1 no hydrogen 3.174 N/A SER 544.A OG GLU 547.A OE1 no hydrogen 3.288 N/A GLU 547.A N SER 544.A OG no hydrogen 3.162 N/A ARG 548.A N SER 544.A O no hydrogen 3.035 N/A ARG 548.A NE GLU 504.A OE1 no hydrogen 2.570 N/A ARG 548.A NE GLU 504.A OE2 no hydrogen 3.078 N/A ARG 548.A NH1 LEU 171.A O no hydrogen 2.606 N/A ARG 548.A NH1 LEU 306.A O no hydrogen 2.905 N/A ARG 548.A NH2 LEU 306.A O no hydrogen 2.555 N/A ARG 548.A NH2 GLU 504.A OE2 no hydrogen 2.740 N/A LEU 549.A N LEU 545.A O no hydrogen 2.873 N/A VAL 550.A N PHE 546.A O no hydrogen 2.890 N/A VAL 551.A N GLU 547.A O no hydrogen 2.814 N/A LEU 552.A N ARG 548.A O no hydrogen 2.725 N/A GLY 553.A N LEU 549.A O no hydrogen 3.241 N/A GLY 553.A N VAL 550.A O no hydrogen 3.013 N/A ILE 554.A N LEU 549.A O no hydrogen 3.061 N/A ARG 555.A NH1 GLU 579.A OE2 no hydrogen 3.225 N/A ARG 555.A NH2 GLU 579.A OE1 no hydrogen 3.114 N/A ILE 557.A N LEU 350.A O no hydrogen 2.854 N/A ARG 558.A NH1 GLN 352.A OE1 no hydrogen 2.843 N/A LEU 559.A N GLN 352.A O no hydrogen 2.883 N/A GLN 560.A N SER 335.A OG no hydrogen 2.630 N/A GLN 562.A N GLN 583.A O no hydrogen 2.799 N/A GLN 562.A NE2 MET 565.A O no hydrogen 2.626 N/A GLN 562.A NE2 ASN 584.A OD1 no hydrogen 3.365 N/A TYR 563.A N GLY 356.A O no hydrogen 2.936 N/A ARG 564.A N GLN 562.A OE1 no hydrogen 2.731 N/A ARG 564.A NE GLU 694.A OE1 no hydrogen 2.738 N/A ARG 564.A NH1 THR 725.A O no hydrogen 2.656 N/A MET 565.A N GLN 562.A OE1 no hydrogen 2.777 N/A HIS 566.A N ARG 728.A O no hydrogen 3.021 N/A ALA 568.A N HIS 566.A ND1 no hydrogen 3.068 N/A LEU 569.A N HIS 566.A O no hydrogen 2.860 N/A SER 570.A OG PRO 567.A O no hydrogen 2.746 N/A SER 570.A OG ASN 584.A OD1 no hydrogen 2.709 N/A ALA 571.A N PRO 567.A O no hydrogen 3.104 N/A SER 574.A N SER 570.A O no hydrogen 2.909 N/A ASN 575.A N ALA 571.A O no hydrogen 3.081 N/A ILE 576.A N PHE 572.A O no hydrogen 2.989 N/A PHE 577.A N PRO 573.A O no hydrogen 2.795 N/A TYR 578.A N SER 574.A O no hydrogen 2.966 N/A TYR 578.A OH ASP 523.A OD2 no hydrogen 2.453 N/A TYR 578.A OH ASN 721.A OD1 no hydrogen 2.721 N/A GLY 580.A N SER 574.A O no hydrogen 2.832 N/A SER 581.A N TYR 578.A O no hydrogen 2.732 N/A SER 581.A OG TYR 578.A O no hydrogen 2.755 N/A LEU 582.A N SER 574.A OG no hydrogen 3.142 N/A GLN 583.A N GLN 560.A O no hydrogen 2.675 N/A GLY 585.A N GLN 562.A O no hydrogen 2.749 N/A ARG 591.A N ALA 588.A O no hydrogen 3.079 N/A ARG 591.A NE ARG 564.A O no hydrogen 2.844 N/A ARG 591.A NH2 ARG 564.A O no hydrogen 3.209 N/A VAL 592.A N ALA 589.A O no hydrogen 3.381 N/A ASP 597.A N ALA 644.A O no hydrogen 2.897 N/A LYS 605.A N GLN 602.A O no hydrogen 3.021 N/A LYS 605.A NZ GLN 756.A O no hydrogen 3.002 N/A LYS 605.A NZ GLN 756.A OE1 no hydrogen 3.553 N/A PHE 608.A N VAL 731.A O no hydrogen 3.236 N/A PHE 609.A N VAL 758.A O no hydrogen 2.984 N/A TYR 610.A N ILE 733.A O no hydrogen 2.777 N/A TYR 610.A OH GLY 762.A O no hydrogen 2.642 N/A VAL 611.A N VAL 760.A O no hydrogen 3.000 N/A THR 612.A N GLY 735.A O no hydrogen 3.113 N/A GLU 617.A N LEU 626.A O no hydrogen 2.956 N/A ALA 619.A N SER 624.A O no hydrogen 3.018 N/A SER 621.A OG ALA 619.A O no hydrogen 2.681 N/A GLY 622.A N ALA 619.A O no hydrogen 2.537 N/A LEU 626.A N GLU 617.A O no hydrogen 2.915 N/A ASN 627.A N GLN 660.A OE1 no hydrogen 2.758 N/A ASN 627.A ND2 VAL 703.A O no hydrogen 3.169 N/A ARG 628.A NE GLU 617.A OE1 no hydrogen 2.690 N/A ARG 628.A NE GLU 617.A OE2 no hydrogen 3.570 N/A GLU 630.A N ASN 627.A OD1 no hydrogen 3.027 N/A ALA 631.A N ASN 627.A O no hydrogen 3.006 N/A ALA 632.A N ARG 628.A O no hydrogen 3.007 N/A ASN 633.A N THR 629.A O no hydrogen 2.862 N/A ASN 633.A ND2 THR 612.A OG1 no hydrogen 3.324 N/A VAL 634.A N GLU 630.A O no hydrogen 2.747 N/A GLU 635.A N ALA 631.A O no hydrogen 2.994 N/A LYS 636.A N ALA 632.A O no hydrogen 3.124 N/A ILE 637.A N ASN 633.A O no hydrogen 2.996 N/A THR 638.A N VAL 634.A O no hydrogen 2.718 N/A THR 638.A OG1 VAL 634.A O no hydrogen 2.690 N/A THR 639.A N GLU 635.A O no hydrogen 2.634 N/A THR 639.A OG1 GLU 635.A O no hydrogen 3.014 N/A THR 639.A OG1 GLU 635.A OE1 no hydrogen 2.571 N/A THR 639.A OG1 TYR 679.A OH no hydrogen 2.495 N/A LYS 640.A N LYS 636.A O no hydrogen 3.042 N/A LYS 640.A NZ ASN 765.A OD1 no hydrogen 2.620 N/A LEU 641.A N ILE 637.A O no hydrogen 3.005 N/A LEU 642.A N THR 638.A O no hydrogen 3.053 N/A LYS 643.A N THR 639.A O no hydrogen 2.850 N/A ALA 644.A N LYS 640.A O no hydrogen 2.711 N/A GLY 645.A N LEU 642.A O no hydrogen 3.098 N/A ALA 646.A N LEU 641.A O no hydrogen 2.921 N/A GLN 650.A N LYS 647.A O no hydrogen 2.799 N/A ILE 651.A N PRO 648.A O no hydrogen 2.791 N/A GLY 652.A N PHE 697.A O no hydrogen 2.882 N/A ILE 653.A N GLU 683.A O no hydrogen 2.821 N/A ILE 654.A N ILE 699.A O no hydrogen 2.796 N/A THR 655.A N ALA 685.A O no hydrogen 2.761 N/A THR 655.A OG1 SER 701.A O no hydrogen 3.069 N/A GLY 659.A N SER 624.A OG no hydrogen 3.285 N/A GLN 660.A NE2 ASN 627.A O no hydrogen 3.300 N/A GLN 660.A NE2 SER 701.A OG no hydrogen 2.929 N/A ARG 661.A N TYR 657.A O no hydrogen 2.990 N/A ARG 661.A NE GLU 658.A OE1 no hydrogen 3.153 N/A ARG 661.A NE GLU 658.A OE2 no hydrogen 3.102 N/A ARG 661.A NH2 GLU 658.A OE2 no hydrogen 2.758 N/A SER 662.A N GLU 658.A O no hydrogen 2.664 N/A TYR 663.A N GLY 659.A O no hydrogen 2.980 N/A LEU 664.A N GLN 660.A O no hydrogen 2.697 N/A VAL 665.A N ARG 661.A O no hydrogen 3.171 N/A GLN 666.A N SER 662.A O no hydrogen 3.160 N/A TYR 667.A N TYR 663.A O no hydrogen 2.748 N/A MET 668.A N LEU 664.A O no hydrogen 3.327 N/A GLN 669.A N VAL 665.A O no hydrogen 3.231 N/A PHE 670.A N GLN 666.A O no hydrogen 3.018 N/A SER 671.A OG TYR 667.A O no hydrogen 3.258 N/A GLY 672.A N MET 668.A O no hydrogen 3.422 N/A LEU 674.A N TYR 679.A OH no hydrogen 3.193 N/A LYS 677.A N HIS 675.A ND1 no hydrogen 3.285 N/A TYR 679.A OH THR 639.A OG1 no hydrogen 2.495 N/A GLN 680.A NE2 GLN 669.A OE1 no hydrogen 3.135 N/A VAL 682.A N TYR 679.A O no hydrogen 2.944 N/A ALA 685.A N ILE 653.A O no hydrogen 2.905 N/A ALA 689.A N SER 686.A O no hydrogen 3.257 N/A PHE 690.A N VAL 687.A O no hydrogen 2.831 N/A GLN 691.A N ASP 688.A O no hydrogen 3.453 N/A GLN 691.A NE2 ASP 688.A O no hydrogen 3.315 N/A ARG 693.A N PHE 690.A O no hydrogen 3.023 N/A ARG 693.A NH1 GLU 683.A OE2 no hydrogen 2.873 N/A ARG 693.A NH1 ALA 689.A O no hydrogen 3.208 N/A ARG 693.A NH2 GLU 683.A OE1 no hydrogen 2.819 N/A ARG 693.A NH2 GLU 683.A OE2 no hydrogen 3.458 N/A LYS 695.A N ARG 726.A O no hydrogen 3.029 N/A LYS 695.A NZ ASP 649.A O no hydrogen 2.905 N/A LYS 695.A NZ GLU 683.A OE1 no hydrogen 3.116 N/A ASP 696.A N GLN 650.A OE1 no hydrogen 3.212 N/A PHE 697.A N GLN 650.A O no hydrogen 3.013 N/A ILE 698.A N GLY 730.A O no hydrogen 3.099 N/A ILE 699.A N GLY 652.A O no hydrogen 2.831 N/A LEU 700.A N ILE 732.A O no hydrogen 2.862 N/A SER 701.A N ILE 654.A O no hydrogen 3.001 N/A SER 701.A OG GLU 630.A OE1 no hydrogen 2.650 N/A CYS 702.A N VAL 734.A O no hydrogen 3.165 N/A CYS 702.A SG VAL 734.A O no hydrogen 3.400 N/A VAL 703.A N GLU 630.A OE1 no hydrogen 2.633 N/A VAL 703.A N GLU 630.A OE2 no hydrogen 3.248 N/A ARG 704.A N CYS 702.A O no hydrogen 2.635 N/A ARG 704.A NE GLU 616.A OE2 no hydrogen 2.852 N/A ARG 704.A NH1 TYR 657.A OH no hydrogen 3.332 N/A ARG 704.A NH2 GLU 616.A OE1 no hydrogen 3.180 N/A ALA 705.A N GLU 616.A OE2 no hydrogen 2.830 N/A ASN 706.A N GLU 616.A OE2 no hydrogen 3.142 N/A ASN 706.A ND2 GLU 616.A OE1 no hydrogen 2.942 N/A HIS 708.A ND1 ASN 706.A O no hydrogen 3.093 N/A ILE 711.A N TYR 657.A OH no hydrogen 3.518 N/A LEU 714.A N ILE 711.A O no hydrogen 3.343 N/A ASN 715.A N GLY 712.A O no hydrogen 3.187 N/A ASP 716.A N GLY 712.A O no hydrogen 3.170 N/A ARG 718.A N ASP 716.A OD2 no hydrogen 3.327 N/A ARG 718.A NE HIS 524.A O no hydrogen 3.284 N/A ARG 719.A NH1 ASP 688.A OD1 no hydrogen 3.178 N/A LEU 720.A N ASP 716.A O no hydrogen 3.025 N/A ASN 721.A N PRO 717.A O no hydrogen 2.867 N/A VAL 722.A N ARG 718.A O no hydrogen 3.131 N/A ALA 723.A N ARG 719.A O no hydrogen 2.959 N/A LEU 724.A N LEU 720.A O no hydrogen 2.946 N/A LEU 724.A N ASN 721.A O no hydrogen 3.249 N/A THR 725.A N VAL 722.A O no hydrogen 2.963 N/A THR 725.A OG1 ASN 721.A O no hydrogen 2.751 N/A THR 725.A OG1 VAL 722.A O no hydrogen 3.279 N/A ARG 726.A NE VAL 722.A O no hydrogen 2.765 N/A ARG 726.A NH1 PHE 690.A O no hydrogen 3.386 N/A ARG 726.A NH1 ARG 693.A O no hydrogen 3.131 N/A ARG 726.A NH2 THR 725.A OG1 no hydrogen 3.021 N/A ARG 728.A N LYS 695.A O no hydrogen 2.853 N/A ARG 728.A NE ASP 696.A OD1 no hydrogen 2.739 N/A ARG 728.A NH2 GLN 650.A OE1 no hydrogen 2.977 N/A ARG 728.A NH2 ASP 696.A OD1 no hydrogen 3.393 N/A TYR 729.A N ASP 696.A O no hydrogen 2.828 N/A GLY 730.A N ASP 696.A O no hydrogen 3.179 N/A VAL 731.A N PRO 606.A O no hydrogen 3.415 N/A ILE 732.A N ILE 698.A O no hydrogen 2.837 N/A ILE 733.A N PHE 608.A O no hydrogen 2.886 N/A VAL 734.A N LEU 700.A O no hydrogen 2.806 N/A GLY 735.A N TYR 610.A O no hydrogen 3.303 N/A ASN 736.A ND2 THR 612.A O no hydrogen 3.534 N/A ALA 739.A N ASN 736.A OD1 no hydrogen 3.327 N/A LEU 740.A N ASN 736.A O no hydrogen 2.993 N/A SER 741.A N PRO 737.A O no hydrogen 2.736 N/A SER 741.A OG PRO 737.A O no hydrogen 3.076 N/A SER 741.A OG LYS 738.A O no hydrogen 3.115 N/A GLN 743.A N LEU 740.A O no hydrogen 3.020 N/A TRP 746.A NE1 PHE 713.A O no hydrogen 3.229 N/A ASN 747.A N GLN 743.A O no hydrogen 2.967 N/A HIS 748.A N PRO 744.A O no hydrogen 3.114 N/A HIS 748.A ND1 PRO 744.A O no hydrogen 2.704 N/A LEU 749.A N LEU 745.A O no hydrogen 3.129 N/A LEU 750.A N TRP 746.A O no hydrogen 2.787 N/A ASN 751.A N ASN 747.A O no hydrogen 2.790 N/A ASN 751.A ND2 ASN 747.A O no hydrogen 2.640 N/A TYR 752.A N HIS 748.A O no hydrogen 2.681 N/A TYR 753.A N LEU 749.A O no hydrogen 2.810 N/A LYS 754.A N LEU 750.A O no hydrogen 2.800 N/A LYS 754.A NZ SER 770.A O no hydrogen 3.272 N/A LYS 754.A NZ MET 772.A O no hydrogen 2.861 N/A GLU 755.A N ASN 751.A O no hydrogen 2.976 N/A GLN 756.A N TYR 752.A O no hydrogen 2.851 N/A LYS 757.A N LYS 754.A O no hydrogen 2.698 N/A VAL 758.A N TYR 753.A O no hydrogen 2.737 N/A VAL 760.A N PHE 609.A O no hydrogen 2.800 N/A GLU 761.A N ARG 768.A O no hydrogen 2.721 N/A ASN 766.A N PRO 763.A O no hydrogen 2.927 N/A ARG 768.A N GLU 761.A O no hydrogen 3.156 N/A SER 770.A N LEU 759.A O no hydrogen 3.046 N/A SER 770.A OG GLU 761.A OE2 no hydrogen 2.552 N/A