Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pgq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A OG1 TYR 8.A O no hydrogen 2.985 N/A TRP 13.A N VAL 10.A O no hydrogen 3.082 N/A LEU 14.A N VAL 10.A O no hydrogen 3.195 N/A GLN 15.A N LYS 11.A O no hydrogen 3.254 N/A GLN 15.A NE2 PRO 78.A O no hydrogen 3.071 N/A LYS 17.A N GLN 15.A OE1 no hydrogen 3.162 N/A LYS 17.A NZ GLY 79.A O no hydrogen 3.311 N/A ARG 18.A N GLN 15.A O no hydrogen 3.002 N/A ARG 18.A NE ASP 31.A OD1 no hydrogen 2.979 N/A ARG 18.A NE ASP 31.A OD2 no hydrogen 3.252 N/A ARG 18.A NH1 LYS 11.A O no hydrogen 3.138 N/A ARG 18.A NH2 ASP 31.A OD2 no hydrogen 2.972 N/A TYR 19.A N PRO 16.A O no hydrogen 2.993 N/A LYS 20.A N PRO 16.A O no hydrogen 3.134 N/A ALA 21.A N LYS 17.A O no hydrogen 2.870 N/A HIS 22.A N ARG 18.A O no hydrogen 3.118 N/A HIS 22.A ND1 GLU 12.A OE2 no hydrogen 3.044 N/A LEU 23.A N TYR 19.A O no hydrogen 2.732 N/A MET 24.A N LYS 20.A O no hydrogen 3.323 N/A MET 24.A N ALA 21.A O no hydrogen 2.912 N/A GLY 25.A N HIS 22.A O no hydrogen 2.673 N/A THR 26.A N ALA 21.A O no hydrogen 3.433 N/A THR 26.A OG1 THR 27.A O no hydrogen 3.364 N/A THR 26.A OG1 THR 250.A OG1 no hydrogen 2.953 N/A THR 27.A N ASP 317.A OD2 no hydrogen 3.061 N/A THR 27.A OG1 ASP 317.A OD2 no hydrogen 2.866 N/A TYR 30.A OH GLU 62.A OE2 no hydrogen 2.348 N/A ASP 31.A N TYR 28.A O no hydrogen 2.652 N/A PHE 32.A N VAL 29.A O no hydrogen 3.309 N/A LEU 35.A N ASP 31.A O no hydrogen 3.296 N/A PHE 36.A N PHE 32.A O no hydrogen 2.972 N/A ARG 37.A N PRO 33.A O no hydrogen 2.965 N/A ARG 37.A NE GLU 34.A OE1 no hydrogen 3.011 N/A ARG 37.A NE GLU 34.A OE2 no hydrogen 3.143 N/A ARG 37.A NH2 GLU 34.A OE2 no hydrogen 2.843 N/A GLN 38.A N GLU 34.A O no hydrogen 2.974 N/A GLN 38.A NE2 GLU 34.A OE2 no hydrogen 2.855 N/A ALA 39.A N LEU 35.A O no hydrogen 2.893 N/A SER 40.A N PHE 36.A O no hydrogen 2.959 N/A SER 40.A OG PHE 36.A O no hydrogen 2.776 N/A SER 41.A N ARG 37.A O no hydrogen 3.042 N/A SER 42.A N GLN 38.A O no hydrogen 3.162 N/A SER 42.A OG GLN 38.A O no hydrogen 3.069 N/A GLN 43.A N ALA 39.A O no hydrogen 2.903 N/A TRP 44.A N SER 40.A O no hydrogen 3.087 N/A TRP 44.A NE1 LYS 93.A O no hydrogen 2.860 N/A LYS 45.A N SER 41.A O no hydrogen 3.033 N/A ASN 46.A N SER 42.A O no hydrogen 2.992 N/A PHE 47.A N GLN 43.A O no hydrogen 3.251 N/A PHE 47.A N TRP 44.A O no hydrogen 3.062 N/A SER 48.A N TRP 44.A O no hydrogen 2.889 N/A VAL 51.A N SER 48.A O no hydrogen 3.376 N/A LYS 52.A NZ ASP 50.A O no hydrogen 3.476 N/A THR 54.A OG1 ASP 56.A OD1 no hydrogen 3.172 N/A THR 54.A OG1 ASP 56.A OD2 no hydrogen 3.164 N/A PHE 57.A N THR 54.A O no hydrogen 3.133 N/A PHE 58.A N ASP 55.A O no hydrogen 3.302 N/A ILE 59.A N THR 91.A O no hydrogen 2.925 N/A ASN 61.A N LYS 89.A O no hydrogen 2.953 N/A ASN 61.A ND2 GLU 73.A OE1 no hydrogen 3.431 N/A LEU 63.A N ALA 87.A O no hydrogen 2.709 N/A ILE 64.A N THR 72.A O no hydrogen 2.790 N/A ASP 66.A N GLU 70.A O no hydrogen 2.575 N/A ASN 68.A N ASP 66.A OD2 no hydrogen 2.787 N/A GLY 69.A N ASP 66.A O no hydrogen 3.000 N/A THR 72.A N ILE 64.A O no hydrogen 2.612 N/A VAL 74.A N GLU 62.A O no hydrogen 3.081 N/A ARG 76.A NE GLU 62.A OE1 no hydrogen 2.987 N/A ARG 76.A NH2 GLU 62.A OE2 no hydrogen 2.735 N/A ALA 80.A N GLU 77.A O no hydrogen 3.183 N/A GLY 84.A N GLU 121.A OE1 no hydrogen 3.134 N/A VAL 86.A N ALA 107.A O no hydrogen 2.971 N/A PHE 88.A N VAL 105.A O no hydrogen 2.813 N/A LYS 89.A N ASN 61.A O no hydrogen 2.782 N/A LYS 89.A NZ TYR 131.A OH no hydrogen 2.978 N/A ILE 90.A N PHE 103.A O no hydrogen 2.895 N/A THR 91.A N ILE 59.A O no hydrogen 3.017 N/A THR 91.A OG1 GLN 102.A OE1 no hydrogen 3.119 N/A VAL 92.A N ARG 101.A O no hydrogen 2.801 N/A LYS 93.A N PHE 57.A O no hydrogen 3.034 N/A THR 94.A N TYR 97.A O no hydrogen 2.885 N/A GLU 96.A N GLU 96.A OE1 no hydrogen 2.847 N/A TYR 97.A N THR 94.A OG1 no hydrogen 2.796 N/A GLY 100.A N TYR 97.A O no hydrogen 2.822 N/A ARG 101.A N VAL 92.A O no hydrogen 2.792 N/A ARG 101.A NH1 GLU 96.A OE2 no hydrogen 3.067 N/A ARG 101.A NH1 MET 328.A O no hydrogen 3.181 N/A ARG 101.A NH2 VAL 331.A O no hydrogen 2.781 N/A PHE 103.A N ILE 90.A O no hydrogen 3.017 N/A VAL 104.A N PRO 138.A O no hydrogen 2.945 N/A VAL 105.A N PHE 88.A O no hydrogen 2.840 N/A VAL 106.A N ILE 140.A O no hydrogen 2.899 N/A ALA 107.A N VAL 86.A O no hydrogen 2.917 N/A ASN 108.A N LEU 142.A O no hydrogen 3.283 N/A ASN 108.A ND2 TYR 141.A OH no hydrogen 2.478 N/A ASP 109.A N GLY 84.A O no hydrogen 2.866 N/A THR 111.A N ASP 109.A OD2 no hydrogen 2.985 N/A THR 111.A OG1 ASP 109.A OD1 no hydrogen 3.400 N/A THR 111.A OG1 ASP 109.A OD2 no hydrogen 2.629 N/A PHE 112.A N ASP 109.A O no hydrogen 2.872 N/A GLY 115.A N PHE 112.A O no hydrogen 2.824 N/A SER 116.A N LYS 113.A O no hydrogen 2.907 N/A SER 116.A OG LYS 113.A O no hydrogen 2.755 N/A PHE 117.A N GLY 147.A O no hydrogen 2.702 N/A GLY 118.A N GLU 121.A OE2 no hydrogen 2.555 N/A ASP 122.A N GLY 118.A O no hydrogen 3.122 N/A GLU 123.A N PRO 119.A O no hydrogen 2.967 N/A PHE 124.A N GLN 120.A O no hydrogen 3.113 N/A PHE 125.A N GLU 121.A O no hydrogen 2.880 N/A ASN 126.A N ASP 122.A O no hydrogen 2.998 N/A LYS 127.A N GLU 123.A O no hydrogen 2.981 N/A LYS 127.A NZ GLU 65.A OE1 no hydrogen 2.913 N/A LYS 127.A NZ GLY 69.A O no hydrogen 2.971 N/A LYS 127.A NZ GLU 123.A OE1 no hydrogen 3.199 N/A LYS 127.A NZ GLU 123.A OE2 no hydrogen 3.508 N/A VAL 128.A N PHE 124.A O no hydrogen 2.965 N/A THR 129.A N PHE 125.A O no hydrogen 3.042 N/A THR 129.A OG1 PHE 125.A O no hydrogen 3.220 N/A GLU 130.A N ASN 126.A O no hydrogen 2.926 N/A TYR 131.A N LYS 127.A O no hydrogen 3.011 N/A ALA 132.A N VAL 128.A O no hydrogen 2.994 N/A ARG 133.A N THR 129.A O no hydrogen 2.912 N/A ARG 133.A NE ASP 242.A OD1 no hydrogen 2.868 N/A ARG 133.A NH2 ASP 242.A OD1 no hydrogen 2.709 N/A LYS 134.A N GLU 130.A O no hydrogen 2.979 N/A ARG 135.A N TYR 131.A O no hydrogen 3.336 N/A ARG 135.A NH1 TYR 131.A O no hydrogen 2.902 N/A GLY 136.A N ALA 132.A O no hydrogen 2.696 N/A GLY 136.A N ARG 133.A O no hydrogen 3.029 N/A ILE 137.A N ALA 132.A O no hydrogen 2.881 N/A ARG 139.A N PHE 244.A O no hydrogen 2.996 N/A ARG 139.A NE ARG 139.A O no hydrogen 2.792 N/A ARG 139.A NH2 ILE 246.A O no hydrogen 3.122 N/A ILE 140.A N VAL 104.A O no hydrogen 2.762 N/A TYR 141.A N ILE 246.A O no hydrogen 2.934 N/A LEU 142.A N VAL 106.A O no hydrogen 2.803 N/A ALA 143.A N LEU 248.A O no hydrogen 2.905 N/A ASN 145.A N ARG 252.A O no hydrogen 2.749 N/A ASN 145.A ND2 VAL 254.A O no hydrogen 3.212 N/A SER 146.A N GLY 115.A O no hydrogen 3.180 N/A SER 146.A OG ILE 114.A O no hydrogen 3.315 N/A ARG 149.A N PHE 117.A O no hydrogen 3.110 N/A ARG 149.A NE SER 116.A OG no hydrogen 3.060 N/A ARG 149.A NH2 SER 116.A O no hydrogen 3.347 N/A ARG 149.A NH2 GLU 121.A OE1 no hydrogen 2.982 N/A GLU 155.A N GLU 155.A OE2 no hydrogen 2.684 N/A ILE 156.A N ALA 153.A O no hydrogen 2.866 N/A VAL 157.A N GLU 154.A O no hydrogen 3.182 N/A LEU 159.A N ILE 156.A O no hydrogen 2.897 N/A PHE 160.A N ILE 156.A O no hydrogen 3.178 N/A GLN 161.A N TYR 178.A O no hydrogen 2.752 N/A ALA 163.A N TYR 176.A O no hydrogen 2.974 N/A LYS 172.A N ASN 169.A O no hydrogen 3.254 N/A GLY 173.A N PRO 170.A O no hydrogen 3.043 N/A GLN 175.A N ALA 163.A O no hydrogen 2.800 N/A TYR 178.A N GLN 161.A O no hydrogen 3.009 N/A LEU 179.A N PHE 209.A O no hydrogen 2.891 N/A MET 184.A N THR 180.A O no hydrogen 2.667 N/A GLU 185.A N SER 181.A O no hydrogen 2.893 N/A THR 186.A N GLU 182.A O no hydrogen 3.172 N/A THR 186.A OG1 GLU 182.A O no hydrogen 2.542 N/A LEU 187.A N GLY 183.A O no hydrogen 3.280 N/A LEU 187.A N MET 184.A O no hydrogen 2.904 N/A LYS 188.A N MET 184.A O no hydrogen 3.026 N/A LYS 189.A N GLU 185.A O no hydrogen 2.859 N/A ASP 191.A N LYS 188.A O no hydrogen 2.993 N/A LYS 192.A NZ SER 217.A OG no hydrogen 3.205 N/A SER 195.A N LYS 192.A O no hydrogen 3.188 N/A SER 195.A OG GLU 155.A OE1 no hydrogen 3.000 N/A SER 195.A OG LYS 192.A O no hydrogen 3.349 N/A LEU 197.A N THR 213.A O no hydrogen 2.927 N/A THR 201.A N ARG 208.A O no hydrogen 3.011 N/A ILE 203.A N GLU 206.A O no hydrogen 3.042 N/A ARG 208.A N THR 201.A O no hydrogen 2.809 N/A ARG 208.A NE TYR 176.A OH no hydrogen 3.546 N/A PHE 209.A N LEU 179.A O no hydrogen 2.908 N/A VAL 210.A N GLU 199.A O no hydrogen 3.255 N/A ILE 211.A N LEU 177.A O no hydrogen 2.820 N/A LYS 212.A N LEU 197.A O no hydrogen 2.839 N/A ILE 215.A N SER 195.A O no hydrogen 2.787 N/A GLY 216.A N SER 195.A O no hydrogen 2.852 N/A SER 217.A N GLU 155.A OE1 no hydrogen 3.062 N/A GLY 220.A N GLU 224.A OE1 no hydrogen 2.590 N/A LEU 221.A N GLU 224.A OE1 no hydrogen 3.031 N/A GLU 224.A N GLU 224.A OE2 no hydrogen 2.767 N/A CYS 225.A N GLY 222.A O no hydrogen 2.823 N/A CYS 225.A SG ARG 149.A O no hydrogen 3.522 N/A ARG 227.A N VAL 223.A O no hydrogen 2.975 N/A GLY 228.A N GLU 224.A O no hydrogen 3.046 N/A SER 229.A N CYS 225.A O no hydrogen 2.947 N/A SER 229.A OG CYS 225.A O no hydrogen 2.990 N/A GLY 230.A N LEU 226.A O no hydrogen 2.876 N/A LEU 231.A N ARG 227.A O no hydrogen 3.036 N/A ALA 233.A N SER 229.A O no hydrogen 2.983 N/A GLY 234.A N GLY 230.A O no hydrogen 3.080 N/A ALA 235.A N LEU 231.A O no hydrogen 2.928 N/A THR 236.A N ILE 232.A O no hydrogen 2.827 N/A THR 236.A OG1 ILE 232.A O no hydrogen 2.751 N/A SER 237.A N ALA 233.A O no hydrogen 2.979 N/A ARG 238.A N GLY 234.A O no hydrogen 3.086 N/A ALA 239.A N ALA 235.A O no hydrogen 2.920 N/A TYR 240.A N THR 236.A O no hydrogen 3.048 N/A TYR 240.A N SER 237.A O no hydrogen 2.982 N/A TYR 240.A OH ASP 459.A OD1 no hydrogen 2.667 N/A HIS 241.A N ARG 238.A O no hydrogen 3.067 N/A HIS 241.A ND1 ASN 462.A OD1 no hydrogen 3.088 N/A ASP 242.A N ALA 239.A O no hydrogen 2.705 N/A ILE 243.A N ALA 239.A O no hydrogen 2.979 N/A THR 245.A OG1 GLY 264.A O no hydrogen 2.458 N/A ILE 246.A N ARG 139.A O no hydrogen 3.380 N/A THR 247.A N ARG 266.A O no hydrogen 2.901 N/A LEU 248.A N TYR 141.A O no hydrogen 2.884 N/A VAL 249.A N ILE 268.A O no hydrogen 2.871 N/A THR 250.A N ALA 143.A O no hydrogen 2.848 N/A THR 250.A OG1 THR 26.A OG1 no hydrogen 2.953 N/A THR 250.A OG1 ASP 317.A OD1 no hydrogen 2.932 N/A CYS 251.A SG MET 24.A O no hydrogen 3.548 N/A ARG 252.A NE ASN 145.A O no hydrogen 3.141 N/A ARG 252.A NE SER 146.A OG no hydrogen 3.319 N/A ARG 252.A NH2 SER 146.A OG no hydrogen 2.618 N/A SER 253.A N PRO 274.A O no hydrogen 3.013 N/A SER 253.A OG ASN 145.A OD1 no hydrogen 2.837 N/A GLY 255.A N ILE 276.A O no hydrogen 2.967 N/A TYR 259.A N GLY 255.A O no hydrogen 3.170 N/A LEU 260.A N ILE 256.A O no hydrogen 2.800 N/A VAL 261.A N GLY 257.A O no hydrogen 3.187 N/A ARG 262.A N ALA 258.A O no hydrogen 3.257 N/A LEU 263.A N TYR 259.A O no hydrogen 2.738 N/A GLY 264.A N LEU 260.A O no hydrogen 3.233 N/A ARG 266.A N GLY 264.A O no hydrogen 2.817 N/A ARG 266.A NE THR 245.A O no hydrogen 2.853 N/A ARG 266.A NH1 GLU 464.A OE1 no hydrogen 3.278 N/A ILE 268.A N THR 247.A O no hydrogen 2.951 N/A GLN 269.A N LEU 312.A O no hydrogen 2.899 N/A VAL 270.A N VAL 249.A O no hydrogen 3.213 N/A GLU 271.A N ALA 314.A O no hydrogen 2.770 N/A GLN 273.A N VAL 270.A O no hydrogen 2.937 N/A GLN 273.A NE2 THR 250.A O no hydrogen 3.274 N/A ILE 275.A N GLY 299.A O no hydrogen 2.917 N/A ILE 276.A N SER 253.A O no hydrogen 2.855 N/A ALA 280.A N ASN 295.A OD1 no hydrogen 2.993 N/A ALA 282.A N GLY 279.A O no hydrogen 3.149 N/A ILE 283.A N GLY 279.A O no hydrogen 3.035 N/A ASN 284.A N ALA 280.A O no hydrogen 2.788 N/A ASN 284.A ND2 TYR 292.A O no hydrogen 2.929 N/A LYS 285.A N PRO 281.A O no hydrogen 2.824 N/A MET 286.A N ALA 282.A O no hydrogen 2.923 N/A LEU 287.A N ILE 283.A O no hydrogen 2.843 N/A GLY 288.A N LYS 285.A O no hydrogen 3.217 N/A ARG 289.A N ASN 284.A O no hydrogen 3.200 N/A VAL 291.A N ASN 284.A OD1 no hydrogen 2.938 N/A TYR 292.A N ASN 284.A OD1 no hydrogen 3.066 N/A GLN 297.A N SER 294.A O no hydrogen 3.193 N/A GLN 297.A N SER 294.A OG no hydrogen 3.227 N/A LEU 298.A N ASN 295.A O no hydrogen 2.836 N/A GLY 299.A N ASN 295.A O no hydrogen 2.949 N/A GLY 300.A N LEU 296.A O no hydrogen 2.930 N/A GLN 302.A NE2 LEU 296.A O no hydrogen 3.100 N/A ILE 303.A N GLY 300.A O no hydrogen 3.018 N/A MET 304.A N GLY 300.A O no hydrogen 2.950 N/A TYR 305.A N THR 301.A O no hydrogen 2.884 N/A TYR 305.A OH SER 392.A OG no hydrogen 3.032 N/A ASN 307.A N ILE 303.A O no hydrogen 2.926 N/A GLY 308.A N TYR 305.A O no hydrogen 3.424 N/A SER 310.A N MET 304.A O no hydrogen 2.815 N/A HIS 311.A N ALA 267.A O no hydrogen 2.760 N/A LEU 312.A N ALA 267.A O no hydrogen 3.310 N/A ALA 314.A N GLN 269.A O no hydrogen 2.763 N/A ALA 319.A N ASP 316.A OD1 no hydrogen 2.790 N/A GLY 320.A N ASP 316.A O no hydrogen 2.920 N/A VAL 321.A N ASP 317.A O no hydrogen 2.812 N/A GLU 322.A N LEU 318.A O no hydrogen 2.926 N/A LYS 323.A N ALA 319.A O no hydrogen 3.100 N/A LYS 323.A NZ THR 313.A O no hydrogen 3.302 N/A ILE 324.A N GLY 320.A O no hydrogen 3.083 N/A VAL 325.A N VAL 321.A O no hydrogen 2.895 N/A GLU 326.A N GLU 322.A O no hydrogen 2.848 N/A TRP 327.A N LYS 323.A O no hydrogen 2.725 N/A TRP 327.A NE1 GLU 464.A OE1 no hydrogen 3.058 N/A MET 328.A N ILE 324.A O no hydrogen 2.865 N/A MET 328.A N VAL 325.A O no hydrogen 3.176 N/A SER 329.A N GLU 326.A O no hydrogen 3.080 N/A SER 329.A OG GLU 326.A O no hydrogen 2.685 N/A TYR 330.A N TRP 327.A O no hydrogen 3.321 N/A TYR 330.A OH SER 386.A O no hydrogen 2.543 N/A VAL 331.A N MET 328.A O no hydrogen 3.043 N/A ARG 335.A N GLY 136.A O no hydrogen 2.829 N/A ARG 335.A NH1 ARG 133.A O no hydrogen 2.949 N/A ARG 335.A NH2 ARG 133.A O no hydrogen 2.959 N/A ASN 336.A N GLN 465.A OE1 no hydrogen 2.869 N/A MET 337.A N LYS 334.A O no hydrogen 3.064 N/A LEU 342.A N GLY 407.A O no hydrogen 2.987 N/A THR 347.A N LYS 345.A O no hydrogen 3.162 N/A ASP 349.A N THR 347.A OG1 no hydrogen 3.331 N/A ARG 350.A N TRP 348.A O no hydrogen 2.948 N/A ARG 350.A NE ASP 346.A OD2 no hydrogen 2.887 N/A ARG 350.A NH1 PRO 351.A O no hydrogen 3.029 N/A ARG 350.A NH1 GLY 380.A O no hydrogen 2.829 N/A ARG 350.A NH2 ASP 346.A OD1 no hydrogen 3.182 N/A ARG 350.A NH2 GLY 380.A O no hydrogen 2.881 N/A VAL 352.A N THR 609.A O no hydrogen 3.183 N/A ASP 353.A N TYR 379.A O no hydrogen 2.815 N/A PHE 354.A N TYR 379.A O no hydrogen 2.937 N/A THR 355.A OG1 ASP 353.A O no hydrogen 3.206 N/A GLU 360.A N THR 357.A O no hydrogen 3.369 N/A ARG 365.A N ASP 363.A OD2 no hydrogen 2.765 N/A ARG 365.A NE GLU 389.A OE2 no hydrogen 3.106 N/A ARG 365.A NH1 ASP 363.A OD2 no hydrogen 3.005 N/A ARG 365.A NH1 GLU 416.A OE2 no hydrogen 3.143 N/A ARG 365.A NH2 GLU 389.A OE1 no hydrogen 2.797 N/A TRP 366.A N ASP 363.A O no hydrogen 2.751 N/A MET 367.A N VAL 364.A O no hydrogen 2.860 N/A ILE 368.A N VAL 364.A O no hydrogen 3.263 N/A ILE 368.A N ARG 365.A O no hydrogen 2.976 N/A GLU 369.A N ARG 365.A O no hydrogen 2.819 N/A GLY 370.A N TRP 366.A O no hydrogen 2.864 N/A ARG 371.A N GLU 378.A O no hydrogen 2.896 N/A THR 373.A OG1 GLY 376.A O no hydrogen 2.541 N/A SER 375.A N THR 373.A OG1 no hydrogen 3.157 N/A GLY 376.A N THR 373.A O no hydrogen 3.301 N/A GLU 378.A N ARG 371.A O no hydrogen 2.973 N/A TYR 379.A N ASP 353.A OD2 no hydrogen 3.183 N/A LEU 381.A N MET 367.A O no hydrogen 2.917 N/A PHE 382.A N ILE 368.A O no hydrogen 3.021 N/A ASP 383.A N ARG 404.A O no hydrogen 2.874 N/A LYS 384.A N ASP 346.A OD1 no hydrogen 2.822 N/A SER 386.A N ASP 383.A O no hydrogen 3.016 N/A SER 386.A OG ASP 383.A O no hydrogen 2.981 N/A PHE 388.A N ARG 402.A O no hydrogen 2.664 N/A THR 390.A N VAL 400.A O no hydrogen 2.829 N/A SER 392.A OG TYR 305.A OH no hydrogen 3.032 N/A TRP 394.A N LEU 391.A O no hydrogen 3.316 N/A VAL 399.A N GLY 414.A O no hydrogen 3.015 N/A GLY 401.A N VAL 412.A O no hydrogen 3.060 N/A ARG 402.A N PHE 388.A O no hydrogen 2.930 N/A ARG 402.A NE GLU 464.A OE1 no hydrogen 3.308 N/A ARG 402.A NE GLU 464.A OE2 no hydrogen 2.264 N/A ARG 402.A NH1 THR 390.A OG1 no hydrogen 3.019 N/A ARG 402.A NH2 THR 390.A OG1 no hydrogen 3.276 N/A ARG 402.A NH2 GLU 464.A OE1 no hydrogen 3.168 N/A ALA 403.A N LEU 410.A O no hydrogen 3.040 N/A ARG 404.A N SER 386.A OG no hydrogen 2.889 N/A ARG 404.A NH2 SER 329.A O no hydrogen 3.288 N/A ARG 404.A NH2 SER 329.A OG no hydrogen 3.287 N/A LEU 405.A N ILE 408.A O no hydrogen 2.684 N/A GLY 406.A N ASP 383.A OD2 no hydrogen 2.622 N/A GLY 407.A N ASP 383.A OD1 no hydrogen 2.940 N/A ILE 408.A N LEU 405.A O no hydrogen 3.099 N/A LEU 410.A N ALA 403.A O no hydrogen 2.827 N/A GLY 411.A N PRO 467.A O no hydrogen 3.001 N/A VAL 412.A N GLY 401.A O no hydrogen 2.946 N/A ILE 413.A N MET 469.A O no hydrogen 3.013 N/A GLY 414.A N VAL 399.A O no hydrogen 2.944 N/A GLU 416.A N GLY 397.A O no hydrogen 3.005 N/A ARG 418.A N GLU 416.A OE1 no hydrogen 2.930 N/A ARG 418.A NH1 GLU 416.A OE1 no hydrogen 2.816 N/A VAL 420.A N GLU 440.A O no hydrogen 3.046 N/A ASN 422.A N ILE 438.A O no hydrogen 2.908 N/A ASN 422.A ND2 GLU 440.A OE2 no hydrogen 3.435 N/A ILE 424.A N THR 436.A O no hydrogen 2.748 N/A ASN 430.A N ASP 427.A O no hydrogen 2.916 N/A SER 433.A N ASN 432.A OD1 no hydrogen 3.115 N/A SER 433.A OG ASP 427.A O no hydrogen 3.253 N/A SER 433.A OG ASN 430.A O no hydrogen 2.886 N/A SER 433.A OG SER 433.A O no hydrogen 2.613 N/A THR 436.A N ILE 424.A O no hydrogen 2.768 N/A ILE 438.A N ASN 422.A O no hydrogen 2.670 N/A GLU 440.A N VAL 420.A O no hydrogen 2.782 N/A GLN 443.A NE2 ASN 473.A O no hydrogen 3.001 N/A TRP 445.A N GLY 476.A O no hydrogen 2.862 N/A TRP 445.A NE1 THR 453.A OG1 no hydrogen 3.210 N/A HIS 446.A N SER 449.A OG no hydrogen 2.799 N/A ASN 448.A ND2 GLU 440.A OE2 no hydrogen 3.125 N/A SER 449.A N ASN 448.A OD1 no hydrogen 2.696 N/A SER 449.A OG HIS 446.A O no hydrogen 3.265 N/A ALA 450.A N HIS 446.A O no hydrogen 2.747 N/A PHE 451.A N PRO 447.A O no hydrogen 2.845 N/A LYS 452.A N ASN 448.A O no hydrogen 2.780 N/A LYS 452.A NZ LEU 391.A O no hydrogen 2.826 N/A LYS 452.A NZ TRP 394.A O no hydrogen 2.557 N/A LYS 452.A NZ ALA 395.A O no hydrogen 3.100 N/A LYS 452.A NZ VAL 398.A O no hydrogen 3.210 N/A THR 453.A N SER 449.A O no hydrogen 3.030 N/A THR 453.A OG1 SER 449.A O no hydrogen 2.715 N/A ALA 454.A N ALA 450.A O no hydrogen 3.053 N/A GLN 455.A N PHE 451.A O no hydrogen 2.745 N/A ALA 456.A N LYS 452.A O no hydrogen 2.696 N/A ILE 457.A N THR 453.A O no hydrogen 3.039 N/A ASN 458.A N ALA 454.A O no hydrogen 3.079 N/A ASP 459.A N GLN 455.A O no hydrogen 3.009 N/A PHE 460.A N ALA 456.A O no hydrogen 3.019 N/A PHE 460.A N ILE 457.A O no hydrogen 3.260 N/A ASN 461.A N ILE 457.A O no hydrogen 3.142 N/A ASN 461.A N ASN 458.A O no hydrogen 2.961 N/A ASN 461.A ND2 ASP 501.A O no hydrogen 2.867 N/A ASN 462.A ND2 ASN 458.A O no hydrogen 2.813 N/A LEU 466.A N PHE 460.A O no hydrogen 3.039 N/A MET 468.A N PRO 505.A O no hydrogen 2.980 N/A MET 469.A N GLY 411.A O no hydrogen 2.811 N/A ILE 470.A N ILE 507.A O no hydrogen 2.802 N/A LEU 471.A N ILE 413.A O no hydrogen 2.782 N/A ARG 475.A N GLN 443.A O no hydrogen 2.494 N/A SER 478.A N TRP 445.A O no hydrogen 3.012 N/A SER 478.A OG ASP 483.A OD1 no hydrogen 2.527 N/A ASP 483.A N GLY 480.A O no hydrogen 3.190 N/A MET 484.A N GLY 480.A O no hydrogen 2.998 N/A PHE 485.A N GLN 481.A O no hydrogen 2.824 N/A ASN 486.A N ARG 482.A O no hydrogen 3.016 N/A GLU 487.A N MET 484.A O no hydrogen 2.610 N/A VAL 488.A N ASP 483.A O no hydrogen 3.054 N/A TYR 491.A N GLU 487.A O no hydrogen 3.254 N/A GLY 492.A N VAL 488.A O no hydrogen 2.863 N/A SER 493.A N LEU 489.A O no hydrogen 3.129 N/A SER 493.A OG LEU 489.A O no hydrogen 2.970 N/A PHE 494.A N LYS 490.A O no hydrogen 3.402 N/A PHE 494.A N TYR 491.A O no hydrogen 3.160 N/A ILE 495.A N GLY 492.A O no hydrogen 2.921 N/A ASP 497.A N SER 493.A O no hydrogen 2.947 N/A ALA 498.A N PHE 494.A O no hydrogen 2.990 N/A ALA 498.A N ILE 495.A O no hydrogen 3.133 N/A LEU 499.A N ILE 495.A O no hydrogen 3.076 N/A VAL 500.A N VAL 496.A O no hydrogen 2.998 N/A ASP 501.A N ALA 498.A O no hydrogen 2.861 N/A TYR 502.A N LEU 499.A O no hydrogen 3.271 N/A TYR 502.A OH LEU 466.A O no hydrogen 2.702 N/A LYS 503.A N ASN 461.A OD1 no hydrogen 2.909 N/A LYS 503.A NZ ASP 501.A O no hydrogen 2.718 N/A GLN 504.A NE2 ASN 461.A OD1 no hydrogen 2.801 N/A GLN 504.A NE2 LEU 466.A O no hydrogen 2.921 N/A ILE 506.A N GLN 532.A O no hydrogen 2.814 N/A ILE 507.A N MET 468.A O no hydrogen 2.833 N/A ILE 508.A N GLU 534.A O no hydrogen 2.724 N/A TYR 509.A N ILE 470.A O no hydrogen 2.867 N/A TYR 509.A OH ASP 538.A OD1 no hydrogen 2.662 N/A ILE 510.A N TYR 536.A O no hydrogen 2.800 N/A GLY 514.A N PRO 511.A O no hydrogen 2.762 N/A GLU 515.A N ASN 473.A OD1 no hydrogen 2.965 N/A LEU 516.A N ARG 542.A O no hydrogen 3.273 N/A ARG 517.A N SER 520.A OG no hydrogen 3.192 N/A ARG 517.A NE GLU 515.A OE2 no hydrogen 3.079 N/A ARG 517.A NH1 ASP 591.A OD2 no hydrogen 3.130 N/A GLY 518.A N GLY 544.A O no hydrogen 3.089 N/A SER 520.A OG TRP 474.A O no hydrogen 3.081 N/A SER 520.A OG ARG 517.A O no hydrogen 2.898 N/A TRP 521.A N GLY 518.A O no hydrogen 2.753 N/A TRP 521.A NE1 ASP 525.A OD1 no hydrogen 2.891 N/A VAL 522.A N GLY 518.A O no hydrogen 3.335 N/A VAL 523.A N GLY 519.A O no hydrogen 3.111 N/A VAL 524.A N TRP 521.A O no hydrogen 3.092 N/A ASP 525.A N VAL 522.A O no hydrogen 3.278 N/A THR 527.A N ASP 525.A OD2 no hydrogen 2.804 N/A THR 527.A OG1 ASP 525.A OD2 no hydrogen 2.800 N/A ILE 528.A N ASP 525.A O no hydrogen 3.067 N/A ASN 529.A N PRO 526.A O no hydrogen 3.012 N/A GLN 532.A N ASN 529.A O no hydrogen 3.201 N/A MET 533.A N ASN 529.A O no hydrogen 2.892 N/A GLU 534.A N ILE 506.A O no hydrogen 3.008 N/A TYR 536.A N ILE 508.A O no hydrogen 2.612 N/A TYR 536.A OH GLU 534.A OE1 no hydrogen 2.631 N/A ASP 538.A N ILE 510.A O no hydrogen 2.869 N/A VAL 539.A N LEU 606.A O no hydrogen 2.850 N/A ASN 540.A N ASP 538.A OD2 no hydrogen 3.106 N/A ALA 541.A N ASP 538.A O no hydrogen 3.027 N/A ARG 542.A N GLY 514.A O no hydrogen 2.963 N/A ARG 542.A NE ASP 588.A OD1 no hydrogen 2.807 N/A ARG 542.A NE ASP 588.A OD2 no hydrogen 3.197 N/A ARG 542.A NH1 ALA 541.A O no hydrogen 3.292 N/A ARG 542.A NH2 ASP 588.A OD2 no hydrogen 3.057 N/A ALA 543.A N ASP 591.A O no hydrogen 3.141 N/A GLY 544.A N LEU 516.A O no hydrogen 3.317 N/A MET 551.A N GLU 547.A O no hydrogen 2.751 N/A VAL 552.A N PRO 548.A O no hydrogen 2.999 N/A GLY 553.A N GLN 549.A O no hydrogen 3.299 N/A ILE 554.A N MET 551.A O no hydrogen 3.266 N/A LYS 555.A N MET 551.A O no hydrogen 3.017 N/A PHE 556.A N VAL 552.A O no hydrogen 3.144 N/A LYS 560.A NZ LYS 555.A O no hydrogen 2.736 N/A LEU 561.A N ARG 557.A O no hydrogen 3.093 N/A LEU 562.A N ARG 558.A O no hydrogen 2.909 N/A ASP 563.A N GLU 559.A O no hydrogen 3.180 N/A THR 564.A N LYS 560.A O no hydrogen 3.262 N/A THR 564.A N LEU 561.A O no hydrogen 2.559 N/A THR 564.A OG1 LYS 560.A O no hydrogen 2.768 N/A MET 565.A N LEU 561.A O no hydrogen 2.972 N/A ASN 566.A N LEU 562.A O no hydrogen 2.689 N/A ARG 567.A N THR 564.A O no hydrogen 2.813 N/A LEU 568.A N THR 564.A O no hydrogen 2.687 N/A TYR 572.A N ASP 569.A OD1 no hydrogen 3.202 N/A ARG 573.A NE ARG 573.A O no hydrogen 2.542 N/A ILE 578.A N LEU 575.A O no hydrogen 2.791 N/A TYR 579.A N LEU 575.A O no hydrogen 2.997 N/A GLY 580.A N LEU 576.A O no hydrogen 2.983 N/A ILE 582.A N ILE 578.A O no hydrogen 2.796 N/A SER 583.A N TYR 579.A O no hydrogen 2.890 N/A SER 583.A OG GLY 580.A O no hydrogen 2.526 N/A LEU 584.A N GLY 580.A O no hydrogen 3.068 N/A GLN 585.A N GLN 581.A O no hydrogen 3.083 N/A PHE 586.A N ILE 582.A O no hydrogen 2.774 N/A ALA 587.A N SER 583.A O no hydrogen 2.822 N/A ASP 588.A N LEU 584.A O no hydrogen 3.058 N/A LEU 589.A N GLN 585.A O no hydrogen 3.072 N/A HIS 590.A N ALA 587.A O no hydrogen 2.605 N/A ASP 591.A N ASP 588.A O no hydrogen 3.006 N/A ARG 592.A NE ASP 588.A O no hydrogen 3.097 N/A ARG 592.A NE ASP 588.A OD2 no hydrogen 3.270 N/A ARG 592.A NH2 ASP 588.A OD2 no hydrogen 3.092 N/A SER 593.A OG GLU 605.A OE1 no hydrogen 2.478 N/A ARG 595.A N ARG 592.A O no hydrogen 2.848 N/A MET 596.A N ARG 592.A O no hydrogen 3.323 N/A VAL 597.A N SER 593.A O no hydrogen 2.972 N/A ALA 598.A N SER 594.A O no hydrogen 3.122 N/A LYS 599.A N ARG 595.A O no hydrogen 2.927 N/A GLY 600.A N VAL 597.A O no hydrogen 2.707 N/A VAL 601.A N MET 596.A O no hydrogen 3.149 N/A SER 603.A N MET 535.A O no hydrogen 2.899 N/A LEU 606.A N ALA 537.A O no hydrogen 2.859 N/A TRP 608.A NE1 PHE 354.A O no hydrogen 2.822 N/A GLU 610.A N GLU 607.A O no hydrogen 2.688 N/A ALA 611.A N TRP 608.A O no hydrogen 2.735 N/A ARG 612.A NE THR 347.A O no hydrogen 3.458 N/A ARG 612.A NH1 LEU 381.A O no hydrogen 2.595 N/A ARG 612.A NH2 ASP 346.A O no hydrogen 3.193 N/A ARG 612.A NH2 THR 347.A O no hydrogen 3.124 N/A ARG 612.A NH2 ASP 383.A OD2 no hydrogen 2.445 N/A ARG 613.A NE ASP 349.A OD2 no hydrogen 2.775 N/A ARG 613.A NH1 GLU 610.A OE1 no hydrogen 3.276 N/A ARG 613.A NH2 ASP 349.A OD2 no hydrogen 3.292 N/A PHE 614.A N GLU 610.A O no hydrogen 3.055 N/A PHE 615.A N ALA 611.A O no hydrogen 2.741 N/A PHE 616.A N ARG 612.A O no hydrogen 2.874 N/A ARG 618.A N PHE 614.A O no hydrogen 2.950 N/A ARG 618.A NE GLU 534.A OE1 no hydrogen 3.071 N/A ARG 618.A NH1 ASP 661.A OD1 no hydrogen 2.627 N/A ARG 618.A NH2 GLU 534.A OE2 no hydrogen 2.422 N/A LEU 619.A N PHE 615.A O no hydrogen 2.823 N/A ARG 620.A N PHE 616.A O no hydrogen 2.951 N/A ARG 620.A NE GLU 669.A OE1 no hydrogen 2.690 N/A ARG 620.A NH2 GLU 669.A OE1 no hydrogen 3.261 N/A ARG 620.A NH2 GLU 669.A OE2 no hydrogen 2.797 N/A ARG 621.A N TRP 617.A O no hydrogen 2.751 N/A ARG 621.A NE GLU 625.A OE1 no hydrogen 2.805 N/A ARG 621.A NH1 HIS 658.A O no hydrogen 2.876 N/A ARG 621.A NH1 ASP 661.A OD1 no hydrogen 2.923 N/A ARG 621.A NH2 GLU 625.A OE2 no hydrogen 3.137 N/A ARG 621.A NH2 HIS 658.A O no hydrogen 2.650 N/A ARG 622.A N ARG 618.A O no hydrogen 2.979 N/A ARG 622.A NH1 GLN 532.A O no hydrogen 3.157 N/A LEU 623.A N LEU 619.A O no hydrogen 2.871 N/A ASN 624.A N ARG 620.A O no hydrogen 3.203 N/A ASN 624.A ND2 TYR 672.A OH no hydrogen 2.458 N/A GLU 625.A N ARG 621.A O no hydrogen 3.020 N/A GLU 626.A N ARG 622.A O no hydrogen 2.693 N/A TYR 627.A N LEU 623.A O no hydrogen 3.029 N/A LEU 628.A N ASN 624.A O no hydrogen 3.284 N/A ILE 629.A N GLU 625.A O no hydrogen 2.761 N/A LYS 630.A N GLU 626.A O no hydrogen 2.822 N/A ARG 631.A N TYR 627.A O no hydrogen 3.029 N/A ARG 631.A NH1 TYR 627.A OH no hydrogen 2.992 N/A ARG 631.A NH1 ASP 676.A OD1 no hydrogen 2.642 N/A ARG 631.A NH2 ASP 676.A OD1 no hydrogen 2.811 N/A LEU 632.A N LEU 628.A O no hydrogen 2.966 N/A SER 633.A N ILE 629.A O no hydrogen 2.861 N/A SER 633.A OG ILE 629.A O no hydrogen 3.521 N/A HIS 634.A N LYS 630.A O no hydrogen 3.196 N/A HIS 634.A N ARG 631.A O no hydrogen 3.248 N/A SER 640.A N GLU 643.A OE2 no hydrogen 2.766 N/A SER 640.A OG GLU 643.A OE2 no hydrogen 2.917 N/A GLU 643.A N SER 640.A O no hydrogen 2.809 N/A LYS 644.A N SER 640.A O no hydrogen 3.143 N/A LYS 644.A NZ SER 633.A OG no hydrogen 2.538 N/A ILE 645.A N ARG 641.A O no hydrogen 3.062 N/A ALA 646.A N LEU 642.A O no hydrogen 3.114 N/A ARG 647.A N GLU 643.A O no hydrogen 3.211 N/A ARG 647.A N LYS 644.A O no hydrogen 2.879 N/A ILE 648.A N LYS 644.A O no hydrogen 2.892 N/A ARG 649.A N ILE 645.A O no hydrogen 3.133 N/A ARG 649.A NE GLU 625.A OE2 no hydrogen 2.794 N/A ARG 649.A NH2 GLU 625.A OE1 no hydrogen 3.085 N/A ARG 649.A NH2 GLU 625.A OE2 no hydrogen 3.478 N/A SER 650.A N ARG 647.A O no hydrogen 3.220 N/A SER 650.A OG ARG 647.A O no hydrogen 2.742 N/A TRP 651.A N ILE 648.A O no hydrogen 2.683 N/A TYR 652.A OH GLU 625.A OE2 no hydrogen 2.682 N/A VAL 656.A N PRO 653.A O no hydrogen 2.898 N/A GLU 659.A N ASP 657.A OD2 no hydrogen 2.977 N/A ASP 660.A N ASP 657.A O no hydrogen 2.776 N/A GLN 663.A N ASP 660.A OD1 no hydrogen 3.476 N/A VAL 664.A N ASP 660.A O no hydrogen 3.003 N/A ALA 665.A N ASP 661.A O no hydrogen 2.912 N/A THR 666.A N ARG 662.A O no hydrogen 2.967 N/A THR 666.A OG1 ARG 662.A O no hydrogen 2.419 N/A TRP 667.A N GLN 663.A O no hydrogen 2.985 N/A ILE 668.A N VAL 664.A O no hydrogen 2.930 N/A GLU 669.A N ALA 665.A O no hydrogen 2.988 N/A GLU 670.A N THR 666.A O no hydrogen 3.165 N/A ASN 671.A N ILE 668.A O no hydrogen 2.868 N/A ASN 671.A ND2 TRP 667.A O no hydrogen 2.663 N/A LEU 675.A N ASN 671.A O no hydrogen 2.796 N/A ASP 676.A N TYR 672.A O no hydrogen 2.706 N/A ASP 677.A N LYS 673.A O no hydrogen 2.962 N/A LYS 678.A N THR 674.A O no hydrogen 3.083 N/A LYS 678.A N LEU 675.A O no hydrogen 2.959 N/A LEU 679.A N LEU 675.A O no hydrogen 3.126 N/A LYS 680.A N ASP 676.A O no hydrogen 3.182 N/A LYS 680.A NZ ASP 676.A OD2 no hydrogen 3.379 N/A GLY 681.A N ASP 677.A O no hydrogen 3.177 N/A GLY 681.A N LYS 678.A O no hydrogen 2.974 N/A LEU 682.A N LEU 679.A O no hydrogen 2.542 N/A SER 686.A OG SER 686.A O no hydrogen 2.504 N/A