Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2z3w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N VAL 13.A O no hydrogen 2.959 N/A GLN 6.A NE2 GLY 4.A O no hydrogen 2.912 N/A TRP 7.A NE1 GLN 365.A O no hydrogen 3.057 N/A MET 8.A N ASN 11.A O no hydrogen 2.755 N/A GLY 9.A N ALA 48.A O no hydrogen 2.800 N/A ASN 11.A N MET 8.A O no hydrogen 2.924 N/A ASN 11.A ND2 MET 8.A O no hydrogen 3.186 N/A TYR 12.A N ASN 23.A O no hydrogen 2.876 N/A VAL 13.A N GLN 6.A O no hydrogen 2.784 N/A PHE 14.A N VAL 21.A O no hydrogen 3.403 N/A ILE 15.A N VAL 3.A O no hydrogen 2.757 N/A GLU 16.A N ASP 19.A O no hydrogen 2.845 N/A ASP 18.A N GLU 16.A O no hydrogen 2.422 N/A ASP 19.A N GLU 16.A O no hydrogen 3.402 N/A LEU 20.A N PHE 28.A O no hydrogen 2.694 N/A VAL 21.A N PHE 14.A O no hydrogen 2.909 N/A PHE 22.A N THR 26.A O no hydrogen 2.792 N/A ASN 23.A N TYR 12.A O no hydrogen 3.145 N/A THR 26.A N PHE 22.A O no hydrogen 2.986 N/A ARG 27.A NH1 GLU 16.A OE1 no hydrogen 2.667 N/A ARG 27.A NH1 ASP 19.A OD2 no hydrogen 2.598 N/A ARG 27.A NH2 GLU 16.A OE1 no hydrogen 2.893 N/A PHE 28.A N LEU 20.A O no hydrogen 2.899 N/A SER 29.A N ASP 32.A OD2 no hydrogen 3.086 N/A ALA 30.A N ASP 18.A O no hydrogen 2.906 N/A ALA 31.A N SER 29.A OG no hydrogen 3.105 N/A LEU 33.A N SER 29.A O no hydrogen 3.041 N/A ASN 34.A N ALA 30.A O no hydrogen 2.887 N/A ALA 35.A N ALA 31.A O no hydrogen 3.098 N/A LEU 36.A N LEU 33.A O no hydrogen 2.889 N/A MET 37.A N LEU 33.A O no hydrogen 3.294 N/A MET 37.A N ASN 34.A O no hydrogen 3.333 N/A PHE 40.A N GLY 17.A O no hydrogen 2.377 N/A ARG 44.A N VAL 54.A O no hydrogen 2.870 N/A THR 45.A OG1 GLN 6.A OE1 no hydrogen 2.435 N/A LEU 46.A N LEU 52.A O no hydrogen 2.662 N/A ASP 47.A N LEU 52.A O no hydrogen 3.075 N/A ARG 50.A N ASP 47.A OD1 no hydrogen 3.150 N/A GLY 51.A N ALA 48.A O no hydrogen 3.127 N/A LEU 52.A N ASP 47.A O no hydrogen 2.944 N/A VAL 53.A N PHE 64.A O no hydrogen 2.933 N/A VAL 54.A N ARG 44.A O no hydrogen 2.810 N/A LEU 55.A N VAL 62.A O no hydrogen 2.769 N/A THR 57.A N GLY 60.A O no hydrogen 3.202 N/A THR 57.A OG1 GLN 58.A O no hydrogen 2.932 N/A THR 57.A OG1 GLY 60.A O no hydrogen 2.924 N/A LEU 61.A N PHE 75.A O no hydrogen 3.058 N/A VAL 62.A N LEU 55.A O no hydrogen 2.985 N/A GLY 63.A N TYR 73.A O no hydrogen 2.662 N/A PHE 64.A N VAL 53.A O no hydrogen 2.840 N/A ASP 65.A N LYS 70.A O no hydrogen 2.767 N/A MET 66.A N GLY 51.A O no hydrogen 2.886 N/A LEU 67.A N ASP 65.A OD1 no hydrogen 2.883 N/A ALA 68.A N ASP 65.A OD1 no hydrogen 2.915 N/A ARG 69.A NH2 ARG 27.A O no hydrogen 3.301 N/A LYS 70.A N ASP 65.A O no hydrogen 3.166 N/A THR 72.A N GLY 63.A O no hydrogen 2.873 N/A TYR 73.A N THR 72.A OG1 no hydrogen 2.717 N/A LEU 74.A N GLY 107.A O no hydrogen 2.894 N/A PHE 75.A N LEU 61.A O no hydrogen 2.805 N/A THR 77.A OG1 GLU 80.A O no hydrogen 2.705 N/A ASN 78.A N ASP 76.A OD1 no hydrogen 3.251 N/A GLU 80.A N THR 77.A O no hydrogen 2.942 N/A SER 83.A N GLU 80.A OE2 no hydrogen 2.983 N/A SER 83.A OG GLU 80.A OE2 no hydrogen 2.723 N/A SER 83.A OG VAL 96.A O no hydrogen 3.511 N/A LEU 84.A N THR 81.A O no hydrogen 3.512 N/A ASP 85.A N ALA 94.A O no hydrogen 2.917 N/A SER 87.A N ARG 92.A O no hydrogen 2.807 N/A VAL 89.A N SER 87.A OG no hydrogen 3.035 N/A GLY 90.A N SER 87.A O no hydrogen 2.893 N/A VAL 93.A N ALA 104.A O no hydrogen 2.811 N/A ALA 94.A N ASP 85.A O no hydrogen 2.798 N/A TYR 95.A N TYR 102.A O no hydrogen 3.027 N/A VAL 96.A N SER 83.A OG no hydrogen 2.835 N/A ARG 97.A N ASN 100.A O no hydrogen 2.888 N/A ASN 100.A N ARG 97.A O no hydrogen 3.187 N/A LEU 101.A N THR 120.A OG1 no hydrogen 2.986 N/A TYR 102.A N TYR 95.A O no hydrogen 2.887 N/A ILE 103.A N ILE 117.A O no hydrogen 2.892 N/A ALA 104.A N VAL 93.A O no hydrogen 2.805 N/A GLY 106.A N ASP 91.A O no hydrogen 2.814 N/A GLY 107.A N LEU 74.A O no hydrogen 2.856 N/A GLU 111.A N LYS 108.A O no hydrogen 2.780 N/A ILE 117.A N ILE 103.A O no hydrogen 2.824 N/A VAL 119.A N LEU 101.A O no hydrogen 2.744 N/A THR 120.A N LEU 101.A O no hydrogen 3.356 N/A THR 120.A OG1 ASN 100.A OD1 no hydrogen 2.838 N/A GLY 123.A N ASN 100.A OD1 no hydrogen 2.958 N/A THR 124.A N LEU 127.A O no hydrogen 2.965 N/A LEU 127.A N THR 124.A O no hydrogen 3.093 N/A VAL 128.A N MET 158.A O no hydrogen 2.882 N/A TYR 129.A OH ASP 122.A OD1 no hydrogen 2.589 N/A GLY 130.A N TYR 156.A O no hydrogen 2.961 N/A HIS 134.A ND1 HIS 191.A NE2 no hydrogen 3.004 N/A ARG 136.A N VAL 133.A O no hydrogen 3.007 N/A GLU 137.A N HIS 134.A O no hydrogen 3.034 N/A ILE 140.A N GLU 137.A O no hydrogen 3.071 N/A LYS 142.A NZ ASP 85.A OD2 no hydrogen 3.096 N/A LYS 142.A NZ THR 144.A O no hydrogen 2.944 N/A THR 144.A OG1 ASP 85.A OD2 no hydrogen 2.550 N/A PHE 145.A N ALA 154.A O no hydrogen 2.823 N/A TRP 146.A NE1 ASP 85.A O no hydrogen 2.879 N/A SER 147.A N CYS 152.A O no hydrogen 2.835 N/A SER 147.A OG CYS 152.A O no hydrogen 3.177 N/A SER 147.A OG GLU 227.A OE2 no hydrogen 2.642 N/A LYS 149.A N GLU 227.A OE2 no hydrogen 2.723 N/A GLY 150.A N SER 147.A O no hydrogen 2.945 N/A SER 151.A N GLU 227.A OE2 no hydrogen 3.255 N/A SER 151.A OG GLU 227.A OE1 no hydrogen 2.585 N/A SER 151.A OG GLU 227.A OE2 no hydrogen 3.249 N/A CYS 152.A N SER 147.A OG no hydrogen 2.788 N/A CYS 152.A SG HIS 199.A ND1 no hydrogen 3.390 N/A LEU 153.A N TYR 198.A O no hydrogen 2.889 N/A ALA 154.A N PHE 145.A O no hydrogen 2.857 N/A PHE 155.A N GLY 196.A O no hydrogen 2.868 N/A TYR 156.A N GLY 143.A O no hydrogen 3.118 N/A TYR 156.A OH LEU 218.A O no hydrogen 2.670 N/A ARG 157.A N THR 194.A O no hydrogen 2.883 N/A ARG 157.A NE TYR 129.A OH no hydrogen 3.315 N/A MET 158.A N VAL 128.A O no hydrogen 2.836 N/A ASP 159.A N HIS 192.A O no hydrogen 2.828 N/A GLN 160.A N THR 126.A O no hydrogen 2.826 N/A GLN 160.A NE2 GLU 125.A O no hydrogen 2.926 N/A SER 161.A N ASP 159.A OD1 no hydrogen 2.913 N/A SER 161.A OG ASP 159.A OD1 no hydrogen 2.715 N/A VAL 163.A N GLN 160.A O no hydrogen 3.079 N/A THR 166.A N LEU 181.A O no hydrogen 2.820 N/A ILE 168.A N LYS 179.A O no hydrogen 2.866 N/A ASP 170.A N GLU 177.A O no hydrogen 2.777 N/A HIS 172.A N ASP 170.A OD1 no hydrogen 3.104 N/A HIS 172.A NE2 SER 630.A OG no hydrogen 2.694 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.831 N/A GLU 177.A N ASP 170.A O no hydrogen 2.914 N/A LYS 179.A N ILE 168.A O no hydrogen 2.920 N/A LEU 181.A N THR 166.A O no hydrogen 2.724 N/A TYR 182.A OH GLU 125.A OE2 no hydrogen 2.435 N/A TYR 183.A N LEU 181.A O no hydrogen 2.848 N/A TYR 183.A OH VAL 603.A O no hydrogen 2.840 N/A ALA 186.A N TYR 558.A O no hydrogen 2.799 N/A GLY 187.A N GLU 564.A OE2 no hydrogen 2.748 N/A THR 188.A N MET 185.A O no hydrogen 2.962 N/A THR 188.A OG1 MET 185.A O no hydrogen 2.599 N/A SER 190.A N GLU 215.A OE2 no hydrogen 2.869 N/A HIS 191.A NE2 HIS 134.A ND1 no hydrogen 3.004 N/A HIS 192.A N ASP 159.A O no hydrogen 2.936 N/A THR 194.A N ARG 157.A O no hydrogen 2.811 N/A GLY 196.A N PHE 155.A O no hydrogen 2.842 N/A ILE 197.A N VAL 206.A O no hydrogen 2.717 N/A TYR 198.A N LEU 153.A O no hydrogen 2.815 N/A HIS 199.A N LYS 204.A O no hydrogen 2.830 N/A HIS 199.A NE2 ALA 249.A O no hydrogen 2.734 N/A LEU 200.A N SER 151.A O no hydrogen 3.030 N/A THR 202.A N HIS 199.A O no hydrogen 3.357 N/A GLY 203.A N HIS 199.A O no hydrogen 2.792 N/A LYS 204.A N THR 202.A OG1 no hydrogen 3.130 N/A VAL 206.A N ILE 197.A O no hydrogen 2.996 N/A LEU 208.A N VAL 195.A O no hydrogen 2.917 N/A GLN 209.A N GLY 252.A O no hydrogen 2.779 N/A LYS 216.A N PRO 213.A O no hydrogen 3.126 N/A LYS 216.A NZ THR 210.A O no hydrogen 2.823 N/A LYS 216.A NZ GLU 212.A O no hydrogen 3.006 N/A PHE 217.A N VAL 235.A O no hydrogen 2.934 N/A LEU 218.A N HIS 134.A NE2 no hydrogen 3.029 N/A THR 219.A N ALA 233.A O no hydrogen 2.954 N/A THR 219.A OG1 ALA 233.A O no hydrogen 2.728 N/A ASN 220.A ND2 PHE 138.A O no hydrogen 3.237 N/A ASN 220.A ND2 THR 219.A OG1 no hydrogen 2.985 N/A SER 222.A N TYR 231.A O no hydrogen 2.903 N/A SER 222.A OG ASN 220.A O no hydrogen 2.858 N/A TRP 223.A NE1 PHE 145.A O no hydrogen 3.010 N/A SER 224.A N ILE 229.A O no hydrogen 2.818 N/A SER 224.A OG ASP 226.A OD1 no hydrogen 2.637 N/A SER 224.A OG ILE 229.A O no hydrogen 3.249 N/A ASP 226.A N ASN 280.A OD1 no hydrogen 3.068 N/A GLU 227.A N SER 224.A O no hydrogen 2.907 N/A ASN 228.A N ASP 226.A OD1 no hydrogen 2.970 N/A ASN 228.A ND2 ASP 226.A OD2 no hydrogen 3.000 N/A ILE 229.A N SER 224.A OG no hydrogen 3.115 N/A LEU 230.A N TYR 247.A O no hydrogen 2.984 N/A TYR 231.A N SER 222.A O no hydrogen 2.793 N/A VAL 232.A N ASN 245.A O no hydrogen 2.967 N/A ALA 233.A N THR 219.A O no hydrogen 2.872 N/A GLU 234.A N LYS 243.A O no hydrogen 2.815 N/A VAL 235.A N PHE 217.A O no hydrogen 2.873 N/A ASN 236.A N GLU 241.A O no hydrogen 3.297 N/A ASN 236.A ND2 ASN 240.A OD1 no hydrogen 2.949 N/A ARG 237.A NE GLU 564.A OE1 no hydrogen 2.856 N/A ARG 237.A NH1 THR 188.A O no hydrogen 3.018 N/A ARG 237.A NH1 GLU 215.A OE1 no hydrogen 2.869 N/A ARG 237.A NH2 THR 188.A O no hydrogen 2.833 N/A ARG 237.A NH2 GLU 564.A OE2 no hydrogen 2.826 N/A GLN 239.A N ASN 236.A O no hydrogen 2.928 N/A GLN 239.A NE2 MET 561.A O no hydrogen 2.927 N/A ASN 240.A N ASN 236.A OD1 no hydrogen 3.104 N/A GLU 241.A N ASN 236.A OD1 no hydrogen 3.176 N/A CYS 242.A N GLU 261.A O no hydrogen 2.859 N/A LYS 243.A N GLU 234.A O no hydrogen 2.871 N/A VAL 244.A N PHE 259.A O no hydrogen 2.933 N/A ASN 245.A N VAL 232.A O no hydrogen 2.884 N/A ASN 245.A ND2 GLU 234.A OE2 no hydrogen 3.131 N/A ALA 246.A N ARG 256.A O no hydrogen 2.791 N/A TYR 247.A N LEU 230.A O no hydrogen 3.072 N/A TYR 247.A OH GLU 234.A OE2 no hydrogen 2.560 N/A ASP 248.A N ARG 253.A O no hydrogen 2.753 N/A ALA 249.A N ASN 228.A O no hydrogen 2.900 N/A THR 251.A N ASP 248.A OD2 no hydrogen 2.756 N/A THR 251.A OG1 ASP 248.A OD2 no hydrogen 2.880 N/A GLY 252.A N ASP 248.A O no hydrogen 2.758 N/A ARG 253.A N THR 251.A OG1 no hydrogen 3.111 N/A VAL 255.A N ALA 246.A O no hydrogen 2.785 N/A ARG 256.A N ALA 246.A O no hydrogen 3.360 N/A ARG 256.A NE THR 300.A O no hydrogen 3.456 N/A THR 257.A OG1 ASN 245.A OD1 no hydrogen 2.590 N/A LEU 258.A N VAL 244.A O no hydrogen 2.701 N/A GLU 261.A N CYS 242.A O no hydrogen 2.820 N/A ASP 263.A N ASN 240.A O no hydrogen 3.211 N/A HIS 265.A N ASP 263.A OD2 no hydrogen 2.860 N/A HIS 265.A ND1 HIS 491.A ND1 no hydrogen 3.090 N/A TYR 266.A N ASP 263.A OD2 no hydrogen 2.906 N/A TYR 266.A OH GLU 487.A OE2 no hydrogen 2.597 N/A VAL 267.A N GLN 239.A O no hydrogen 2.844 N/A LEU 273.A N SER 222.A OG no hydrogen 2.931 N/A THR 274.A N ILE 284.A O no hydrogen 3.022 N/A LEU 276.A N GLN 282.A O no hydrogen 2.996 N/A SER 279.A N LEU 276.A O no hydrogen 3.111 N/A ASN 281.A N SER 279.A OG no hydrogen 3.150 N/A GLN 282.A N SER 279.A OG no hydrogen 3.169 N/A PHE 283.A N TYR 298.A O no hydrogen 2.885 N/A ILE 284.A N THR 274.A O no hydrogen 2.870 N/A TRP 285.A N TYR 296.A O no hydrogen 2.848 N/A TRP 285.A NE1 GLU 261.A OE2 no hydrogen 2.652 N/A SER 287.A N HIS 294.A O no hydrogen 2.937 N/A SER 287.A OG GLU 261.A OE1 no hydrogen 3.126 N/A SER 287.A OG GLU 261.A OE2 no hydrogen 2.864 N/A ARG 288.A NE GLU 314.A OE2 no hydrogen 2.856 N/A ARG 288.A NH1 GLU 487.A OE1 no hydrogen 2.855 N/A ARG 288.A NH2 GLU 314.A OE1 no hydrogen 2.807 N/A ARG 288.A NH2 GLU 314.A OE2 no hydrogen 3.453 N/A ARG 289.A N SER 287.A OG no hydrogen 3.123 N/A ARG 289.A NE SER 287.A OG no hydrogen 3.070 N/A ARG 289.A NH1 TYR 298.A OH no hydrogen 2.901 N/A ARG 289.A NH2 GLU 261.A OE2 no hydrogen 2.814 N/A ARG 289.A NH2 TYR 298.A OH no hydrogen 2.971 N/A GLY 291.A N ARG 288.A O no hydrogen 2.894 N/A TRP 292.A N ASP 290.A OD1 no hydrogen 3.068 N/A ASN 293.A N GLU 314.A OE2 no hydrogen 2.887 N/A ASN 293.A ND2 GLN 286.A OE1 no hydrogen 2.928 N/A ASN 293.A ND2 VAL 315.A O no hydrogen 2.946 N/A HIS 294.A N SER 287.A O no hydrogen 2.879 N/A HIS 294.A ND1 THR 309.A OG1 no hydrogen 2.750 N/A HIS 294.A NE2 GLY 311.A O no hydrogen 2.924 N/A LEU 295.A N THR 309.A OG1 no hydrogen 2.913 N/A TYR 296.A N TRP 285.A O no hydrogen 2.735 N/A LEU 297.A N ARG 306.A O no hydrogen 2.850 N/A TYR 298.A N PHE 283.A O no hydrogen 2.941 N/A ASP 299.A N ARG 303.A O no hydrogen 3.028 N/A THR 300.A N ASN 281.A O no hydrogen 2.922 N/A THR 301.A N ASP 299.A OD1 no hydrogen 2.757 N/A THR 301.A OG1 ASP 299.A OD1 no hydrogen 2.598 N/A GLY 302.A N ASP 299.A O no hydrogen 2.870 N/A ARG 303.A N ASP 299.A OD1 no hydrogen 3.372 N/A ARG 303.A N THR 301.A OG1 no hydrogen 3.327 N/A ARG 303.A NH1 ASP 299.A OD2 no hydrogen 3.053 N/A ILE 305.A N LEU 297.A O no hydrogen 2.713 N/A ARG 306.A N LEU 297.A O no hydrogen 3.330 N/A ARG 306.A NH1 ILE 347.A O no hydrogen 2.974 N/A GLN 307.A NE2 ASP 290.A OD2 no hydrogen 2.953 N/A GLN 307.A NE2 THR 309.A O no hydrogen 2.923 N/A VAL 308.A N LEU 295.A O no hydrogen 2.825 N/A THR 309.A N LEU 295.A O no hydrogen 3.421 N/A THR 309.A OG1 HIS 294.A ND1 no hydrogen 2.750 N/A GLU 314.A N THR 333.A OG1 no hydrogen 2.890 N/A VAL 315.A N ASN 293.A O no hydrogen 2.804 N/A THR 316.A N GLU 331.A O no hydrogen 2.782 N/A THR 316.A OG1 GLU 331.A OE2 no hydrogen 2.595 N/A ASN 317.A N GLU 331.A O no hydrogen 3.329 N/A ALA 319.A N TYR 329.A O no hydrogen 2.788 N/A GLY 320.A N TYR 329.A O no hydrogen 3.206 N/A ASP 322.A N ARG 327.A O no hydrogen 3.349 N/A GLY 325.A N ASP 322.A O no hydrogen 2.850 N/A THR 326.A N ASP 322.A OD1 no hydrogen 2.543 N/A THR 326.A OG1 ASP 322.A OD2 no hydrogen 2.682 N/A ARG 327.A N ASP 322.A OD1 no hydrogen 2.894 N/A LEU 328.A N ILE 345.A O no hydrogen 2.803 N/A TYR 329.A N GLY 320.A O no hydrogen 2.853 N/A PHE 330.A N TYR 343.A O no hydrogen 3.075 N/A GLU 331.A N ASN 317.A O no hydrogen 2.780 N/A SER 332.A N HIS 341.A O no hydrogen 3.025 N/A THR 333.A N GLU 314.A O no hydrogen 3.080 N/A THR 333.A OG1 GLU 314.A O no hydrogen 3.549 N/A GLU 334.A N SER 332.A OG no hydrogen 3.119 N/A ALA 335.A N TYR 343.A OH no hydrogen 3.060 N/A LEU 338.A N SER 336.A OG no hydrogen 3.012 N/A GLU 339.A N SER 336.A O no hydrogen 3.021 N/A ARG 340.A N GLY 360.A O no hydrogen 3.286 N/A ARG 340.A NH1 PRO 337.A O no hydrogen 2.935 N/A ARG 340.A NH1 GLU 339.A O no hydrogen 2.817 N/A ARG 340.A NH2 GLN 450.A OE1 no hydrogen 2.679 N/A HIS 341.A N SER 332.A O no hydrogen 3.298 N/A HIS 341.A ND1 ASP 354.A OD2 no hydrogen 2.626 N/A HIS 341.A NE2 GLU 339.A OE1 no hydrogen 2.696 N/A PHE 342.A N THR 356.A OG1 no hydrogen 2.792 N/A TYR 343.A N PHE 330.A O no hydrogen 2.714 N/A CYS 344.A N LYS 353.A O no hydrogen 2.948 N/A ILE 345.A N LEU 328.A O no hydrogen 2.942 N/A ILE 347.A N THR 326.A O no hydrogen 2.776 N/A LYS 348.A N ASP 346.A OD1 no hydrogen 2.803 N/A GLY 349.A N ASP 346.A O no hydrogen 2.695 N/A THR 352.A OG1 GLU 334.A OE1 no hydrogen 2.600 N/A THR 352.A OG1 GLU 334.A OE2 no hydrogen 3.264 N/A LYS 353.A N CYS 344.A O no hydrogen 2.857 N/A LEU 355.A N PHE 342.A O no hydrogen 2.712 N/A THR 356.A N ASP 354.A OD1 no hydrogen 2.786 N/A SER 359.A OG GLU 339.A OE1 no hydrogen 3.298 N/A SER 359.A OG GLU 339.A OE2 no hydrogen 2.877 N/A GLY 360.A N GLU 339.A OE1 no hydrogen 3.070 N/A MET 361.A N GLN 378.A O no hydrogen 2.845 N/A HIS 362.A N ARG 340.A O no hydrogen 2.970 N/A HIS 362.A ND1 ASP 375.A OD2 no hydrogen 2.711 N/A HIS 362.A NE2 GLU 358.A O no hydrogen 2.622 N/A ARG 363.A N ILE 376.A O no hydrogen 2.857 N/A THR 364.A OG1 ASP 375.A OD1 no hydrogen 2.756 N/A GLN 365.A N ILE 374.A O no hydrogen 2.778 N/A GLN 365.A NE2 LEU 5.A O no hydrogen 2.954 N/A SER 367.A N ALA 372.A O no hydrogen 2.710 N/A SER 367.A OG ASP 369.A OD1 no hydrogen 2.896 N/A SER 367.A OG ALA 372.A O no hydrogen 3.191 N/A GLY 370.A N SER 367.A O no hydrogen 2.775 N/A SER 371.A N SER 367.A OG no hydrogen 3.244 N/A SER 371.A N ASP 369.A OD1 no hydrogen 2.943 N/A SER 371.A OG ASP 369.A OD1 no hydrogen 2.742 N/A ALA 372.A N SER 367.A OG no hydrogen 3.016 N/A ILE 373.A N THR 389.A O no hydrogen 2.976 N/A ILE 374.A N GLN 365.A O no hydrogen 2.877 N/A ASP 375.A N THR 387.A O no hydrogen 2.849 N/A ILE 376.A N ARG 363.A O no hydrogen 2.926 N/A PHE 377.A N LYS 385.A O no hydrogen 2.852 N/A GLN 378.A N MET 361.A O no hydrogen 3.043 N/A SER 379.A N VAL 382.A O no hydrogen 2.851 N/A SER 379.A OG THR 381.A OG1 no hydrogen 3.273 N/A THR 381.A OG1 SER 379.A OG no hydrogen 3.273 N/A VAL 382.A N SER 379.A O no hydrogen 3.102 N/A VAL 382.A N SER 379.A OG no hydrogen 2.927 N/A ARG 384.A NE PRO 383.A O no hydrogen 3.449 N/A LYS 385.A N PHE 377.A O no hydrogen 2.866 N/A VAL 386.A N LEU 399.A O no hydrogen 2.910 N/A THR 387.A N ASP 375.A O no hydrogen 2.838 N/A VAL 388.A N HIS 396.A O no hydrogen 3.006 N/A THR 389.A N ILE 373.A O no hydrogen 2.854 N/A THR 389.A OG1 SER 395.A OG no hydrogen 2.791 N/A ILE 391.A N SER 371.A O no hydrogen 2.901 N/A SER 395.A OG THR 389.A OG1 no hydrogen 2.791 N/A HIS 396.A N VAL 388.A O no hydrogen 3.061 N/A LEU 398.A N VAL 386.A O no hydrogen 2.699 N/A LEU 399.A N VAL 386.A O no hydrogen 3.354 N/A ALA 401.A N ARG 384.A O no hydrogen 2.833 N/A ARG 408.A N LEU 425.A O no hydrogen 2.786 N/A ARG 408.A NE GLU 406.A OE1 no hydrogen 3.477 N/A ARG 408.A NE GLU 406.A OE2 no hydrogen 2.842 N/A ARG 408.A NH2 GLU 406.A OE1 no hydrogen 3.502 N/A GLY 410.A N TYR 423.A O no hydrogen 3.234 N/A ILE 412.A N LEU 421.A O no hydrogen 2.908 N/A ALA 414.A N THR 419.A O no hydrogen 2.734 N/A ALA 415.A N ASP 501.A OD1 no hydrogen 2.893 N/A GLY 417.A N ALA 414.A O no hydrogen 2.946 N/A GLN 418.A N ASP 416.A OD1 no hydrogen 2.805 N/A THR 419.A N ASP 416.A OD1 no hydrogen 2.759 N/A THR 419.A OG1 ASP 416.A OD1 no hydrogen 3.410 N/A THR 419.A OG1 ASP 416.A OD2 no hydrogen 2.406 N/A LEU 421.A N ILE 412.A O no hydrogen 2.769 N/A TYR 423.A N GLY 410.A O no hydrogen 2.917 N/A LYS 424.A N THR 473.A O no hydrogen 2.921 N/A LYS 424.A NZ LEU 451.A O no hydrogen 2.684 N/A LEU 425.A N ARG 408.A O no hydrogen 2.768 N/A THR 426.A N VAL 471.A O no hydrogen 2.789 N/A THR 426.A OG1 ASP 461.A OD2 no hydrogen 2.838 N/A MET 427.A N GLU 406.A O no hydrogen 2.816 N/A LEU 429.A N ALA 465.A O no hydrogen 2.930 N/A PHE 431.A N PRO 428.A O no hydrogen 3.044 N/A ASP 432.A N TYR 437.A OH no hydrogen 2.802 N/A ALA 434.A N ASP 432.A OD1 no hydrogen 3.087 N/A LYS 435.A N ASP 432.A O no hydrogen 2.811 N/A LYS 436.A NZ SER 513.A O no hydrogen 3.475 N/A LYS 436.A NZ VAL 515.A O no hydrogen 3.121 N/A TYR 437.A N TRP 514.A O no hydrogen 2.788 N/A VAL 439.A N ARG 519.A O no hydrogen 3.080 N/A ILE 440.A N ALA 470.A O no hydrogen 2.799 N/A VAL 441.A N GLY 521.A O no hydrogen 2.874 N/A TYR 442.A N PHE 472.A O no hydrogen 2.848 N/A VAL 443.A N HIS 523.A O no hydrogen 2.867 N/A GLN 450.A NE2 PRO 337.A O no hydrogen 2.794 N/A LEU 451.A N ASP 475.A OD1 no hydrogen 2.787 N/A VAL 452.A N ASP 475.A OD2 no hydrogen 2.765 N/A LYS 454.A N LEU 338.A O no hydrogen 2.781 N/A LYS 454.A NZ SER 359.A OG no hydrogen 2.943 N/A THR 455.A N THR 453.A O no hydrogen 2.861 N/A TRP 456.A N GLN 378.A OE1 no hydrogen 3.059 N/A TYR 463.A N GLY 459.A O no hydrogen 3.194 N/A TYR 463.A OH GLU 645.A OE1 no hydrogen 2.728 N/A MET 464.A N TRP 460.A O no hydrogen 2.911 N/A ALA 465.A N ASP 461.A O no hydrogen 2.934 N/A GLN 466.A N ILE 462.A O no hydrogen 2.944 N/A LYS 467.A N MET 464.A O no hydrogen 2.973 N/A GLY 468.A N ALA 465.A O no hydrogen 2.995 N/A TYR 469.A N MET 464.A O no hydrogen 3.161 N/A TYR 469.A OH LEU 655.A OXT no hydrogen 2.648 N/A ALA 470.A N PRO 438.A O no hydrogen 3.058 N/A VAL 471.A N THR 426.A O no hydrogen 2.887 N/A PHE 472.A N ILE 440.A O no hydrogen 2.933 N/A THR 473.A N LYS 424.A O no hydrogen 2.890 N/A THR 473.A OG1 TYR 442.A O no hydrogen 2.821 N/A ASP 475.A N TYR 422.A O no hydrogen 3.177 N/A ARG 477.A N ASP 501.A OD2 no hydrogen 2.946 N/A ARG 477.A NE ASP 501.A OD2 no hydrogen 2.799 N/A ARG 477.A NH2 ASP 501.A OD1 no hydrogen 2.843 N/A GLY 478.A N PHE 486.A O no hydrogen 2.991 N/A SER 479.A N SER 476.A O no hydrogen 3.103 N/A SER 479.A OG SER 476.A O no hydrogen 2.640 N/A ALA 480.A N ALA 449.A O no hydrogen 3.054 N/A ARG 482.A NH1 PRO 420.A O no hydrogen 2.939 N/A ARG 482.A NH2 PRO 420.A O no hydrogen 2.836 N/A GLY 483.A N GLU 314.A OE1 no hydrogen 2.809 N/A ALA 484.A N GLY 291.A O no hydrogen 2.828 N/A GLU 487.A N GLY 483.A O no hydrogen 3.380 N/A GLN 488.A N ALA 484.A O no hydrogen 2.619 N/A GLN 488.A NE2 ASP 263.A OD2 no hydrogen 3.180 N/A GLN 488.A NE2 TYR 266.A O no hydrogen 3.501 N/A ILE 490.A N GLU 487.A O no hydrogen 3.369 N/A HIS 491.A N GLN 488.A O no hydrogen 2.965 N/A HIS 491.A NE2 ASP 568.A OD1 no hydrogen 2.930 N/A ARG 492.A N TYR 566.A O no hydrogen 2.796 N/A ARG 492.A NH1 ASP 568.A OD2 no hydrogen 2.818 N/A ARG 492.A NH1 GLU 572.A O no hydrogen 3.250 N/A ARG 492.A NH2 GLU 572.A O no hydrogen 2.934 N/A ARG 493.A N ILE 490.A O no hydrogen 2.805 N/A ARG 493.A NE VAL 489.A O no hydrogen 3.420 N/A ARG 493.A NH2 VAL 489.A O no hydrogen 3.176 N/A ARG 493.A NH2 THR 497.A OG1 no hydrogen 2.207 N/A GLY 495.A N GLU 498.A OE2 no hydrogen 2.771 N/A GLN 496.A N ARG 493.A O no hydrogen 3.116 N/A GLU 498.A N GLU 498.A OE1 no hydrogen 2.706 N/A MET 499.A N GLY 495.A O no hydrogen 2.881 N/A ALA 500.A N GLN 496.A O no hydrogen 3.135 N/A ASP 501.A N THR 497.A O no hydrogen 2.848 N/A GLN 502.A N GLU 498.A O no hydrogen 2.930 N/A GLN 502.A NE2 VAL 474.A O no hydrogen 3.040 N/A GLN 502.A NE2 SER 476.A OG no hydrogen 2.691 N/A MET 503.A N MET 499.A O no hydrogen 2.806 N/A CYS 504.A N ALA 500.A O no hydrogen 3.243 N/A CYS 504.A SG MET 413.A O no hydrogen 3.754 N/A CYS 504.A SG ALA 500.A O no hydrogen 3.642 N/A GLY 505.A N ASP 501.A O no hydrogen 3.194 N/A VAL 506.A N GLN 502.A O no hydrogen 3.057 N/A ASP 507.A N MET 503.A O no hydrogen 2.866 N/A PHE 508.A N CYS 504.A O no hydrogen 3.034 N/A LEU 509.A N GLY 505.A O no hydrogen 2.932 N/A LYS 510.A N VAL 506.A O no hydrogen 2.805 N/A SER 511.A N ASP 507.A O no hydrogen 3.122 N/A SER 511.A N PHE 508.A O no hydrogen 3.206 N/A SER 511.A OG PHE 508.A O no hydrogen 2.770 N/A SER 511.A OG GLN 512.A OE1 no hydrogen 3.472 N/A GLN 512.A N LEU 509.A O no hydrogen 2.919 N/A VAL 515.A N GLN 512.A O no hydrogen 3.271 N/A ASP 516.A N TYR 437.A O no hydrogen 2.916 N/A ASP 518.A N ASP 516.A OD1 no hydrogen 2.930 N/A ARG 519.A N ASP 516.A O no hydrogen 2.943 N/A ARG 519.A NE LEU 655.A O no hydrogen 2.842 N/A ARG 519.A NH2 LEU 655.A O no hydrogen 3.464 N/A ARG 519.A NH2 LEU 655.A OXT no hydrogen 2.769 N/A GLY 521.A N VAL 439.A O no hydrogen 2.827 N/A VAL 522.A N VAL 545.A O no hydrogen 3.010 N/A HIS 523.A N VAL 441.A O no hydrogen 2.870 N/A HIS 523.A ND1 VAL 547.A O no hydrogen 2.691 N/A GLY 524.A N VAL 547.A O no hydrogen 3.337 N/A TRP 525.A NE1 HIS 633.A O no hydrogen 2.852 N/A SER 526.A N GLY 549.A O no hydrogen 2.904 N/A SER 526.A OG HIS 633.A NE2 no hydrogen 2.666 N/A TYR 527.A OH GLU 498.A OE2 no hydrogen 2.524 N/A GLY 528.A N TRP 525.A O no hydrogen 2.835 N/A GLY 529.A N SER 526.A O no hydrogen 2.869 N/A PHE 530.A N SER 526.A O no hydrogen 2.993 N/A MET 531.A N TYR 527.A O no hydrogen 2.850 N/A THR 532.A N GLY 528.A O no hydrogen 2.803 N/A THR 532.A OG1 GLY 528.A O no hydrogen 2.769 N/A THR 533.A N GLY 529.A O no hydrogen 3.054 N/A THR 533.A OG1 GLY 529.A O no hydrogen 2.927 N/A ASN 534.A N PHE 530.A O no hydrogen 2.864 N/A LEU 535.A N MET 531.A O no hydrogen 2.903 N/A MET 536.A N THR 532.A O no hydrogen 3.104 N/A LEU 537.A N THR 533.A O no hydrogen 3.011 N/A THR 538.A N ASN 534.A O no hydrogen 2.747 N/A THR 538.A OG1 ASN 534.A O no hydrogen 2.699 N/A THR 538.A OG1 ASN 534.A OD1 no hydrogen 3.025 N/A HIS 539.A N LEU 535.A O no hydrogen 2.743 N/A VAL 542.A N HIS 539.A O no hydrogen 2.965 N/A PHE 543.A N HIS 539.A O no hydrogen 3.184 N/A LYS 544.A N ILE 520.A O no hydrogen 2.982 N/A LYS 544.A NZ ASP 541.A O no hydrogen 3.015 N/A GLY 546.A N ARG 592.A O no hydrogen 2.863 N/A VAL 547.A N VAL 522.A O no hydrogen 3.081 N/A ALA 548.A N MET 594.A O no hydrogen 2.857 N/A GLY 549.A N GLY 524.A O no hydrogen 3.072 N/A GLY 550.A N ILE 596.A O no hydrogen 2.752 N/A ASN 556.A N ASP 554.A OD1 no hydrogen 2.951 N/A ASN 556.A ND2 ASN 556.A O no hydrogen 2.782 N/A ARG 557.A N ASP 554.A O no hydrogen 2.913 N/A ARG 557.A NH1 ASP 554.A OD2 no hydrogen 2.770 N/A TYR 558.A N TRP 555.A O no hydrogen 3.134 N/A ILE 560.A N PRO 184.A O no hydrogen 2.911 N/A GLY 563.A N ALA 559.A O no hydrogen 2.958 N/A GLU 564.A N ILE 560.A O no hydrogen 3.094 N/A ARG 565.A N TYR 562.A O no hydrogen 3.240 N/A ARG 565.A NE GLN 239.A OE1 no hydrogen 3.281 N/A ARG 565.A NH1 GLU 137.A OE1 no hydrogen 2.672 N/A ARG 565.A NH1 TYR 566.A OH no hydrogen 3.025 N/A ARG 565.A NH2 GLU 137.A OE1 no hydrogen 2.764 N/A ARG 565.A NH2 GLN 239.A OE1 no hydrogen 3.301 N/A PHE 567.A N GLY 563.A O no hydrogen 2.820 N/A ALA 569.A N GLU 572.A OE1 no hydrogen 2.931 N/A GLN 571.A N GLN 571.A OE1 no hydrogen 2.688 N/A GLN 571.A NE2 GLY 187.A O no hydrogen 2.968 N/A GLU 572.A N ALA 569.A O no hydrogen 2.889 N/A ASN 573.A N PRO 570.A O no hydrogen 3.219 N/A ASN 573.A ND2 ARG 492.A O no hydrogen 2.906 N/A ASN 573.A ND2 PHE 567.A O no hydrogen 2.869 N/A GLY 576.A N ASN 573.A OD1 no hydrogen 3.101 N/A TYR 577.A N ASN 573.A O no hydrogen 3.068 N/A TYR 577.A OH ASP 568.A O no hydrogen 2.622 N/A ASP 578.A N PRO 574.A O no hydrogen 2.855 N/A ALA 579.A N GLU 575.A O no hydrogen 3.075 N/A ALA 580.A N GLY 576.A O no hydrogen 3.210 N/A ALA 580.A N TYR 577.A O no hydrogen 3.117 N/A ASN 581.A N ASP 578.A O no hydrogen 3.240 N/A LEU 582.A N ILE 553.A O no hydrogen 2.817 N/A LEU 583.A N ASN 581.A OD1 no hydrogen 2.979 N/A LYS 584.A N ASN 581.A O no hydrogen 3.128 N/A ARG 585.A N LEU 582.A O no hydrogen 3.139 N/A ARG 585.A NH1 ASN 534.A OD1 no hydrogen 3.451 N/A ARG 585.A NH1 THR 538.A OG1 no hydrogen 3.148 N/A ARG 585.A NH2 ASN 534.A OD1 no hydrogen 2.909 N/A ARG 585.A NH2 ALA 579.A O no hydrogen 2.889 N/A ASP 588.A N ARG 585.A O no hydrogen 2.921 N/A LEU 589.A N ALA 586.A O no hydrogen 3.134 N/A LYS 590.A NZ ASP 541.A OD1 no hydrogen 2.791 N/A ARG 592.A N LYS 544.A O no hydrogen 3.048 N/A ARG 592.A NH2 ASP 624.A OD2 no hydrogen 2.880 N/A MET 594.A N GLY 546.A O no hydrogen 3.063 N/A LEU 595.A N ASP 624.A O no hydrogen 2.943 N/A ILE 596.A N ALA 548.A O no hydrogen 2.987 N/A HIS 597.A N TYR 626.A O no hydrogen 3.069 N/A HIS 597.A ND1 SER 609.A OG no hydrogen 2.688 N/A HIS 597.A NE2 VAL 604.A O no hydrogen 2.790 N/A ALA 599.A N TYR 628.A O no hydrogen 2.993 N/A ILE 600.A N HIS 631.A O no hydrogen 3.229 N/A ASP 601.A N GLY 598.A O no hydrogen 3.196 N/A VAL 603.A N ASP 601.A OD1 no hydrogen 2.780 N/A VAL 604.A N ASP 601.A OD1 no hydrogen 2.861 N/A HIS 608.A N VAL 605.A O no hydrogen 2.908 N/A HIS 608.A ND1 VAL 605.A O no hydrogen 3.155 N/A HIS 608.A NE2 ASP 554.A O no hydrogen 3.172 N/A SER 609.A OG HIS 597.A ND1 no hydrogen 2.688 N/A SER 609.A OG TRP 606.A O no hydrogen 3.327 N/A SER 609.A OG TYR 625.A OH no hydrogen 2.716 N/A LEU 610.A N TRP 606.A O no hydrogen 3.163 N/A LEU 611.A N GLN 607.A O no hydrogen 2.816 N/A PHE 612.A N HIS 608.A O no hydrogen 3.161 N/A LEU 613.A N SER 609.A O no hydrogen 3.076 N/A ASP 614.A N LEU 610.A O no hydrogen 2.937 N/A ALA 615.A N LEU 611.A O no hydrogen 2.815 N/A CYS 616.A N PHE 612.A O no hydrogen 2.890 N/A CYS 616.A SG PHE 612.A O no hydrogen 3.364 N/A CYS 616.A SG THR 621.A OG1 no hydrogen 3.339 N/A VAL 617.A N LEU 613.A O no hydrogen 3.003 N/A LYS 618.A N ASP 614.A O no hydrogen 3.211 N/A ALA 619.A N ALA 615.A O no hydrogen 2.892 N/A ARG 620.A N VAL 617.A O no hydrogen 3.159 N/A THR 621.A N CYS 616.A O no hydrogen 2.795 N/A THR 621.A OG1 ALA 586.A O no hydrogen 2.894 N/A ASP 624.A N LEU 593.A O no hydrogen 2.767 N/A TYR 625.A OH SER 609.A OG no hydrogen 2.716 N/A TYR 626.A N LEU 595.A O no hydrogen 2.975 N/A TYR 628.A N HIS 597.A O no hydrogen 2.961 N/A TYR 628.A OH HIS 642.A ND1 no hydrogen 2.852 N/A SER 630.A OG HIS 172.A NE2 no hydrogen 2.694 N/A HIS 631.A N TYR 628.A O no hydrogen 3.138 N/A HIS 631.A NE2 ASP 639.A OD2 no hydrogen 2.751 N/A HIS 633.A ND1 ASP 601.A OD2 no hydrogen 2.674 N/A HIS 633.A NE2 SER 526.A OG no hydrogen 2.666 N/A ARG 640.A N GLY 637.A O no hydrogen 2.886 N/A ARG 640.A NE TYR 644.A OH no hydrogen 3.449 N/A ARG 640.A NH1 VAL 635.A O no hydrogen 2.750 N/A VAL 641.A N PRO 638.A O no hydrogen 2.937 N/A HIS 642.A ND1 TYR 628.A OH no hydrogen 2.852 N/A LEU 643.A N ASP 639.A O no hydrogen 3.101 N/A TYR 644.A N ARG 640.A O no hydrogen 2.990 N/A TYR 644.A OH GLY 458.A O no hydrogen 2.977 N/A GLU 645.A N VAL 641.A O no hydrogen 3.011 N/A THR 646.A N HIS 642.A O no hydrogen 2.840 N/A THR 646.A OG1 HIS 642.A O no hydrogen 2.898 N/A ILE 647.A N LEU 643.A O no hydrogen 2.877 N/A THR 648.A N TYR 644.A O no hydrogen 2.823 N/A THR 648.A OG1 TYR 644.A O no hydrogen 2.889 N/A ARG 649.A N GLU 645.A O no hydrogen 2.989 N/A TYR 650.A N THR 646.A O no hydrogen 3.196 N/A TYR 650.A OH ASP 624.A OD2 no hydrogen 2.691 N/A PHE 651.A N ILE 647.A O no hydrogen 3.236 N/A THR 652.A N THR 648.A O no hydrogen 2.878 N/A THR 652.A OG1 THR 648.A O no hydrogen 3.540 N/A THR 652.A OG1 ARG 649.A O no hydrogen 3.376 N/A ASP 653.A N ARG 649.A O no hydrogen 2.733 N/A HIS 654.A N TYR 650.A O no hydrogen 3.069 N/A LEU 655.A N PHE 651.A O no hydrogen 2.915 N/A