Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ncb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ALA 304.A O no hydrogen 2.921 N/A VAL 5.A N ALA 302.A O no hydrogen 2.918 N/A PHE 6.A N TYR 573.A O no hydrogen 2.803 N/A LEU 7.A N VAL 300.A O no hydrogen 3.056 N/A ASN 8.A ND2 VAL 163.A O no hydrogen 3.075 N/A PHE 10.A N LEU 161.A O no hydrogen 2.872 N/A ALA 11.A N GLU 298.A O no hydrogen 2.647 N/A LEU 12.A N PHE 159.A O no hydrogen 2.875 N/A ARG 13.A N LEU 294.A O no hydrogen 2.978 N/A ARG 13.A NE GLY 293.A O no hydrogen 3.160 N/A ARG 13.A NH1 PRO 14.A O no hydrogen 2.955 N/A ARG 13.A NH1 GLU 19.A OE2 no hydrogen 3.068 N/A ARG 13.A NH2 GLU 19.A OE1 no hydrogen 2.869 N/A LEU 15.A N GLY 157.A O no hydrogen 3.037 N/A ASN 16.A N GLU 19.A OE2 no hydrogen 2.875 N/A GLU 18.A N ASN 16.A OD1 no hydrogen 2.954 N/A GLU 19.A N ASN 16.A O no hydrogen 3.044 N/A GLU 19.A N ASN 16.A OD1 no hydrogen 3.003 N/A LEU 20.A N ASN 16.A O no hydrogen 3.317 N/A ARG 21.A N GLU 18.A O no hydrogen 3.226 N/A TRP 23.A N SER 62.A O no hydrogen 2.933 N/A ARG 24.A N GLY 90.A O no hydrogen 2.879 N/A LEU 25.A N LEU 60.A O no hydrogen 2.924 N/A GLU 26.A N TYR 87.A O no hydrogen 2.853 N/A VAL 28.A N ARG 85.A O no hydrogen 2.920 N/A ASP 30.A N ALA 83.A O no hydrogen 2.855 N/A GLU 37.A N GLY 34.A O no hydrogen 3.238 N/A VAL 38.A N GLY 34.A O no hydrogen 2.967 N/A LEU 41.A N GLU 37.A O no hydrogen 3.005 N/A LEU 42.A N VAL 38.A O no hydrogen 2.995 N/A ALA 43.A N TYR 39.A O no hydrogen 3.205 N/A GLN 44.A N PRO 40.A O no hydrogen 3.068 N/A GLN 44.A NE2 ALA 76.A O no hydrogen 3.047 N/A VAL 45.A N LEU 41.A O no hydrogen 2.939 N/A ALA 46.A N LEU 42.A O no hydrogen 3.035 N/A ARG 47.A N ALA 43.A O no hydrogen 3.278 N/A ARG 48.A N GLN 44.A O no hydrogen 2.897 N/A ARG 48.A NH2 THR 74.A O no hydrogen 3.148 N/A ALA 49.A N VAL 45.A O no hydrogen 2.880 N/A GLY 50.A N ARG 47.A O no hydrogen 3.132 N/A VAL 52.A N SER 64.A OG no hydrogen 3.387 N/A VAL 54.A N ALA 61.A O no hydrogen 2.880 N/A ARG 55.A NH1 GLY 57.A O no hydrogen 2.980 N/A MET 56.A N GLY 59.A O no hydrogen 2.888 N/A GLY 59.A N MET 56.A O no hydrogen 2.918 N/A LEU 60.A N LEU 25.A O no hydrogen 2.855 N/A ALA 61.A N VAL 54.A O no hydrogen 2.882 N/A SER 62.A N TRP 23.A O no hydrogen 2.846 N/A SER 62.A OG VAL 52.A O no hydrogen 3.495 N/A SER 62.A OG SER 64.A O no hydrogen 2.910 N/A TRP 63.A N VAL 52.A O no hydrogen 2.861 N/A TRP 63.A NE1 GLU 19.A O no hydrogen 2.669 N/A SER 64.A N SER 62.A OG no hydrogen 2.876 N/A VAL 68.A N PRO 65.A O no hydrogen 3.087 N/A LEU 69.A N PRO 66.A O no hydrogen 2.907 N/A VAL 70.A N ALA 49.A O no hydrogen 2.867 N/A GLY 73.A N TYR 84.A O no hydrogen 2.996 N/A ARG 77.A N GLN 80.A O no hydrogen 3.103 N/A TYR 82.A N LEU 75.A O no hydrogen 2.898 N/A ALA 83.A N ASP 30.A O no hydrogen 2.888 N/A TYR 84.A N GLY 73.A O no hydrogen 2.902 N/A TYR 84.A OH VAL 70.A O no hydrogen 2.872 N/A ARG 85.A N VAL 28.A O no hydrogen 2.925 N/A LEU 86.A N LEU 71.A O no hydrogen 2.699 N/A TYR 87.A N GLU 26.A O no hydrogen 2.875 N/A LYS 89.A N ARG 24.A O no hydrogen 2.852 N/A LYS 89.A NZ GLU 26.A OE2 no hydrogen 3.053 N/A ARG 91.A NE ARG 21.A O no hydrogen 2.986 N/A ARG 91.A NH1 GLU 18.A OE1 no hydrogen 3.197 N/A ARG 91.A NH1 ARG 21.A O no hydrogen 2.864 N/A ARG 91.A NH2 GLU 18.A OE1 no hydrogen 2.964 N/A ARG 91.A NH2 GLU 18.A OE2 no hydrogen 3.504 N/A ARG 92.A N PRO 22.A O no hydrogen 3.018 N/A ARG 92.A NE PRO 93.A O no hydrogen 3.468 N/A ARG 92.A NH2 PRO 93.A O no hydrogen 3.543 N/A LEU 94.A N LEU 20.A O no hydrogen 2.761 N/A ASP 95.A N GLU 101.A OE1 no hydrogen 2.545 N/A LYS 97.A N ASP 95.A OD1 no hydrogen 2.823 N/A ASP 98.A N ASP 95.A O no hydrogen 3.137 N/A GLU 101.A N ASP 98.A OD2 no hydrogen 2.964 N/A ARG 102.A N ASP 98.A O no hydrogen 2.816 N/A SER 103.A N PRO 99.A O no hydrogen 2.906 N/A VAL 104.A N GLY 100.A O no hydrogen 3.013 N/A LEU 105.A N GLU 101.A O no hydrogen 2.995 N/A SER 106.A N ARG 102.A O no hydrogen 2.873 N/A SER 106.A OG ARG 102.A O no hydrogen 3.354 N/A ALA 107.A N SER 103.A O no hydrogen 2.989 N/A LEU 108.A N VAL 104.A O no hydrogen 2.967 N/A ALA 109.A N LEU 105.A O no hydrogen 2.894 N/A ARG 110.A N SER 106.A O no hydrogen 2.931 N/A ARG 110.A NE ASP 150.A OD1 no hydrogen 3.022 N/A ARG 110.A NH2 ASP 150.A OD1 no hydrogen 3.453 N/A ARG 110.A NH2 ASP 150.A OD2 no hydrogen 2.816 N/A ARG 111.A N ALA 107.A O no hydrogen 3.038 N/A LEU 112.A N LEU 108.A O no hydrogen 2.878 N/A LEU 113.A N ALA 109.A O no hydrogen 2.913 N/A GLN 114.A N ARG 110.A O no hydrogen 3.023 N/A GLU 115.A N ARG 111.A O no hydrogen 2.980 N/A ARG 116.A N LEU 112.A O no hydrogen 2.897 N/A ARG 116.A NH1 LEU 292.A O no hydrogen 2.803 N/A LEU 117.A N LEU 113.A O no hydrogen 2.920 N/A ARG 118.A N GLN 114.A O no hydrogen 3.058 N/A ARG 118.A NH1 GLU 115.A OE1 no hydrogen 3.564 N/A ARG 119.A N ARG 116.A O no hydrogen 3.112 N/A LEU 120.A N LEU 117.A O no hydrogen 3.010 N/A TRP 124.A N TYR 131.A O no hydrogen 2.942 N/A TRP 124.A NE1 GLU 126.A OE2 no hydrogen 2.426 N/A GLU 126.A N ALA 129.A O no hydrogen 2.788 N/A ALA 129.A N GLU 126.A O no hydrogen 3.159 N/A VAL 130.A N ALA 147.A O no hydrogen 2.913 N/A TYR 131.A N TRP 124.A O no hydrogen 2.871 N/A ARG 132.A N GLY 145.A O no hydrogen 2.878 N/A ARG 133.A N GLY 145.A O no hydrogen 3.256 N/A HIS 135.A N VAL 143.A O no hydrogen 2.697 N/A ALA 136.A N VAL 143.A O no hydrogen 3.323 N/A GLY 138.A N TRP 141.A O no hydrogen 2.934 N/A TRP 141.A N GLY 138.A O no hydrogen 2.950 N/A ARG 142.A N LEU 170.A O no hydrogen 2.973 N/A ARG 142.A NH1 GLU 134.A OE2 no hydrogen 3.460 N/A VAL 143.A N ALA 136.A O no hydrogen 2.975 N/A LEU 144.A N ARG 168.A O no hydrogen 2.863 N/A GLY 145.A N ARG 133.A O no hydrogen 2.759 N/A GLY 146.A N ALA 166.A O no hydrogen 2.882 N/A ALA 147.A N VAL 130.A O no hydrogen 2.866 N/A VAL 148.A N ASP 164.A O no hydrogen 2.856 N/A LEU 149.A N LEU 128.A O no hydrogen 2.924 N/A ASP 150.A N GLU 162.A O no hydrogen 2.947 N/A LEU 151.A N ASP 150.A OD1 no hydrogen 2.790 N/A TRP 152.A N LEU 160.A O no hydrogen 2.955 N/A VAL 153.A N SER 106.A OG no hydrogen 2.898 N/A SER 154.A N ALA 158.A O no hydrogen 2.893 N/A SER 154.A OG SER 156.A OG no hydrogen 3.086 N/A SER 154.A OG ALA 158.A O no hydrogen 3.122 N/A SER 156.A OG SER 154.A OG no hydrogen 3.086 N/A GLY 157.A N SER 154.A O no hydrogen 2.946 N/A ALA 158.A N SER 154.A OG no hydrogen 3.051 N/A PHE 159.A N ARG 13.A O no hydrogen 3.059 N/A LEU 160.A N TRP 152.A O no hydrogen 2.854 N/A LEU 161.A N PHE 10.A O no hydrogen 2.900 N/A GLU 162.A N ASP 150.A O no hydrogen 2.898 N/A VAL 163.A N ASN 8.A O no hydrogen 3.188 N/A ASP 164.A N VAL 148.A O no hydrogen 2.927 N/A ALA 166.A N GLY 146.A O no hydrogen 2.879 N/A ARG 168.A N LEU 144.A O no hydrogen 2.928 N/A ARG 168.A NH1 GLU 126.A OE2 no hydrogen 3.002 N/A LEU 170.A N ARG 142.A O no hydrogen 2.885 N/A CYS 171.A SG GLY 140.A O no hydrogen 3.652 N/A CYS 171.A SG MET 173.A O no hydrogen 3.813 N/A LEU 175.A N LEU 257.A O no hydrogen 2.712 N/A ALA 177.A N SER 174.A OG no hydrogen 3.140 N/A TRP 178.A N SER 174.A O no hydrogen 3.012 N/A LEU 179.A N LEU 175.A O no hydrogen 2.913 N/A ALA 180.A N GLU 176.A O no hydrogen 2.922 N/A GLN 181.A N TRP 178.A O no hydrogen 3.173 N/A GLY 182.A N LEU 179.A O no hydrogen 2.934 N/A VAL 189.A N TRP 198.A O no hydrogen 2.929 N/A ARG 190.A N VAL 258.A O no hydrogen 2.836 N/A ARG 190.A NE ARG 195.A O no hydrogen 3.377 N/A ASN 191.A N ARG 196.A O no hydrogen 2.998 N/A ASN 191.A ND2 ASP 194.A OD1 no hydrogen 2.951 N/A ALA 192.A N LEU 256.A O no hydrogen 2.761 N/A TYR 193.A OH HIS 252.A NE2 no hydrogen 3.110 N/A ARG 196.A N ASP 194.A OD1 no hydrogen 2.851 N/A ARG 196.A NH1 ASP 194.A OD2 no hydrogen 2.956 N/A TRP 198.A N VAL 189.A O no hydrogen 2.852 N/A TRP 198.A NE1 ASN 191.A OD1 no hydrogen 2.902 N/A LEU 200.A N LYS 187.A O no hydrogen 2.831 N/A LEU 201.A N TRP 239.A O no hydrogen 2.895 N/A ARG 202.A N TRP 239.A O no hydrogen 3.346 N/A LYS 209.A N ASP 207.A OD1 no hydrogen 2.923 N/A GLU 210.A N ASP 207.A O no hydrogen 3.057 N/A LEU 213.A N LEU 217.A O no hydrogen 2.983 N/A GLY 216.A N LEU 213.A O no hydrogen 3.376 N/A SER 218.A OG LYS 209.A O no hydrogen 3.419 N/A SER 218.A OG ASP 221.A OD1 no hydrogen 2.671 N/A LEU 219.A N LEU 211.A O no hydrogen 3.008 N/A LEU 220.A N PRO 208.A O no hydrogen 2.964 N/A TYR 222.A N SER 218.A O no hydrogen 2.920 N/A HIS 223.A N LEU 219.A O no hydrogen 3.001 N/A ALA 224.A N LEU 220.A O no hydrogen 2.861 N/A SER 225.A N ASP 221.A O no hydrogen 2.886 N/A LYS 226.A N HIS 223.A O no hydrogen 3.193 N/A GLY 227.A N ALA 224.A O no hydrogen 2.690 N/A ARG 228.A N HIS 223.A O no hydrogen 3.244 N/A ARG 228.A NH1 HIS 223.A ND1 no hydrogen 2.967 N/A ARG 232.A N LEU 229.A O no hydrogen 3.142 N/A ARG 236.A N THR 254.A OG1 no hydrogen 2.952 N/A ARG 236.A NE GLU 176.A OE1 no hydrogen 2.890 N/A ARG 236.A NH2 GLU 176.A OE1 no hydrogen 2.929 N/A ARG 236.A NH2 GLU 176.A OE2 no hydrogen 3.272 N/A ALA 238.A N HIS 252.A O no hydrogen 2.828 N/A TRP 239.A N ARG 202.A O no hydrogen 2.840 N/A VAL 240.A N ILE 250.A O no hydrogen 2.785 N/A ALA 241.A N GLU 199.A O no hydrogen 2.900 N/A LYS 244.A N ASP 242.A OD1 no hydrogen 3.113 N/A ASP 245.A N ASP 242.A O no hydrogen 3.170 N/A LYS 248.A N ASP 245.A O no hydrogen 3.433 N/A ILE 250.A N VAL 240.A O no hydrogen 2.683 N/A HIS 252.A N ALA 238.A O no hydrogen 2.840 N/A HIS 252.A NE2 ASN 191.A OD1 no hydrogen 2.771 N/A LEU 253.A N HIS 252.A ND1 no hydrogen 2.792 N/A THR 254.A N ARG 236.A O no hydrogen 2.853 N/A THR 254.A OG1 GLU 176.A OE1 no hydrogen 2.655 N/A THR 254.A OG1 ARG 236.A O no hydrogen 3.102 N/A GLY 255.A N GLY 234.A O no hydrogen 3.024 N/A LEU 256.A N LEU 253.A O no hydrogen 2.882 N/A LEU 257.A N THR 254.A O no hydrogen 3.388 N/A VAL 258.A N ARG 190.A O no hydrogen 2.853 N/A VAL 260.A N ARG 188.A O no hydrogen 3.276 N/A THR 262.A N ASP 265.A OD2 no hydrogen 3.491 N/A GLU 264.A N THR 262.A OG1 no hydrogen 3.179 N/A ASP 265.A N THR 262.A O no hydrogen 3.152 N/A LEU 266.A N LEU 263.A O no hydrogen 3.403 N/A GLU 275.A N GLU 275.A OE1 no hydrogen 2.808 N/A ARG 277.A N PRO 273.A O no hydrogen 3.042 N/A ARG 277.A NE THR 604.A OG1 no hydrogen 3.176 N/A ARG 277.A NH1 ASP 164.A OD1 no hydrogen 3.205 N/A ARG 277.A NH1 PRO 165.A O no hydrogen 2.740 N/A ARG 278.A N TRP 274.A O no hydrogen 2.903 N/A ARG 278.A NH2 PRO 574.A O no hydrogen 2.716 N/A ARG 279.A N GLU 275.A O no hydrogen 2.965 N/A ARG 279.A NH1 GLU 283.A OE1 no hydrogen 3.501 N/A ARG 279.A NH1 GLU 283.A OE2 no hydrogen 2.875 N/A ARG 280.A N GLU 276.A O no hydrogen 2.933 N/A ARG 280.A NE GLU 283.A OE1 no hydrogen 3.435 N/A ARG 280.A NH2 GLU 283.A OE1 no hydrogen 3.405 N/A THR 281.A N ARG 277.A O no hydrogen 2.868 N/A THR 281.A OG1 ARG 277.A O no hydrogen 2.702 N/A ARG 282.A N ARG 278.A O no hydrogen 2.958 N/A GLU 283.A N ARG 279.A O no hydrogen 2.989 N/A ILE 284.A N ARG 280.A O no hydrogen 2.902 N/A ALA 285.A N THR 281.A O no hydrogen 2.925 N/A SER 286.A N ARG 282.A O no hydrogen 3.003 N/A SER 286.A OG GLU 283.A O no hydrogen 3.042 N/A TRP 287.A N GLU 283.A O no hydrogen 2.965 N/A ILE 288.A N ILE 284.A O no hydrogen 2.889 N/A GLY 289.A N ALA 285.A O no hydrogen 2.899 N/A ARG 290.A N SER 286.A O no hydrogen 2.959 N/A ARG 291.A N TRP 287.A O no hydrogen 2.942 N/A LEU 292.A N ILE 288.A O no hydrogen 2.955 N/A LEU 294.A N GLY 289.A O no hydrogen 2.890 N/A GLY 295.A N GLY 289.A O no hydrogen 3.263 N/A GLU 298.A N ALA 11.A O no hydrogen 2.957 N/A VAL 300.A N ARG 9.A O no hydrogen 3.150 N/A ARG 301.A NH1 GLU 4.A OE1 no hydrogen 3.180 N/A ALA 302.A N VAL 5.A O no hydrogen 2.888 N/A ALA 304.A N THR 3.A O no hydrogen 2.905 N/A TYR 305.A N TYR 584.A O no hydrogen 2.864 N/A ARG 306.A N GLY 1.A O no hydrogen 3.130 N/A LEU 307.A N GLY 582.A O no hydrogen 3.086 N/A SER 308.A OG HIS 624.A NE2 no hydrogen 3.260 N/A MET 313.A N ALA 455.A O no hydrogen 2.870 N/A GLY 314.A N ARG 316.A O no hydrogen 2.775 N/A ARG 315.A N GLY 328.A O no hydrogen 2.906 N/A ARG 315.A NE ALA 362.A O no hydrogen 3.216 N/A ARG 315.A NH1 ALA 362.A O no hydrogen 3.082 N/A VAL 318.A N LEU 312.A O no hydrogen 2.967 N/A SER 319.A N ASP 323.A OD2 no hydrogen 3.173 N/A SER 319.A OG ASP 323.A OD2 no hydrogen 3.056 N/A LYS 320.A N ASP 323.A OD2 no hydrogen 3.008 N/A LYS 320.A NZ ASP 323.A OD1 no hydrogen 3.322 N/A ALA 322.A N GLY 637.A O no hydrogen 3.246 N/A ASP 323.A N LYS 320.A O no hydrogen 3.013 N/A ALA 324.A N PRO 321.A O no hydrogen 3.057 N/A LEU 325.A N ALA 322.A O no hydrogen 3.207 N/A ARG 326.A N ASP 323.A O no hydrogen 2.976 N/A VAL 327.A N ASP 323.A O no hydrogen 2.922 N/A GLY 328.A N ALA 324.A O no hydrogen 2.799 N/A PHE 329.A N SER 363.A OG no hydrogen 2.705 N/A TYR 330.A N VAL 453.A O no hydrogen 2.922 N/A TYR 330.A OH ASP 488.A OD2 no hydrogen 2.742 N/A ARG 331.A N GLN 452.A O no hydrogen 3.204 N/A ARG 331.A NH1 GLY 490.A O no hydrogen 2.738 N/A ARG 331.A NH2 GLY 490.A O no hydrogen 3.136 N/A THR 335.A N SER 366.A O no hydrogen 3.183 N/A ALA 336.A N GLN 395.A OE1 no hydrogen 3.434 N/A LEU 337.A N ARG 368.A O no hydrogen 2.915 N/A ALA 338.A N ALA 396.A O no hydrogen 2.965 N/A LEU 339.A N HIS 370.A O no hydrogen 2.893 N/A LEU 340.A N LEU 398.A O no hydrogen 2.825 N/A ARG 341.A NE GLN 346.A O no hydrogen 2.921 N/A ARG 341.A NE GLY 347.A O no hydrogen 3.164 N/A ARG 341.A NH1 GLY 347.A O no hydrogen 3.043 N/A ARG 341.A NH2 ASP 343.A OD2 no hydrogen 2.683 N/A LEU 342.A N LEU 400.A O no hydrogen 3.022 N/A ALA 345.A N ASP 343.A OD1 no hydrogen 3.312 N/A TRP 348.A NE1 HIS 370.A O no hydrogen 3.183 N/A ARG 353.A N PRO 349.A O no hydrogen 3.271 N/A ARG 354.A N GLU 350.A O no hydrogen 2.899 N/A ALA 355.A N PHE 351.A O no hydrogen 2.926 N/A LEU 356.A N LEU 352.A O no hydrogen 2.951 N/A LEU 357.A N ARG 353.A O no hydrogen 2.927 N/A ARG 358.A N ARG 354.A O no hydrogen 2.892 N/A ALA 359.A N ALA 355.A O no hydrogen 2.959 N/A PHE 360.A N LEU 356.A O no hydrogen 2.957 N/A GLY 361.A N LEU 357.A O no hydrogen 2.839 N/A ALA 362.A N ARG 358.A O no hydrogen 2.938 N/A SER 363.A N ALA 359.A O no hydrogen 2.982 N/A SER 363.A OG ALA 359.A O no hydrogen 3.068 N/A GLY 364.A N GLY 361.A O no hydrogen 3.218 N/A ALA 365.A N PHE 360.A O no hydrogen 3.090 N/A ARG 368.A N THR 335.A O no hydrogen 2.916 N/A ARG 368.A NH2 HIS 370.A NE2 no hydrogen 3.109 N/A HIS 370.A N LEU 337.A O no hydrogen 2.848 N/A LEU 372.A N LEU 339.A O no hydrogen 2.874 N/A SER 377.A N HIS 375.A ND1 no hydrogen 3.025 N/A SER 377.A OG HIS 375.A ND1 no hydrogen 2.964 N/A SER 377.A OG GLN 378.A OE1 no hydrogen 2.898 N/A GLN 378.A N HIS 375.A O no hydrogen 3.183 N/A GLY 379.A N PRO 376.A O no hydrogen 3.330 N/A ARG 383.A NH2 GLU 419.A OE2 no hydrogen 2.372 N/A GLU 384.A N LEU 380.A O no hydrogen 2.969 N/A ALA 385.A N ALA 381.A O no hydrogen 2.957 N/A LEU 386.A N PHE 382.A O no hydrogen 2.917 N/A ARG 387.A N ARG 383.A O no hydrogen 2.905 N/A ARG 387.A NH1 GLU 391.A OE2 no hydrogen 3.152 N/A LYS 388.A N GLU 384.A O no hydrogen 2.956 N/A ALA 389.A N ALA 385.A O no hydrogen 2.917 N/A LYS 390.A N LEU 386.A O no hydrogen 2.916 N/A GLU 391.A N ARG 387.A O no hydrogen 2.899 N/A GLU 392.A N LYS 388.A O no hydrogen 2.919 N/A GLY 393.A N LYS 390.A O no hydrogen 2.917 N/A VAL 394.A N ALA 389.A O no hydrogen 3.162 N/A GLN 395.A N ALA 336.A O no hydrogen 2.774 N/A VAL 397.A N PRO 422.A O no hydrogen 2.950 N/A LEU 398.A N ALA 338.A O no hydrogen 2.851 N/A VAL 399.A N GLN 424.A O no hydrogen 2.859 N/A LEU 400.A N LEU 340.A O no hydrogen 2.909 N/A THR 401.A N LEU 426.A O no hydrogen 2.994 N/A THR 401.A OG1 PRO 402.A O no hydrogen 2.988 N/A ARG 409.A N ALA 405.A O no hydrogen 2.933 N/A ARG 409.A NH1 ASN 410.A OD1 no hydrogen 3.090 N/A ARG 409.A NH1 GLU 656.A OE1 no hydrogen 3.031 N/A ARG 409.A NH1 GLU 656.A OE2 no hydrogen 3.245 N/A ARG 409.A NH2 GLU 656.A OE2 no hydrogen 2.894 N/A ASN 410.A N TRP 406.A O no hydrogen 2.916 N/A ARG 411.A N GLU 407.A O no hydrogen 2.965 N/A ARG 411.A NH1 ASP 408.A OD1 no hydrogen 2.847 N/A ARG 411.A NH2 ASP 408.A OD1 no hydrogen 3.153 N/A LEU 412.A N ASP 408.A O no hydrogen 2.944 N/A LYS 413.A N ARG 409.A O no hydrogen 2.924 N/A LYS 413.A NZ SER 423.A O no hydrogen 2.691 N/A ALA 414.A N ASN 410.A O no hydrogen 2.917 N/A LEU 415.A N ARG 411.A O no hydrogen 2.923 N/A LEU 416.A N LEU 412.A O no hydrogen 2.990 N/A LEU 417.A N LYS 413.A O no hydrogen 2.889 N/A ARG 418.A N ALA 414.A O no hydrogen 2.940 N/A ARG 418.A NH1 HIS 664.A ND1 no hydrogen 3.206 N/A GLU 419.A N LEU 416.A O no hydrogen 3.070 N/A GLY 420.A N LEU 417.A O no hydrogen 2.615 N/A LEU 421.A N LEU 416.A O no hydrogen 3.000 N/A GLN 424.A N VAL 397.A O no hydrogen 2.882 N/A GLN 424.A NE2 ILE 425.A O no hydrogen 2.913 N/A LEU 426.A N VAL 399.A O no hydrogen 2.894 N/A ARG 431.A N GLU 434.A OE2 no hydrogen 2.546 N/A GLU 434.A N ARG 431.A O no hydrogen 2.814 N/A ARG 437.A NH2 PRO 429.A O no hydrogen 2.686 N/A TRP 438.A N GLU 434.A O no hydrogen 3.472 N/A TRP 438.A NE1 GLU 432.A O no hydrogen 2.843 N/A GLU 439.A N ARG 435.A O no hydrogen 2.903 N/A ASN 440.A N HIS 436.A O no hydrogen 2.951 N/A ALA 441.A N ARG 437.A O no hydrogen 2.959 N/A LEU 442.A N TRP 438.A O no hydrogen 2.905 N/A LEU 443.A N GLU 439.A O no hydrogen 2.906 N/A GLY 444.A N ASN 440.A O no hydrogen 2.930 N/A LEU 445.A N ALA 441.A O no hydrogen 2.866 N/A LEU 446.A N LEU 442.A O no hydrogen 2.907 N/A ALA 447.A N LEU 443.A O no hydrogen 2.950 N/A LYS 448.A N GLY 444.A O no hydrogen 2.907 N/A LYS 448.A NZ SER 423.A O no hydrogen 2.877 N/A LYS 448.A NZ GLN 424.A OE1 no hydrogen 2.755 N/A LYS 448.A NZ VAL 676.A O no hydrogen 3.123 N/A ALA 449.A N LEU 446.A O no hydrogen 3.093 N/A GLY 450.A N ALA 447.A O no hydrogen 3.147 N/A LEU 451.A N LEU 446.A O no hydrogen 3.154 N/A GLN 452.A NE2 VAL 454.A O no hydrogen 2.942 N/A ALA 455.A N MET 313.A O no hydrogen 2.954 N/A LEU 456.A N ASP 488.A O no hydrogen 2.833 N/A SER 457.A OG LYS 311.A O no hydrogen 3.313 N/A TYR 460.A OH HIS 628.A ND1 no hydrogen 2.568 N/A ALA 462.A N GLN 625.A OE1 no hydrogen 3.374 N/A GLU 463.A N ARG 531.A O no hydrogen 3.316 N/A ALA 465.A N ALA 484.A O no hydrogen 2.964 N/A VAL 466.A N LEU 533.A O no hydrogen 2.902 N/A GLY 467.A N ALA 482.A O no hydrogen 2.846 N/A PHE 468.A N LEU 535.A O no hydrogen 2.897 N/A ASP 469.A N GLY 480.A O no hydrogen 2.999 N/A GLY 471.A N PHE 478.A O no hydrogen 2.945 N/A ARG 477.A N GLN 500.A O no hydrogen 2.858 N/A PHE 478.A N GLY 471.A O no hydrogen 2.878 N/A GLY 479.A N GLU 498.A O no hydrogen 2.831 N/A GLY 480.A N ASP 469.A O no hydrogen 2.883 N/A ALA 482.A N GLY 467.A O no hydrogen 2.991 N/A CYS 483.A N LEU 493.A O no hydrogen 2.838 N/A CYS 483.A SG LEU 493.A O no hydrogen 3.924 N/A ALA 484.A N ALA 465.A O no hydrogen 2.896 N/A VAL 485.A N HIS 491.A O no hydrogen 2.864 N/A ASP 488.A N ASP 488.A OD1 no hydrogen 2.372 N/A GLY 489.A N GLY 486.A O no hydrogen 3.045 N/A HIS 491.A N VAL 485.A O no hydrogen 3.338 N/A HIS 491.A ND1 GLU 671.A OE2 no hydrogen 3.244 N/A LEU 493.A N CYS 483.A O no hydrogen 2.951 N/A TRP 494.A N ARG 670.A O no hydrogen 3.226 N/A TRP 494.A NE1 LYS 672.A O no hydrogen 2.949 N/A THR 495.A N ALA 481.A O no hydrogen 3.197 N/A THR 495.A OG1 ALA 481.A O no hydrogen 3.182 N/A GLU 498.A N GLY 479.A O no hydrogen 2.927 N/A ALA 499.A N GLU 498.A OE2 no hydrogen 3.242 N/A GLN 500.A N ARG 477.A O no hydrogen 2.864 N/A GLN 500.A NE2 GLY 502.A O no hydrogen 2.760 N/A GLN 500.A NE2 GLU 503.A O no hydrogen 3.251 N/A ILE 505.A N GLU 544.A OE1 no hydrogen 2.769 N/A VAL 510.A N PRO 506.A O no hydrogen 2.913 N/A TRP 511.A N GLN 507.A O no hydrogen 2.969 N/A ASP 512.A N GLU 508.A O no hydrogen 2.917 N/A LEU 513.A N VAL 509.A O no hydrogen 2.941 N/A LEU 514.A N VAL 510.A O no hydrogen 2.991 N/A GLU 515.A N TRP 511.A O no hydrogen 2.820 N/A GLU 516.A N ASP 512.A O no hydrogen 2.992 N/A THR 517.A N LEU 513.A O no hydrogen 3.046 N/A THR 517.A OG1 LEU 514.A O no hydrogen 2.659 N/A LEU 518.A N LEU 514.A O no hydrogen 2.860 N/A TRP 519.A N GLU 515.A O no hydrogen 2.905 N/A ALA 520.A N GLU 516.A O no hydrogen 2.936 N/A PHE 521.A N THR 517.A O no hydrogen 2.987 N/A ARG 522.A N LEU 518.A O no hydrogen 2.884 N/A ARG 523.A N TRP 519.A O no hydrogen 2.889 N/A LYS 524.A N ALA 520.A O no hydrogen 2.966 N/A ALA 525.A N PHE 521.A O no hydrogen 2.855 N/A GLY 526.A N ARG 522.A O no hydrogen 2.843 N/A ARG 527.A NH1 GLU 463.A OE1 no hydrogen 2.989 N/A ARG 527.A NH1 GLU 463.A OE2 no hydrogen 3.178 N/A ARG 527.A NH2 GLU 463.A OE2 no hydrogen 2.843 N/A SER 530.A N GLU 463.A OE1 no hydrogen 3.261 N/A ARG 531.A NE ASP 560.A OD2 no hydrogen 3.350 N/A VAL 532.A N ALA 558.A O no hydrogen 2.927 N/A LEU 533.A N LEU 464.A O no hydrogen 2.859 N/A LEU 534.A N ASP 560.A O no hydrogen 2.713 N/A LEU 535.A N VAL 466.A O no hydrogen 2.859 N/A ARG 536.A N VAL 562.A O no hydrogen 3.002 N/A ARG 536.A NH1 GLU 544.A OE2 no hydrogen 2.772 N/A ASP 537.A N PHE 468.A O no hydrogen 2.978 N/A GLY 538.A N VAL 564.A O no hydrogen 2.784 N/A GLU 544.A N PRO 541.A O no hydrogen 3.050 N/A ALA 546.A N ASP 543.A O no hydrogen 3.335 N/A LEU 547.A N GLN 507.A OE1 no hydrogen 3.261 N/A LEU 549.A N PHE 545.A O no hydrogen 2.735 N/A GLU 550.A N ALA 546.A O no hydrogen 2.981 N/A ALA 551.A N LEU 547.A O no hydrogen 2.910 N/A LEU 552.A N ALA 548.A O no hydrogen 2.896 N/A ALA 553.A N LEU 549.A O no hydrogen 2.949 N/A ARG 554.A N GLU 550.A O no hydrogen 2.899 N/A ARG 554.A N ALA 551.A O no hydrogen 3.228 N/A ARG 554.A NE GLU 550.A OE1 no hydrogen 2.724 N/A ARG 554.A NH2 GLU 550.A OE1 no hydrogen 2.987 N/A GLU 555.A N ALA 551.A O no hydrogen 3.298 N/A GLU 555.A N LEU 552.A O no hydrogen 3.074 N/A GLY 556.A N ALA 553.A O no hydrogen 3.318 N/A ILE 557.A N LEU 552.A O no hydrogen 2.997 N/A ALA 558.A N SER 530.A O no hydrogen 3.173 N/A ASP 560.A N VAL 532.A O no hydrogen 3.118 N/A LEU 561.A N ALA 614.A O no hydrogen 2.753 N/A VAL 562.A N LEU 534.A O no hydrogen 2.735 N/A SER 563.A N VAL 611.A O no hydrogen 2.892 N/A SER 563.A OG GLY 538.A O no hydrogen 2.676 N/A VAL 564.A N ARG 536.A O no hydrogen 2.942 N/A ARG 565.A N LYS 609.A O no hydrogen 2.857 N/A ARG 565.A NE SER 563.A OG no hydrogen 2.964 N/A LYS 566.A NZ ASP 537.A OD2 no hydrogen 2.681 N/A ARG 571.A N ASN 8.A OD1 no hydrogen 2.900 N/A ARG 571.A NE ASP 164.A OD1 no hydrogen 3.249 N/A ARG 571.A NE ASP 164.A OD2 no hydrogen 3.051 N/A ARG 571.A NH1 PRO 605.A O no hydrogen 3.050 N/A ARG 571.A NH2 ASP 164.A OD2 no hydrogen 2.910 N/A TYR 573.A N PHE 6.A O no hydrogen 2.930 N/A VAL 575.A N GLU 4.A O no hydrogen 3.302 N/A LEU 583.A N LEU 595.A O no hydrogen 2.998 N/A TYR 584.A N TYR 305.A O no hydrogen 2.881 N/A VAL 585.A N LEU 593.A O no hydrogen 2.947 N/A LEU 587.A N THR 591.A O no hydrogen 3.155 N/A THR 591.A N GLU 588.A O no hydrogen 3.210 N/A PHE 592.A N LEU 610.A O no hydrogen 2.915 N/A LEU 593.A N VAL 585.A O no hydrogen 2.825 N/A LEU 594.A N LEU 608.A O no hydrogen 2.893 N/A LEU 595.A N LEU 583.A O no hydrogen 2.889 N/A THR 596.A OG1 ARG 642.A O no hydrogen 2.673 N/A ARG 602.A N ARG 599.A O no hydrogen 3.421 N/A THR 604.A OG1 LEU 272.A O no hydrogen 2.870 N/A LEU 608.A N LEU 594.A O no hydrogen 2.840 N/A LYS 609.A N ARG 565.A O no hydrogen 2.949 N/A LEU 610.A N PHE 592.A O no hydrogen 2.803 N/A VAL 611.A N SER 563.A O no hydrogen 2.942 N/A HIS 612.A N LYS 590.A O no hydrogen 2.747 N/A HIS 612.A NE2 ASP 560.A OD1 no hydrogen 2.947 N/A GLU 613.A N LEU 561.A O no hydrogen 2.886 N/A ALA 614.A N LEU 561.A O no hydrogen 3.510 N/A THR 617.A N ASP 560.A OD1 no hydrogen 3.140 N/A THR 617.A OG1 ASP 560.A OD1 no hydrogen 3.285 N/A THR 617.A OG1 ASP 560.A OD2 no hydrogen 2.618 N/A LEU 622.A N PRO 618.A O no hydrogen 3.251 N/A ALA 623.A N LEU 619.A O no hydrogen 2.929 N/A HIS 624.A N GLU 620.A O no hydrogen 2.836 N/A GLN 625.A N ALA 621.A O no hydrogen 2.964 N/A GLN 625.A NE2 ALA 462.A O no hydrogen 2.838 N/A ILE 626.A N LEU 622.A O no hydrogen 2.906 N/A PHE 627.A N ALA 623.A O no hydrogen 2.883 N/A HIS 628.A N HIS 624.A O no hydrogen 2.914 N/A HIS 628.A ND1 TYR 460.A OH no hydrogen 2.568 N/A HIS 628.A NE2 SER 308.A O no hydrogen 3.146 N/A LEU 629.A N GLN 625.A O no hydrogen 2.890 N/A THR 630.A N ILE 626.A O no hydrogen 3.066 N/A THR 630.A N PHE 627.A O no hydrogen 3.090 N/A THR 630.A OG1 PRO 641.A O no hydrogen 2.816 N/A THR 630.A OG1 ARG 642.A O no hydrogen 2.940 N/A ARG 631.A N HIS 628.A O no hydrogen 2.764 N/A ARG 631.A NH1 ASP 581.A OD2 no hydrogen 3.382 N/A ARG 631.A NH2 ASP 581.A OD2 no hydrogen 3.475 N/A ARG 631.A NH2 THR 596.A O no hydrogen 2.647 N/A LEU 632.A N LEU 629.A O no hydrogen 3.183 N/A SER 636.A OG ALA 639.A O no hydrogen 2.599 N/A GLY 637.A N ASN 440.A OD1 no hydrogen 2.637 N/A ARG 642.A NH1 LYS 566.A O no hydrogen 2.952 N/A ARG 642.A NH1 ARG 606.A O no hydrogen 2.537 N/A ARG 642.A NH2 LYS 566.A O no hydrogen 3.216 N/A ALA 645.A N LEU 629.A O no hydrogen 2.979 N/A HIS 648.A N PRO 644.A O no hydrogen 3.095 N/A LEU 649.A N ALA 645.A O no hydrogen 2.893 N/A ALA 650.A N PRO 646.A O no hydrogen 2.903 N/A ASP 651.A N LEU 647.A O no hydrogen 2.897 N/A ARG 652.A N HIS 648.A O no hydrogen 3.038 N/A ARG 652.A NH2 PHE 675.A O no hydrogen 3.227 N/A LEU 653.A N LEU 649.A O no hydrogen 2.841 N/A VAL 654.A N ALA 650.A O no hydrogen 2.959 N/A LYS 655.A N ASP 651.A O no hydrogen 3.000 N/A LYS 655.A NZ ASP 651.A OD1 no hydrogen 2.864 N/A GLU 656.A N ARG 652.A O no hydrogen 2.928 N/A VAL 657.A N LEU 653.A O no hydrogen 2.977 N/A GLY 658.A N VAL 654.A O no hydrogen 2.913 N/A ARG 659.A N LYS 655.A O no hydrogen 2.992 N/A ARG 659.A N GLU 656.A O no hydrogen 3.055 N/A ARG 659.A NE GLU 656.A OE1 no hydrogen 3.332 N/A ARG 659.A NH2 GLU 656.A OE1 no hydrogen 3.305 N/A LEU 660.A N GLU 656.A O no hydrogen 2.869 N/A GLY 661.A N VAL 657.A O no hydrogen 2.868 N/A HIS 664.A NE2 LEU 660.A O no hydrogen 3.259 N/A LEU 665.A N ILE 662.A O no hydrogen 3.478 N/A VAL 668.A N LEU 665.A O no hydrogen 3.212 N/A ARG 670.A NH1 GLU 516.A OE2 no hydrogen 2.810 N/A LYS 672.A N ASP 669.A O no hydrogen 2.899 N/A LYS 672.A NZ GLN 395.A O no hydrogen 2.999 N/A LEU 673.A N ALA 447.A O no hydrogen 3.315 N/A PHE 674.A N LYS 672.A O no hydrogen 2.920 N/A VAL 676.A N LEU 673.A O no hydrogen 3.397 N/A