Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fwg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N ILE 547.A O no hydrogen 2.748 N/A TYR 4.A OH GLU 8.A OE1 no hydrogen 2.595 N/A ALA 6.A N SER 3.A OG no hydrogen 2.811 N/A LEU 7.A N SER 3.A O no hydrogen 3.104 N/A LEU 7.A N TYR 4.A O no hydrogen 3.176 N/A GLU 8.A N TYR 4.A O no hydrogen 3.037 N/A TRP 9.A N GLU 8.A OE2 no hydrogen 2.871 N/A TRP 9.A NE1 LEU 532.A O no hydrogen 2.879 N/A ARG 10.A N GLU 8.A OE2 no hydrogen 2.835 N/A ARG 10.A NE GLU 8.A OE2 no hydrogen 2.948 N/A ARG 10.A NH2 GLU 8.A OE1 no hydrogen 3.006 N/A THR 11.A N ASP 300.A OD2 no hydrogen 2.859 N/A THR 11.A OG1 ASP 300.A OD1 no hydrogen 2.646 N/A ASN 15.A N GLU 14.A OE1 no hydrogen 2.702 N/A GLU 18.A N ASN 15.A O no hydrogen 3.052 N/A VAL 20.A N LEU 290.A O no hydrogen 2.977 N/A PHE 29.A N PRO 26.A O no hydrogen 3.280 N/A GLN 31.A N PHE 28.A O no hydrogen 2.851 N/A GLN 31.A NE2 SER 267.A O no hydrogen 2.961 N/A ARG 35.A N GLN 31.A O no hydrogen 3.073 N/A ARG 35.A NE GLU 32.A OE1 no hydrogen 2.340 N/A ARG 35.A NH1 GLU 39.A OE1 no hydrogen 3.474 N/A ARG 35.A NH2 GLU 32.A OE2 no hydrogen 2.589 N/A GLU 36.A N GLU 32.A O no hydrogen 2.897 N/A ALA 37.A N ARG 33.A O no hydrogen 3.007 N/A LEU 38.A N ALA 34.A O no hydrogen 2.899 N/A GLU 39.A N ARG 35.A O no hydrogen 2.890 N/A LEU 40.A N GLU 36.A O no hydrogen 3.258 N/A ALA 41.A N ALA 37.A O no hydrogen 3.124 N/A ILE 42.A N LEU 38.A O no hydrogen 3.013 N/A ARG 43.A N GLU 39.A O no hydrogen 2.895 N/A ARG 43.A NH1 GLU 39.A OE2 no hydrogen 3.432 N/A GLY 44.A N LEU 40.A O no hydrogen 2.845 N/A ALA 48.A N VAL 239.A O no hydrogen 2.938 N/A TYR 49.A N ILE 262.A O no hydrogen 2.845 N/A LEU 50.A N LEU 240.A O no hydrogen 2.863 N/A VAL 51.A N ALA 264.A O no hydrogen 3.069 N/A GLY 52.A N GLY 242.A O no hydrogen 3.156 N/A SER 55.A OG GLU 316.A OE2 no hydrogen 2.963 N/A LYS 58.A NZ GLY 52.A O no hydrogen 3.142 N/A LYS 58.A NZ PRO 53.A O no hydrogen 2.835 N/A HIS 59.A NE2 ASP 195.A OD1 no hydrogen 2.534 N/A ALA 61.A N GLY 57.A O no hydrogen 2.994 N/A LEU 62.A N LYS 58.A O no hydrogen 2.978 N/A LEU 63.A N HIS 59.A O no hydrogen 2.906 N/A ALA 64.A N GLU 60.A O no hydrogen 3.108 N/A TYR 65.A N ALA 61.A O no hydrogen 3.031 N/A LEU 66.A N LEU 62.A O no hydrogen 2.909 N/A SER 67.A N LEU 63.A O no hydrogen 3.080 N/A SER 67.A OG ALA 64.A O no hydrogen 2.529 N/A THR 68.A N TYR 65.A O no hydrogen 3.132 N/A THR 68.A OG1 TYR 65.A O no hydrogen 2.876 N/A GLN 69.A N LEU 66.A O no hydrogen 3.126 N/A GLN 69.A NE2 TYR 65.A O no hydrogen 3.295 N/A SER 70.A OG THR 148.A OG1 no hydrogen 3.116 N/A VAL 71.A N GLY 147.A O no hydrogen 3.060 N/A LEU 77.A N THR 142.A O no hydrogen 3.185 N/A TYR 79.A N ASN 139.A O no hydrogen 3.094 N/A VAL 80.A N ALA 88.A O no hydrogen 2.853 N/A LEU 82.A N LYS 86.A O no hydrogen 2.917 N/A SER 83.A OG.A LEU 82.A O no hydrogen 2.495 N/A ARG 85.A N SER 83.A OG.B no hydrogen 2.844 N/A VAL 87.A N GLU 230.A O no hydrogen 2.911 N/A ALA 88.A N VAL 80.A O no hydrogen 2.946 N/A LEU 91.A N ASP 76.A O no hydrogen 3.277 N/A SER 93.A OG SER 144.A O no hydrogen 2.975 N/A GLY 94.A N ASP 76.A OD1 no hydrogen 3.139 N/A GLN 95.A N PRO 92.A O no hydrogen 3.043 N/A GLU 96.A N ASP 76.A OD2 no hydrogen 3.216 N/A LEU 99.A N GLN 95.A O no hydrogen 3.177 N/A ALA 100.A N GLU 96.A O no hydrogen 2.923 N/A ALA 102.A N HIS 98.A O no hydrogen 3.200 N/A VAL 103.A N LEU 99.A O no hydrogen 2.659 N/A GLU 104.A N ALA 100.A O no hydrogen 2.848 N/A GLY 105.A N GLU 101.A O no hydrogen 2.721 N/A LEU 107.A N GLU 104.A O no hydrogen 3.276 N/A ALA 114.A N PHE 111.A O no hydrogen 2.954 N/A TYR 117.A OH TRP 136.A O no hydrogen 2.451 N/A LEU 118.A N ALA 114.A O no hydrogen 2.897 N/A GLU 119.A N ARG 115.A O no hydrogen 3.122 N/A ALA 120.A N ALA 116.A O no hydrogen 3.375 N/A LEU 121.A N TYR 117.A O no hydrogen 2.951 N/A ARG 122.A N LEU 118.A O no hydrogen 2.962 N/A ALA 123.A N GLU 119.A O no hydrogen 2.887 N/A ARG 124.A N LEU 121.A O no hydrogen 3.241 N/A ARG 124.A NH1 ARG 124.A O no hydrogen 2.749 N/A LEU 125.A N LEU 121.A O no hydrogen 3.155 N/A ALA 126.A N ARG 122.A O no hydrogen 2.705 N/A ARG 127.A N ALA 123.A O no hydrogen 2.969 N/A TYR 128.A N ARG 124.A O no hydrogen 3.159 N/A TYR 128.A OH ASP 132.A OD2 no hydrogen 3.336 N/A ALA 129.A N LEU 125.A O no hydrogen 2.961 N/A GLU 130.A N ALA 126.A O no hydrogen 2.575 N/A ASN 139.A N TYR 79.A O no hydrogen 2.963 N/A ASN 139.A ND2 VAL 176.A O no hydrogen 3.079 N/A ASN 139.A ND2 ILE 179.A O no hydrogen 3.120 N/A LEU 141.A N LEU 77.A O no hydrogen 2.794 N/A THR 142.A N LEU 77.A O no hydrogen 3.457 N/A SER 143.A OG ASP 76.A OD1 no hydrogen 3.178 N/A THR 148.A N SER 146.A OG no hydrogen 2.898 N/A THR 148.A OG1 SER 70.A OG no hydrogen 3.116 N/A VAL 153.A N TYR 191.A O no hydrogen 2.870 N/A TYR 154.A OH ASP 195.A OD2 no hydrogen 2.539 N/A GLU 155.A N ILE 193.A O no hydrogen 3.043 N/A TYR 157.A N GLU 155.A OE2 no hydrogen 2.704 N/A ALA 158.A N SER 198.A OG no hydrogen 2.592 N/A THR 159.A N TYR 157.A O no hydrogen 2.831 N/A ARG 162.A N THR 159.A OG1 no hydrogen 3.141 N/A ARG 162.A NH1 GLU 155.A OE1 no hydrogen 3.331 N/A LEU 163.A N THR 159.A O no hydrogen 2.914 N/A PHE 164.A N ALA 160.A O no hydrogen 2.708 N/A GLY 165.A N PRO 161.A O no hydrogen 3.102 N/A ARG 166.A N ARG 180.A O no hydrogen 2.965 N/A LEU 167.A N VAL 220.A O no hydrogen 3.049 N/A ASP 168.A N LEU 178.A O no hydrogen 2.993 N/A TYR 169.A OH THR 221.A OG1 no hydrogen 3.415 N/A SER 173.A N LEU 170.A O no hydrogen 2.697 N/A SER 177.A N ASN 175.A OD1 no hydrogen 3.006 N/A LEU 178.A N ASN 175.A O no hydrogen 3.027 N/A ARG 180.A N ARG 166.A O no hydrogen 2.750 N/A GLY 182.A N HIS 185.A ND1 no hydrogen 2.969 N/A ALA 183.A N ARG 162.A O no hydrogen 2.757 N/A VAL 184.A N LEU 163.A O no hydrogen 3.004 N/A ARG 186.A N GLY 182.A O no hydrogen 3.153 N/A ALA 187.A N ALA 183.A O no hydrogen 2.873 N/A ALA 187.A N VAL 184.A O no hydrogen 3.293 N/A GLN 188.A N HIS 185.A O no hydrogen 3.115 N/A GLN 188.A NE2 VAL 184.A O no hydrogen 2.905 N/A GLY 189.A N GLN 237.A O no hydrogen 2.727 N/A GLY 190.A N ALA 187.A O no hydrogen 2.970 N/A TYR 191.A N PRO 151.A O no hydrogen 2.889 N/A LEU 192.A N GLN 238.A O no hydrogen 2.984 N/A ILE 193.A N VAL 153.A O no hydrogen 2.666 N/A ALA 196.A N VAL 241.A O no hydrogen 3.113 N/A SER 198.A OG PRO 156.A O no hydrogen 3.246 N/A LEU 199.A N ASP 195.A O no hydrogen 3.243 N/A LYS 200.A N ALA 196.A O no hydrogen 3.358 N/A LYS 200.A NZ ALA 246.A O no hydrogen 2.937 N/A ARG 201.A N LEU 197.A O no hydrogen 2.997 N/A GLU 202.A N SER 198.A O no hydrogen 2.696 N/A GLY 203.A N LYS 200.A O no hydrogen 2.946 N/A THR 204.A N LEU 199.A O no hydrogen 3.069 N/A THR 204.A OG1 ALA 158.A O no hydrogen 2.852 N/A TRP 205.A NE1 ASP 253.A OD2 no hydrogen 2.837 N/A PHE 208.A N THR 204.A O no hydrogen 2.921 N/A LYS 209.A N TRP 205.A O no hydrogen 2.810 N/A LYS 209.A NZ GLU 206.A OE1 no hydrogen 3.002 N/A LYS 209.A NZ ASP 253.A OD2 no hydrogen 2.731 N/A ARG 210.A N GLU 206.A O no hydrogen 3.061 N/A ALA 211.A N ALA 207.A O no hydrogen 2.983 N/A LEU 212.A N PHE 208.A O no hydrogen 2.968 N/A ARG 213.A N LYS 209.A O no hydrogen 2.702 N/A ARG 213.A NE ASN 214.A OD1 no hydrogen 3.359 N/A ARG 213.A NH2 ASN 214.A OD1 no hydrogen 3.109 N/A ASN 214.A N ARG 210.A O no hydrogen 2.778 N/A ASN 214.A ND2 GLN 216.A OE1 no hydrogen 3.237 N/A GLY 215.A N ALA 211.A O no hydrogen 3.022 N/A GLN 216.A N ARG 210.A O no hydrogen 3.421 N/A VAL 220.A N GLY 165.A O no hydrogen 2.882 N/A THR 221.A OG1 TYR 169.A OH no hydrogen 3.415 N/A GLU 222.A N TYR 169.A OH no hydrogen 2.592 N/A ALA 225.A N GLU 222.A O no hydrogen 3.374 N/A GLU 230.A N ARG 85.A O no hydrogen 2.739 N/A GLU 232.A N VAL 87.A O no hydrogen 2.844 N/A PHE 234.A N GLY 215.A O no hydrogen 3.077 N/A GLN 237.A N GLN 188.A OE1 no hydrogen 2.861 N/A GLN 238.A N GLY 190.A O no hydrogen 3.014 N/A GLN 238.A NE2 PHE 46.A O no hydrogen 3.094 N/A VAL 241.A N LEU 194.A O no hydrogen 2.815 N/A GLY 242.A N LEU 50.A O no hydrogen 2.871 N/A ALA 246.A N THR 243.A OG1 no hydrogen 3.028 N/A PHE 247.A N THR 243.A O no hydrogen 3.177 N/A GLU 251.A N PHE 247.A O no hydrogen 2.799 N/A ASP 253.A N LEU 250.A O no hydrogen 3.122 N/A ALA 255.A N ASP 253.A OD1 no hydrogen 2.968 N/A PHE 256.A N ASP 253.A O no hydrogen 2.918 N/A SER 257.A OG PRO 254.A O no hydrogen 3.382 N/A GLU 258.A N PRO 254.A O no hydrogen 3.294 N/A LEU 259.A N ALA 255.A O no hydrogen 3.002 N/A LEU 259.A N PHE 256.A O no hydrogen 3.114 N/A PHE 260.A N PHE 256.A O no hydrogen 2.830 N/A ARG 261.A NE GLU 258.A O no hydrogen 3.189 N/A ILE 262.A N HIS 47.A O no hydrogen 3.307 N/A ARG 263.A NE GLU 265.A OE1 no hydrogen 3.131 N/A ARG 263.A NH1 GLU 265.A OE1 no hydrogen 3.058 N/A ARG 263.A NH1 GLU 265.A OE2 no hydrogen 3.522 N/A ARG 263.A NH2 TYR 49.A OH no hydrogen 2.815 N/A ALA 264.A N TYR 49.A O no hydrogen 2.795 N/A PHE 266.A N VAL 51.A O no hydrogen 2.814 N/A SER 267.A N GLN 31.A OE1 no hydrogen 2.772 N/A ALA 271.A N ASP 309.A O no hydrogen 2.878 N/A ASN 275.A N SER 272.A OG no hydrogen 3.169 N/A ASN 275.A ND2 PRO 270.A O no hydrogen 2.947 N/A CYS 276.A N SER 272.A O no hydrogen 2.853 N/A THR 277.A N PRO 273.A O no hydrogen 2.888 N/A THR 277.A OG1 PRO 273.A O no hydrogen 3.050 N/A ALA 278.A N GLU 274.A O no hydrogen 2.920 N/A LEU 279.A N ASN 275.A O no hydrogen 2.750 N/A GLY 280.A N CYS 276.A O no hydrogen 3.002 N/A GLY 281.A N THR 277.A O no hydrogen 3.022 N/A TRP 282.A N ALA 278.A O no hydrogen 2.650 N/A LEU 283.A N LEU 279.A O no hydrogen 2.612 N/A LEU 284.A N GLY 280.A O no hydrogen 2.950 N/A ALA 285.A N GLY 281.A O no hydrogen 3.023 N/A GLN 286.A N TRP 282.A O no hydrogen 3.029 N/A GLY 287.A N LEU 284.A O no hydrogen 3.122 N/A PHE 288.A N LEU 283.A O no hydrogen 3.356 N/A GLN 289.A NE2 GLY 330.A O no hydrogen 3.615 N/A THR 291.A N LEU 332.A O no hydrogen 3.080 N/A THR 291.A OG1 SER 16.A O no hydrogen 2.998 N/A THR 291.A OG1 LEU 332.A O no hydrogen 3.287 N/A GLN 292.A N GLU 18.A O no hydrogen 2.928 N/A GLY 293.A N SER 16.A O no hydrogen 2.852 N/A GLY 294.A N THR 291.A OG1 no hydrogen 3.299 N/A LEU 295.A N THR 291.A O no hydrogen 2.870 N/A THR 296.A N GLN 292.A O no hydrogen 2.861 N/A THR 296.A OG1 GLN 292.A O no hydrogen 2.999 N/A ARG 297.A N GLY 293.A O no hydrogen 2.976 N/A ARG 297.A NE GLU 338.A OE2 no hydrogen 2.694 N/A ARG 297.A NH2 GLU 338.A OE2 no hydrogen 2.705 N/A LEU 298.A N GLY 294.A O no hydrogen 3.012 N/A TYR 299.A N LEU 295.A O no hydrogen 2.898 N/A ASP 300.A N THR 296.A O no hydrogen 2.823 N/A GLU 301.A N ARG 297.A O no hydrogen 2.942 N/A GLU 301.A N LEU 298.A O no hydrogen 3.197 N/A ALA 302.A N LEU 298.A O no hydrogen 2.841 N/A ARG 303.A N TYR 299.A O no hydrogen 3.177 N/A ARG 303.A NE ARG 308.A O no hydrogen 3.100 N/A ARG 303.A NH1 TRP 9.A O no hydrogen 2.859 N/A ARG 303.A NH1 ASP 300.A OD1 no hydrogen 2.849 N/A ARG 303.A NH2 TRP 9.A O no hydrogen 3.123 N/A ARG 303.A NH2 ARG 308.A O no hydrogen 2.841 N/A ARG 304.A N ASP 300.A O no hydrogen 2.987 N/A ARG 304.A NH1 GLU 503.A OE2 no hydrogen 2.603 N/A ARG 304.A NH1 THR 531.A O no hydrogen 2.942 N/A ARG 304.A NH2 GLU 503.A OE1 no hydrogen 2.661 N/A ARG 304.A NH2 GLU 503.A OE2 no hydrogen 3.279 N/A GLU 306.A N ARG 304.A O no hydrogen 2.871 N/A GLN 307.A N ARG 303.A O no hydrogen 3.306 N/A GLN 307.A NE2 GLU 306.A O no hydrogen 3.518 N/A ARG 308.A N ALA 528.A O no hydrogen 2.930 N/A ARG 308.A NH1 ALA 6.A O no hydrogen 2.923 N/A ARG 310.A NH1 THR 269.A OG1 no hydrogen 3.348 N/A ALA 312.A N PRO 268.A O no hydrogen 2.928 N/A ARG 313.A N ASP 311.A OD1 no hydrogen 3.035 N/A ARG 313.A NE ASP 311.A OD1 no hydrogen 2.844 N/A ARG 313.A NH2 ASP 311.A OD2 no hydrogen 3.395 N/A VAL 315.A N SER 55.A O no hydrogen 3.210 N/A ILE 317.A N ARG 313.A O no hydrogen 3.088 N/A ARG 318.A N LEU 314.A O no hydrogen 2.899 N/A ARG 318.A NH1 GLU 60.A OE1 no hydrogen 2.996 N/A ARG 318.A NH1 GLU 60.A OE2 no hydrogen 3.437 N/A ARG 318.A NH1 GLN 286.A OE1 no hydrogen 2.712 N/A ARG 318.A NH2 GLU 60.A OE2 no hydrogen 3.055 N/A ALA 319.A N VAL 315.A O no hydrogen 2.910 N/A LEU 320.A N GLU 316.A O no hydrogen 3.167 N/A ALA 321.A N ILE 317.A O no hydrogen 2.843 N/A GLU 322.A N ARG 318.A O no hydrogen 2.679 N/A GLU 323.A N ALA 319.A O no hydrogen 3.327 N/A ALA 324.A N LEU 320.A O no hydrogen 2.861 N/A ALA 325.A N ALA 321.A O no hydrogen 2.779 N/A VAL 326.A N GLU 322.A O no hydrogen 3.486 N/A LEU 327.A N GLU 323.A O no hydrogen 3.247 N/A GLY 328.A N ALA 324.A O no hydrogen 2.939 N/A GLY 329.A N VAL 326.A O no hydrogen 3.087 N/A GLY 330.A N ALA 325.A O no hydrogen 2.690 N/A LEU 331.A N GLY 328.A O no hydrogen 3.332 N/A LEU 332.A N GLN 289.A O no hydrogen 2.901 N/A THR 333.A N SER 336.A OG no hydrogen 3.091 N/A SER 336.A N THR 333.A OG1 no hydrogen 2.960 N/A SER 336.A OG ALA 324.A O no hydrogen 3.351 N/A SER 336.A OG THR 333.A O no hydrogen 3.108 N/A SER 336.A OG THR 333.A OG1 no hydrogen 3.384 N/A VAL 337.A N THR 333.A O no hydrogen 3.223 N/A GLU 338.A N ALA 334.A O no hydrogen 2.922 N/A GLN 339.A N GLU 335.A O no hydrogen 2.854 N/A ALA 340.A N SER 336.A O no hydrogen 2.803 N/A ILE 341.A N VAL 337.A O no hydrogen 3.070 N/A ALA 342.A N GLU 338.A O no hydrogen 3.015 N/A ALA 343.A N GLN 339.A O no hydrogen 3.007 N/A ARG 344.A N ALA 340.A O no hydrogen 3.066 N/A ARG 344.A NE GLU 323.A OE1 no hydrogen 2.890 N/A ARG 344.A NH2 GLU 323.A OE2 no hydrogen 3.120 N/A GLU 345.A N ILE 341.A O no hydrogen 3.003 N/A HIS 346.A N ALA 342.A O no hydrogen 2.842 N/A ARG 347.A N ALA 343.A O no hydrogen 2.966 N/A ARG 347.A NH2 GLU 323.A OE1 no hydrogen 3.146 N/A SER 348.A N GLU 345.A O no hydrogen 3.069 N/A SER 348.A OG ARG 344.A O no hydrogen 3.338 N/A SER 348.A OG GLU 345.A O no hydrogen 3.507 N/A PHE 349.A N HIS 346.A O no hydrogen 3.261 N/A GLU 353.A N PHE 349.A O no hydrogen 2.753 N/A GLU 354.A N LEU 350.A O no hydrogen 2.965 N/A PHE 355.A N SER 351.A O no hydrogen 3.219 N/A LEU 356.A N GLU 352.A O no hydrogen 2.806 N/A ARG 357.A N GLU 353.A O no hydrogen 2.894 N/A ALA 358.A N GLU 354.A O no hydrogen 2.947 N/A VAL 359.A N PHE 355.A O no hydrogen 3.009 N/A GLN 360.A N LEU 356.A O no hydrogen 2.927 N/A GLN 360.A NE2 ALA 511.A O no hydrogen 3.017 N/A GLU 361.A N ARG 357.A O no hydrogen 2.862 N/A GLY 362.A N VAL 359.A O no hydrogen 3.150 N/A VAL 363.A N ALA 358.A O no hydrogen 2.914 N/A ILE 364.A N ALA 358.A O no hydrogen 3.073 N/A ARG 365.A N GLN 449.A OE1 no hydrogen 2.791 N/A ARG 367.A NE THR 369.A O no hydrogen 3.254 N/A ARG 367.A NH2 THR 369.A O no hydrogen 3.366 N/A ARG 367.A NH2 ARG 371.A O no hydrogen 2.873 N/A ALA 372.A N LEU 476.A O no hydrogen 3.014 N/A GLY 374.A N SER 469.A OG no hydrogen 2.787 N/A VAL 376.A N LEU 394.A O no hydrogen 3.176 N/A ASN 377.A ND2 ARG 367.A O no hydrogen 2.827 N/A ASN 377.A ND2 GLN 478.A O no hydrogen 2.875 N/A SER 378.A N ALA 392.A O no hydrogen 2.893 N/A VAL 380.A N ARG 390.A O no hydrogen 2.702 N/A GLU 383.A N GLU 383.A OE2 no hydrogen 2.904 N/A TYR 387.A N ALA 384.A O no hydrogen 2.595 N/A TRP 388.A NE1 SER 348.A O no hydrogen 2.999 N/A ARG 390.A N VAL 380.A O no hydrogen 2.873 N/A ARG 390.A NE GLU 352.A OE2 no hydrogen 3.197 N/A ALA 392.A N SER 378.A O no hydrogen 2.842 N/A ARG 393.A NE ARG 365.A O no hydrogen 3.261 N/A ARG 393.A NH1 GLU 375.A OE1 no hydrogen 3.517 N/A LEU 394.A N VAL 376.A O no hydrogen 2.925 N/A THR 395.A N ALA 446.A O no hydrogen 2.868 N/A THR 395.A OG1 ALA 446.A O no hydrogen 3.458 N/A THR 395.A OG1 GLU 448.A OE1 no hydrogen 2.709 N/A ALA 396.A N GLY 374.A O no hydrogen 2.889 N/A ARG 397.A N SER 444.A O no hydrogen 3.002 N/A ARG 397.A NH1 VAL 373.A O no hydrogen 3.479 N/A ARG 397.A NH1 ALA 396.A O no hydrogen 3.061 N/A ALA 399.A N THR 442.A O no hydrogen 2.969 N/A ASP 403.A N LEU 439.A O no hydrogen 2.660 N/A HIS 404.A N.A VAL 441.A O no hydrogen 3.289 N/A HIS 404.A N.B VAL 441.A O no hydrogen 3.315 N/A ILE 406.A N ILE 443.A O no hydrogen 2.696 N/A ILE 408.A N LEU 445.A O no hydrogen 2.839 N/A ARG 410.A N SER 407.A O no hydrogen 3.036 N/A ARG 410.A N SER 407.A OG no hydrogen 3.089 N/A GLU 411.A N SER 407.A O no hydrogen 2.974 N/A ALA 412.A N ILE 408.A O no hydrogen 2.832 N/A GLY 413.A N ARG 410.A O no hydrogen 2.855 N/A LEU 414.A N ASP 409.A O no hydrogen 2.737 N/A GLY 415.A N ASP 409.A O no hydrogen 2.981 N/A GLY 416.A N ILE 454.A O no hydrogen 2.799 N/A ILE 418.A N GLU 455.A OE2 no hydrogen 2.818 N/A PHE 419.A N GLU 455.A OE1 no hydrogen 2.671 N/A HIS 420.A N GLY 416.A O no hydrogen 2.834 N/A LYS 421.A N GLN 417.A O no hydrogen 2.639 N/A ALA 422.A N ILE 418.A O no hydrogen 2.801 N/A VAL 423.A N PHE 419.A O no hydrogen 3.128 N/A LEU 424.A N HIS 420.A O no hydrogen 2.850 N/A THR 425.A N LYS 421.A O no hydrogen 2.704 N/A THR 425.A OG1 LYS 421.A O no hydrogen 2.770 N/A LEU 426.A N ALA 422.A O no hydrogen 3.027 N/A ALA 427.A N VAL 423.A O no hydrogen 2.971 N/A GLY 428.A N LEU 424.A O no hydrogen 2.982 N/A TYR 429.A N THR 425.A O no hydrogen 2.898 N/A LEU 430.A N LEU 426.A O no hydrogen 2.878 N/A ARG 431.A N ALA 427.A O no hydrogen 2.710 N/A SER 432.A N GLY 428.A O no hydrogen 3.208 N/A SER 432.A N TYR 429.A O no hydrogen 3.261 N/A SER 432.A OG GLY 428.A O no hydrogen 3.310 N/A SER 432.A OG TYR 429.A O no hydrogen 3.105 N/A ARG 433.A N TYR 429.A O no hydrogen 2.942 N/A HIS 436.A NE2 GLU 579.A OE2 no hydrogen 2.630 N/A GLY 437.A N ILE 434.A O no hydrogen 2.951 N/A THR 442.A N ALA 399.A O no hydrogen 2.690 N/A ILE 443.A N HIS 404.A O.A no hydrogen 2.802 N/A ILE 443.A N HIS 404.A O.B no hydrogen 2.833 N/A SER 444.A N ARG 397.A O no hydrogen 2.854 N/A LEU 445.A N ILE 406.A O no hydrogen 2.979 N/A ALA 446.A N THR 395.A O no hydrogen 2.960 N/A PHE 447.A N ASP 409.A OD2 no hydrogen 3.030 N/A GLU 448.A N ARG 393.A O no hydrogen 2.855 N/A GLN 449.A NE2 VAL 363.A O no hydrogen 3.010 N/A ASN 450.A N PHE 447.A O no hydrogen 3.229 N/A ASN 450.A ND2 ASP 409.A OD1 no hydrogen 2.767 N/A ASN 450.A ND2 VAL 452.A O no hydrogen 2.952 N/A VAL 452.A N ASN 450.A OD1 no hydrogen 3.170 N/A SER 453.A OG GLU 383.A OE1 no hydrogen 3.322 N/A ILE 454.A N LEU 414.A O no hydrogen 2.987 N/A GLY 456.A N GLU 455.A OE1 no hydrogen 3.005 N/A GLY 460.A N ASP 457.A O no hydrogen 2.973 N/A LEU 461.A N GLY 484.A O no hydrogen 3.051 N/A GLU 463.A N ALA 459.A O no hydrogen 2.837 N/A LEU 464.A N GLY 460.A O no hydrogen 2.869 N/A VAL 465.A N LEU 461.A O no hydrogen 2.893 N/A ALA 466.A N ALA 462.A O no hydrogen 2.994 N/A ALA 467.A N GLU 463.A O no hydrogen 2.974 N/A LEU 468.A N LEU 464.A O no hydrogen 2.957 N/A SER 469.A N VAL 465.A O no hydrogen 2.828 N/A SER 469.A OG LEU 474.A O no hydrogen 2.656 N/A ALA 470.A N ALA 466.A O no hydrogen 2.955 N/A ILE 471.A N ALA 467.A O no hydrogen 3.079 N/A GLY 472.A N LEU 468.A O no hydrogen 2.891 N/A LEU 474.A N SER 469.A O no hydrogen 2.930 N/A LEU 476.A N ALA 372.A O no hydrogen 2.797 N/A ARG 477.A N LEU 560.A O no hydrogen 2.930 N/A ARG 477.A NE ASP 479.A OD1 no hydrogen 2.930 N/A ARG 477.A NH2 ASP 479.A OD1 no hydrogen 3.489 N/A ARG 477.A NH2 ASP 479.A OD2 no hydrogen 3.031 N/A GLN 478.A N GLY 370.A O no hydrogen 2.878 N/A GLN 478.A NE2 ALA 372.A O no hydrogen 3.634 N/A GLN 478.A NE2 GLU 375.A O no hydrogen 2.949 N/A GLN 478.A NE2 LEU 476.A O no hydrogen 2.922 N/A ALA 481.A N GLY 519.A O no hydrogen 3.114 N/A VAL 482.A N ASN 377.A O no hydrogen 2.924 N/A THR 483.A N ILE 521.A O no hydrogen 3.026 N/A GLY 484.A N SER 458.A O no hydrogen 3.393 N/A ALA 485.A N LEU 493.A O no hydrogen 3.073 N/A ASP 487.A N LYS 491.A O no hydrogen 3.022 N/A THR 489.A N ASP 487.A OD1 no hydrogen 2.688 N/A THR 489.A OG1 ASP 487.A OD1 no hydrogen 2.495 N/A THR 489.A OG1 ASP 487.A OD2 no hydrogen 3.339 N/A GLY 490.A N ASP 487.A O no hydrogen 2.862 N/A LYS 491.A N ASP 487.A OD1 no hydrogen 3.090 N/A VAL 492.A N GLU 551.A O no hydrogen 2.998 N/A LEU 493.A N ALA 485.A O no hydrogen 2.794 N/A VAL 495.A N ASN 526.A OD1 no hydrogen 2.954 N/A ASN 499.A ND2 THR 531.A OG1 no hydrogen 2.625 N/A LYS 501.A N ALA 497.A O no hydrogen 3.008 N/A LYS 501.A NZ GLY 496.A O no hydrogen 3.138 N/A VAL 502.A N ILE 498.A O no hydrogen 3.096 N/A GLU 503.A N ASN 499.A O no hydrogen 2.998 N/A GLY 504.A N ALA 500.A O no hydrogen 2.758 N/A PHE 505.A N LYS 501.A O no hydrogen 3.044 N/A PHE 506.A N VAL 502.A O no hydrogen 3.031 N/A ARG 507.A N GLU 503.A O no hydrogen 3.066 N/A VAL 508.A N GLY 504.A O no hydrogen 3.411 N/A CYS 509.A N PHE 505.A O no hydrogen 2.871 N/A CYS 509.A SG PHE 505.A O no hydrogen 3.464 N/A LYS 510.A N PHE 506.A O no hydrogen 2.698 N/A LYS 510.A NZ GLU 535.A OE1 no hydrogen 3.377 N/A LYS 510.A NZ GLU 535.A OE2 no hydrogen 3.300 N/A ALA 511.A N ARG 507.A O no hydrogen 2.816 N/A LEU 512.A N VAL 508.A O no hydrogen 2.958 N/A GLY 513.A N LYS 510.A O no hydrogen 3.065 N/A SER 515.A N GLN 518.A OE1 no hydrogen 2.948 N/A SER 515.A OG THR 517.A OG1 no hydrogen 3.251 N/A THR 517.A N SER 515.A OG no hydrogen 3.230 N/A THR 517.A OG1 ASP 479.A OD2 no hydrogen 2.715 N/A THR 517.A OG1 SER 515.A OG no hydrogen 3.251 N/A GLN 518.A NE2 THR 368.A O no hydrogen 2.956 N/A GLY 519.A N ASP 479.A O no hydrogen 3.029 N/A VAL 520.A N HIS 546.A O no hydrogen 2.905 N/A ILE 521.A N ALA 481.A O no hydrogen 2.780 N/A LEU 522.A N TYR 548.A O no hydrogen 2.853 N/A GLU 524.A N VAL 550.A O no hydrogen 2.658 N/A ASN 526.A N PRO 523.A O no hydrogen 2.702 N/A ASN 526.A ND2 VAL 495.A O no hydrogen 2.839 N/A ASN 526.A ND2 ASN 529.A OD1 no hydrogen 3.115 N/A LEU 527.A N GLU 524.A O no hydrogen 3.225 N/A ASN 529.A N ASN 526.A O no hydrogen 2.510 N/A ASN 529.A ND2 GLU 306.A O no hydrogen 2.814 N/A LEU 530.A N LEU 527.A O no hydrogen 3.091 N/A THR 531.A N ASN 499.A OD1 no hydrogen 2.899 N/A ARG 533.A N GLU 503.A OE2 no hydrogen 2.846 N/A ARG 533.A NH1 GLU 345.A OE2 no hydrogen 2.694 N/A ARG 533.A NH2 GLU 345.A OE1 no hydrogen 2.817 N/A ARG 533.A NH2 GLU 345.A OE2 no hydrogen 3.271 N/A LEU 537.A N ARG 533.A O no hydrogen 3.104 N/A GLU 538.A N ALA 534.A O no hydrogen 2.949 N/A ALA 539.A N GLU 535.A O no hydrogen 3.121 N/A VAL 540.A N VAL 536.A O no hydrogen 2.881 N/A ARG 541.A N LEU 537.A O no hydrogen 2.642 N/A ALA 542.A N GLU 538.A O no hydrogen 2.806 N/A GLY 543.A N VAL 540.A O no hydrogen 2.945 N/A GLN 544.A N ALA 539.A O no hydrogen 2.824 N/A HIS 546.A NE2 GLY 516.A O no hydrogen 2.805 N/A TYR 548.A N VAL 520.A O no hydrogen 2.890 N/A VAL 550.A N LEU 522.A O no hydrogen 2.926 N/A GLU 551.A N GLN 555.A OE1 no hydrogen 2.647 N/A THR 552.A N GLN 555.A OE1 no hydrogen 3.032 N/A ALA 553.A N GLY 490.A O no hydrogen 2.795 N/A GLN 555.A N THR 552.A OG1 no hydrogen 3.193 N/A ALA 556.A N THR 552.A O no hydrogen 3.347 N/A LEU 557.A N ALA 553.A O no hydrogen 2.967 N/A GLU 558.A N GLU 554.A O no hydrogen 2.927 N/A ILE 559.A N GLN 555.A O no hydrogen 3.209 N/A LEU 560.A N ALA 556.A O no hydrogen 2.898 N/A ALA 561.A N LEU 557.A O no hydrogen 2.846 N/A GLY 562.A N ILE 559.A O no hydrogen 3.374 N/A ALA 563.A N GLU 558.A O no hydrogen 3.201 N/A ARG 564.A NE GLU 558.A OE2 no hydrogen 2.815 N/A LEU 570.A N ARG 564.A O no hydrogen 2.900 N/A LYS 573.A N GLY 569.A O no hydrogen 3.324 N/A ILE 574.A N LEU 570.A O no hydrogen 2.998 N/A ARG 575.A N GLN 571.A O no hydrogen 2.936 N/A ALA 576.A N GLU 572.A O no hydrogen 2.842 N/A GLY 577.A N LYS 573.A O no hydrogen 2.914 N/A LEU 578.A N ILE 574.A O no hydrogen 2.873 N/A GLU 579.A N ARG 575.A O no hydrogen 2.905 N/A ALA 580.A N ALA 576.A O no hydrogen 2.988 N/A PHE 581.A N GLY 577.A O no hydrogen 3.014 N/A ALA 582.A N LEU 578.A O no hydrogen 2.764 N/A ARG 583.A N GLU 579.A O no hydrogen 2.945 N/A LEU 584.A N ALA 580.A O no hydrogen 2.957 N/A GLU 585.A N PHE 581.A O no hydrogen 2.898 N/A