Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1uwk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASP 119.A OD1 no hydrogen 2.848 N/A ARG 5.A N LYS 44.A O no hydrogen 2.930 N/A ARG 5.A NH1 ASP 63.A OD1 no hydrogen 2.825 N/A ARG 5.A NH1 ASP 63.A OD2 no hydrogen 3.437 N/A ARG 5.A NH2 ASP 63.A OD2 no hydrogen 2.811 N/A VAL 7.A N ARG 5.A O no hydrogen 2.948 N/A ARG 10.A NH1 GLU 8.A OE1 no hydrogen 3.345 N/A ARG 10.A NH2 GLU 8.A OE1 no hydrogen 3.071 N/A ARG 13.A NH1 ALA 11.A O no hydrogen 2.806 N/A GLY 14.A N SER 364.A O no hydrogen 2.876 N/A ASN 15.A ND2 SER 432.A O no hydrogen 3.125 N/A LYS 16.A NZ ARG 13.A O no hydrogen 2.810 N/A THR 18.A N GLU 25.A OE1 no hydrogen 2.828 N/A ALA 19.A N GLU 25.A OE1 no hydrogen 2.873 N/A LYS 20.A NZ ARG 71.A O no hydrogen 2.807 N/A LYS 20.A NZ GLU 73.A OE2 no hydrogen 2.938 N/A SER 21.A N THR 24.A OG1 no hydrogen 3.358 N/A LEU 23.A N SER 21.A OG no hydrogen 3.171 N/A THR 24.A N SER 21.A O no hydrogen 3.161 N/A THR 24.A OG1 SER 21.A O no hydrogen 3.145 N/A GLU 25.A N SER 21.A O no hydrogen 2.820 N/A ALA 26.A N TRP 22.A O no hydrogen 2.943 N/A LEU 28.A N THR 24.A O no hydrogen 3.404 N/A ARG 29.A N GLU 25.A O no hydrogen 2.802 N/A ARG 29.A NE GLU 25.A OE2 no hydrogen 2.773 N/A ARG 29.A NH1 GLY 14.A O no hydrogen 2.860 N/A ARG 29.A NH1 LEU 363.A O no hydrogen 2.743 N/A ARG 29.A NH2 GLY 14.A O no hydrogen 3.114 N/A ARG 29.A NH2 GLU 25.A OE2 no hydrogen 3.159 N/A MET 30.A N ALA 26.A O no hydrogen 2.883 N/A LEU 31.A N PRO 27.A O no hydrogen 2.845 N/A MET 32.A N LEU 28.A O no hydrogen 3.101 N/A ASN 33.A N ARG 29.A O no hydrogen 2.770 N/A ASN 33.A ND2 TYR 136.A O no hydrogen 3.641 N/A ASN 34.A N MET 30.A O no hydrogen 2.997 N/A ASN 34.A ND2 THR 130.A O no hydrogen 2.990 N/A ASN 34.A ND2 ALA 131.A O no hydrogen 2.828 N/A LEU 35.A N MET 32.A O no hydrogen 3.017 N/A ASP 36.A N ASN 33.A O no hydrogen 3.038 N/A GLN 38.A N ASP 36.A OD2 no hydrogen 2.866 N/A VAL 39.A N ASP 36.A O no hydrogen 2.828 N/A ALA 40.A N ASP 36.A O no hydrogen 2.910 N/A GLU 41.A N VAL 48.A O no hydrogen 2.799 N/A ASN 42.A N VAL 47.A O no hydrogen 2.913 N/A ASN 42.A ND2 GLU 45.A OE1 no hydrogen 3.355 N/A LYS 44.A NZ.B ASP 6.A OD2 no hydrogen 2.651 N/A GLU 45.A N ASN 42.A O no hydrogen 3.069 N/A LEU 46.A N PRO 43.A O no hydrogen 2.938 N/A VAL 47.A N ASN 42.A O no hydrogen 3.073 N/A VAL 48.A N GLY 53.A O no hydrogen 2.776 N/A GLY 53.A N TYR 49.A O no hydrogen 3.158 N/A ARG 54.A N TYR 126.A O no hydrogen 2.903 N/A ARG 54.A NE GLU 45.A O no hydrogen 2.760 N/A ARG 54.A NH1 GLU 45.A O no hydrogen 2.955 N/A ALA 55.A N LEU 46.A O no hydrogen 3.081 N/A ARG 57.A N GLY 83.A O no hydrogen 2.924 N/A ARG 57.A NE SER 82.A O no hydrogen 2.858 N/A ARG 57.A NH1 GLN 81.A O no hydrogen 2.818 N/A ARG 57.A NH1 GLN 81.A OE1 no hydrogen 2.932 N/A ARG 57.A NH1 SER 82.A O no hydrogen 3.297 N/A ARG 57.A NH2 GLY 122.A O no hydrogen 2.968 N/A TRP 59.A N ASN 2.A O no hydrogen 3.013 N/A TRP 59.A NE1 LYS 3.A O no hydrogen 3.018 N/A TRP 59.A NE1 LYS 44.A O no hydrogen 3.156 N/A GLU 60.A N ASN 1.A O no hydrogen 2.913 N/A CYS 61.A N ASN 58.A OD1 no hydrogen 2.926 N/A CYS 61.A SG ASN 58.A OD1 no hydrogen 3.419 N/A TYR 62.A N ASN 58.A O no hydrogen 2.931 N/A ASP 63.A N TRP 59.A O no hydrogen 2.918 N/A LYS 64.A N GLU 60.A O no hydrogen 3.060 N/A LYS 64.A NZ GLU 67.A OE1 no hydrogen 2.749 N/A ILE 65.A N CYS 61.A O no hydrogen 2.824 N/A VAL 66.A N TYR 62.A O no hydrogen 2.979 N/A GLU 67.A N ASP 63.A O no hydrogen 2.962 N/A THR 68.A N LYS 64.A O no hydrogen 2.847 N/A THR 68.A OG1 LYS 64.A O no hydrogen 2.759 N/A LEU 69.A N ILE 65.A O no hydrogen 2.879 N/A THR 70.A N VAL 66.A O no hydrogen 2.995 N/A THR 70.A OG1 VAL 66.A O no hydrogen 2.674 N/A ARG 71.A N THR 68.A O no hydrogen 3.084 N/A LEU 72.A N LEU 69.A O no hydrogen 3.404 N/A GLU 73.A N GLU 76.A OE2 no hydrogen 2.862 N/A GLU 76.A N GLU 73.A O no hydrogen 3.141 N/A THR 77.A N PHE 89.A O no hydrogen 2.799 N/A THR 77.A OG1 THR 91.A OG1 no hydrogen 2.659 N/A THR 77.A OG1 PRO 96.A O no hydrogen 2.704 N/A LEU 78.A N ARG 97.A O no hydrogen 2.884 N/A LEU 79.A N GLY 87.A O no hydrogen 2.796 N/A VAL 80.A N LEU 99.A O no hydrogen 2.855 N/A GLN 81.A N LYS 84.A O no hydrogen 2.845 N/A SER 82.A N ALA 101.A O no hydrogen 2.816 N/A GLY 83.A N ASN 102.A OD1 no hydrogen 2.915 N/A LYS 84.A N GLN 81.A O no hydrogen 3.000 N/A VAL 86.A N LEU 79.A O no hydrogen 2.989 N/A PHE 89.A N THR 77.A O no hydrogen 2.961 N/A THR 91.A N ASP 75.A O no hydrogen 2.766 N/A THR 91.A OG1 THR 77.A OG1 no hydrogen 2.659 N/A ASN 94.A N HIS 92.A ND1 no hydrogen 3.121 N/A ALA 95.A N HIS 92.A O no hydrogen 3.054 N/A ARG 97.A N THR 481.A O no hydrogen 2.838 N/A ARG 97.A NE GLU 76.A O no hydrogen 2.820 N/A ARG 97.A NH1 GLU 76.A O no hydrogen 3.079 N/A ARG 97.A NH1 HIS 92.A O no hydrogen 2.938 N/A ARG 97.A NH2 HIS 92.A O no hydrogen 3.564 N/A ARG 97.A NH2 SER 93.A O no hydrogen 3.346 N/A VAL 98.A N THR 481.A O no hydrogen 3.443 N/A LEU 99.A N LEU 78.A O no hydrogen 2.921 N/A ILE 100.A N VAL 483.A O no hydrogen 2.878 N/A ALA 101.A N VAL 80.A O no hydrogen 2.857 N/A ASN 102.A N LEU 485.A O no hydrogen 3.005 N/A ASN 102.A ND2 GLY 132.A O no hydrogen 3.124 N/A ASN 102.A ND2 HIS 486.A NE2 no hydrogen 2.969 N/A SER 103.A N SER 82.A OG no hydrogen 2.941 N/A SER 103.A OG MET 125.A O no hydrogen 2.657 N/A ASN 104.A ND2 LEU 485.A O no hydrogen 3.120 N/A TRP 109.A N VAL 106.A O no hydrogen 2.845 N/A ALA 110.A N PRO 107.A O no hydrogen 2.958 N/A ASN 111.A N TRP 109.A O no hydrogen 2.958 N/A TRP 112.A NE1 HIS 265.A O no hydrogen 2.882 N/A HIS 114.A N ASN 111.A OD1 no hydrogen 2.846 N/A PHE 115.A N ASN 111.A O no hydrogen 3.010 N/A ASN 116.A N TRP 112.A O no hydrogen 2.773 N/A GLU 117.A N GLU 113.A O no hydrogen 3.049 N/A LEU 118.A N HIS 114.A O no hydrogen 2.962 N/A ASP 119.A N PHE 115.A O no hydrogen 2.773 N/A ALA 120.A N ASN 116.A O no hydrogen 2.983 N/A LYS 121.A N LEU 118.A O no hydrogen 3.011 N/A GLY 122.A N ASP 119.A O no hydrogen 2.881 N/A LEU 123.A N LEU 118.A O no hydrogen 2.833 N/A TYR 126.A OH HIS 265.A ND1 no hydrogen 3.408 N/A TYR 126.A OH GLY 488.A O no hydrogen 2.626 N/A GLY 127.A N SER 103.A OG no hydrogen 2.892 N/A GLN 128.A NE2 GLY 50.A O no hydrogen 2.919 N/A MET 129.A N TYR 49.A OH no hydrogen 2.888 N/A THR 130.A N TYR 49.A OH no hydrogen 3.043 N/A GLY 132.A N GLY 127.A O no hydrogen 2.900 N/A SER 133.A OG MET 129.A O no hydrogen 2.883 N/A SER 133.A OG HIS 441.A NE2 no hydrogen 3.165 N/A TRP 134.A NE1 ALA 55.A O no hydrogen 2.952 N/A ILE 135.A N THR 130.A O no hydrogen 3.368 N/A TYR 136.A N ASN 34.A OD1 no hydrogen 3.034 N/A SER 139.A N GLN 401.A OE1 no hydrogen 3.001 N/A SER 139.A OG GLY 174.A O no hydrogen 2.660 N/A GLN 140.A NE2 ALA 405.A O no hydrogen 2.833 N/A GLY 141.A N GLY 138.A O no hydrogen 3.357 N/A ILE 142.A N SER 139.A O no hydrogen 3.366 N/A VAL 143.A N GLN 140.A O no hydrogen 3.303 N/A GLN 144.A NE2 GLU 148.A OE2 no hydrogen 3.160 N/A THR 146.A N ILE 142.A O no hydrogen 2.950 N/A THR 146.A OG1 ILE 142.A O no hydrogen 3.166 N/A THR 146.A OG1 TYR 320.A OH no hydrogen 2.585 N/A TYR 147.A N VAL 143.A O no hydrogen 2.903 N/A GLU 148.A N GLN 144.A O no hydrogen 2.822 N/A THR 149.A N GLY 145.A O no hydrogen 2.912 N/A THR 149.A OG1 GLY 145.A O no hydrogen 2.895 N/A PHE 150.A N THR 146.A O no hydrogen 2.944 N/A VAL 151.A N TYR 147.A O no hydrogen 2.762 N/A GLU 152.A N GLU 148.A O no hydrogen 2.974 N/A ALA 153.A N THR 149.A O no hydrogen 2.934 N/A GLY 154.A N PHE 150.A O no hydrogen 2.886 N/A ARG 155.A N VAL 151.A O no hydrogen 2.811 N/A GLN 156.A N GLU 152.A O no hydrogen 2.850 N/A GLN 156.A NE2 GLU 152.A OE2 no hydrogen 2.999 N/A GLN 156.A NE2 ALA 345.A O no hydrogen 3.030 N/A HIS 157.A N ALA 153.A O no hydrogen 2.914 N/A HIS 157.A ND1 ALA 153.A O no hydrogen 3.123 N/A TYR 158.A N GLY 154.A O no hydrogen 2.769 N/A TYR 158.A OH ASP 256.A O no hydrogen 2.570 N/A GLY 160.A N GLY 154.A O no hydrogen 2.991 N/A LEU 162.A N ALA 186.A O no hydrogen 3.153 N/A LYS 163.A N SER 161.A OG no hydrogen 3.327 N/A LYS 165.A N LEU 162.A O no hydrogen 2.847 N/A TRP 166.A N ASP 256.A OD2 no hydrogen 2.848 N/A VAL 167.A N CYS 189.A O no hydrogen 2.986 N/A LEU 168.A N MET 257.A O no hydrogen 2.889 N/A THR 169.A N LEU 191.A O no hydrogen 2.993 N/A THR 169.A OG1 ALA 170.A O no hydrogen 3.542 N/A THR 169.A OG1 GLN 179.A OE1 no hydrogen 2.634 N/A ALA 170.A N THR 169.A OG1 no hydrogen 2.736 N/A GLY 171.A N ILE 193.A O no hydrogen 2.814 N/A LEU 172.A N GLU 194.A OE1 no hydrogen 2.753 N/A GLY 177.A N GLY 173.A O no hydrogen 2.777 N/A ALA 178.A N MET 175.A O no hydrogen 3.057 N/A GLN 179.A N GLY 176.A O no hydrogen 2.936 N/A GLN 179.A NE2 ALA 170.A O no hydrogen 3.190 N/A GLN 179.A NE2 GLY 171.A O no hydrogen 2.966 N/A GLN 179.A NE2 GLY 176.A O no hydrogen 3.149 N/A ALA 182.A N ALA 178.A O no hydrogen 2.918 N/A ALA 183.A N GLN 179.A O no hydrogen 2.856 N/A THR 184.A N PRO 180.A O no hydrogen 2.966 N/A THR 184.A OG1 PRO 180.A O no hydrogen 3.152 N/A THR 184.A OG1 ALA 232.A O no hydrogen 3.525 N/A LEU 185.A N LEU 181.A O no hydrogen 2.839 N/A ALA 186.A N ALA 182.A O no hydrogen 3.009 N/A GLY 187.A N THR 184.A O no hydrogen 2.899 N/A ALA 188.A N ALA 183.A O no hydrogen 2.896 N/A CYS 189.A N LYS 165.A O no hydrogen 2.955 N/A CYS 189.A SG LYS 231.A O no hydrogen 3.151 N/A SER 190.A N ILE 233.A O no hydrogen 3.139 N/A LEU 191.A N VAL 167.A O no hydrogen 2.854 N/A ASN 192.A N ILE 235.A O no hydrogen 2.846 N/A ASN 192.A ND2 SER 190.A OG no hydrogen 2.928 N/A ASN 192.A ND2 ILE 235.A O no hydrogen 3.142 N/A ILE 193.A N THR 169.A O no hydrogen 2.962 N/A GLU 194.A N LEU 237.A O no hydrogen 2.933 N/A SER 195.A OG.B GLY 239.A O no hydrogen 2.798 N/A GLN 196.A N GLU 194.A OE2 no hydrogen 2.755 N/A GLN 197.A NE2 ASP 201.A OD1 no hydrogen 2.883 N/A GLN 197.A NE2 GLN 212.A OE1 no hydrogen 2.880 N/A ARG 199.A N GLN 196.A O no hydrogen 2.998 N/A ARG 199.A NE SER 198.A OG no hydrogen 3.031 N/A ARG 199.A NH1 GLU 41.A O no hydrogen 2.943 N/A ARG 199.A NH1 GLU 41.A OE1 no hydrogen 2.830 N/A ARG 199.A NH2 SER 198.A OG no hydrogen 3.270 N/A ILE 200.A N GLN 196.A O no hydrogen 3.207 N/A ASP 201.A N GLN 197.A O no hydrogen 2.877 N/A PHE 202.A N SER 198.A O no hydrogen 3.000 N/A ARG 203.A N ARG 199.A O no hydrogen 3.029 N/A ARG 203.A NH1 GLU 41.A OE2 no hydrogen 2.873 N/A ARG 203.A NH2 GLU 41.A OE1 no hydrogen 3.137 N/A ARG 203.A NH2 GLU 41.A OE2 no hydrogen 3.446 N/A ARG 203.A NH2 LEU 172.A O no hydrogen 2.856 N/A LEU 204.A N ILE 200.A O no hydrogen 2.853 N/A GLU 205.A N ASP 201.A O no hydrogen 2.862 N/A THR 206.A N PHE 202.A O no hydrogen 3.067 N/A THR 206.A OG1 PHE 202.A O no hydrogen 2.819 N/A THR 206.A OG1 ARG 203.A O no hydrogen 3.479 N/A ARG 207.A N LEU 204.A O no hydrogen 3.068 N/A ARG 207.A NH2 SER 399.A OG no hydrogen 2.945 N/A TYR 208.A N ARG 203.A O no hydrogen 2.886 N/A VAL 209.A N ARG 203.A O no hydrogen 3.319 N/A ASP 210.A N SER 234.A O no hydrogen 3.255 N/A ASP 210.A N SER 234.A OG no hydrogen 2.882 N/A GLU 211.A N SER 234.A O no hydrogen 3.097 N/A GLN 212.A NE2 GLN 197.A OE1 no hydrogen 2.920 N/A ALA 213.A N ALA 236.A O no hydrogen 2.859 N/A THR 214.A N ASP 218.A OD2 no hydrogen 2.901 N/A THR 214.A OG1 ASP 215.A OD2 no hydrogen 2.783 N/A ASP 218.A N ASP 215.A OD1 no hydrogen 2.840 N/A ALA 219.A N ASP 215.A O no hydrogen 2.866 N/A LEU 220.A N LEU 216.A O no hydrogen 2.990 N/A VAL 221.A N ASP 217.A O no hydrogen 2.972 N/A ARG 222.A N ASP 218.A O no hydrogen 3.021 N/A ARG 222.A NE ASP 218.A OD2 no hydrogen 2.814 N/A ARG 222.A NH1 GLU 211.A OE1 no hydrogen 2.676 N/A ARG 222.A NH2 ASP 218.A OD2 no hydrogen 2.978 N/A ILE 223.A N ALA 219.A O no hydrogen 2.924 N/A ALA 224.A N LEU 220.A O no hydrogen 2.896 N/A LYS 225.A N VAL 221.A O no hydrogen 2.942 N/A LYS 225.A NZ GLU 229.A OE2 no hydrogen 2.794 N/A TYR 226.A N ARG 222.A O no hydrogen 2.841 N/A TYR 226.A OH GLU 211.A OE1 no hydrogen 3.152 N/A TYR 226.A OH GLU 211.A OE2 no hydrogen 2.877 N/A THR 227.A N ILE 223.A O no hydrogen 2.975 N/A THR 227.A OG1 ILE 223.A O no hydrogen 2.738 N/A THR 227.A OG1 ALA 224.A O no hydrogen 3.355 N/A ALA 228.A N ALA 224.A O no hydrogen 3.162 N/A GLU 229.A N LYS 225.A O no hydrogen 3.133 N/A GLU 229.A N TYR 226.A O no hydrogen 3.187 N/A GLY 230.A N THR 227.A O no hydrogen 2.973 N/A LYS 231.A N TYR 226.A O no hydrogen 2.856 N/A LYS 231.A NZ GLU 229.A OE1 no hydrogen 2.494 N/A SER 234.A N ASP 210.A OD2 no hydrogen 2.968 N/A SER 234.A OG ASP 210.A OD2 no hydrogen 3.273 N/A ILE 235.A N SER 190.A O no hydrogen 2.795 N/A ALA 236.A N GLU 211.A O no hydrogen 2.767 N/A LEU 237.A N ASN 192.A O no hydrogen 2.897 N/A HIS 238.A NE2 SER 195.A O no hydrogen 2.942 N/A GLY 239.A N GLU 194.A O no hydrogen 3.005 N/A ASN 240.A ND2 LEU 272.A O no hydrogen 2.986 N/A ALA 242.A N ASN 240.A OD1 no hydrogen 2.843 N/A GLU 243.A N ASN 240.A O no hydrogen 2.974 N/A ILE 244.A N ASN 240.A O no hydrogen 2.897 N/A LEU 245.A N ALA 241.A O no hydrogen 2.896 N/A GLU 247.A N GLU 243.A O no hydrogen 3.293 N/A LEU 248.A N ILE 244.A O no hydrogen 2.835 N/A VAL 249.A N LEU 245.A O no hydrogen 3.025 N/A LYS 250.A N PRO 246.A O no hydrogen 2.976 N/A ARG 251.A N GLU 247.A O no hydrogen 2.931 N/A ARG 251.A NE GLU 247.A OE2 no hydrogen 2.816 N/A ARG 251.A NH1 ASP 217.A OD1 no hydrogen 2.592 N/A ARG 251.A NH2 GLU 247.A OE2 no hydrogen 3.494 N/A GLY 252.A N VAL 249.A O no hydrogen 2.944 N/A VAL 253.A N LEU 248.A O no hydrogen 3.015 N/A ARG 254.A NE GLN 313.A O no hydrogen 3.442 N/A ARG 254.A NH2 GLN 313.A O no hydrogen 3.290 N/A ASP 256.A N TRP 166.A O no hydrogen 2.852 N/A MET 257.A N TRP 166.A O no hydrogen 3.301 N/A VAL 258.A N PRO 316.A O no hydrogen 2.875 N/A THR 259.A N LEU 168.A O no hydrogen 3.099 N/A THR 259.A OG1 PHE 318.A O no hydrogen 2.760 N/A ASP 260.A N THR 259.A OG1 no hydrogen 2.763 N/A GLN 261.A N ALA 170.A O no hydrogen 2.869 N/A THR 262.A N ASP 260.A OD1 no hydrogen 3.109 N/A THR 262.A OG1 ASP 260.A OD1 no hydrogen 2.689 N/A SER 263.A OG HIS 265.A NE2 no hydrogen 3.380 N/A ASP 266.A N SER 263.A O no hydrogen 3.229 N/A LEU 268.A N ASP 266.A OD2 no hydrogen 3.269 N/A ASN 269.A N ASP 266.A O no hydrogen 3.165 N/A ASN 269.A ND2 ASP 266.A OD1 no hydrogen 2.890 N/A ASN 269.A ND2 ASP 266.A OD2 no hydrogen 3.530 N/A GLY 270.A N ASP 266.A O no hydrogen 2.827 N/A TYR 271.A N TYR 281.A OH no hydrogen 2.920 N/A TYR 271.A OH HIS 303.A ND1 no hydrogen 2.711 N/A ALA 274.A N SER 299.A OG no hydrogen 2.858 N/A TRP 276.A N PRO 273.A O no hydrogen 3.018 N/A THR 277.A N GLN 280.A OE1 no hydrogen 2.932 N/A THR 277.A OG1 GLU 279.A OE2 no hydrogen 3.473 N/A GLN 280.A N THR 277.A OG1 no hydrogen 2.905 N/A TYR 281.A N THR 277.A O no hydrogen 2.869 N/A TYR 281.A OH PRO 267.A O no hydrogen 2.687 N/A ARG 282.A N TRP 278.A O no hydrogen 2.887 N/A ARG 282.A NH1 ASN 269.A OD1 no hydrogen 2.614 N/A ARG 282.A NH2 LEU 268.A O no hydrogen 2.681 N/A ASP 283.A N GLU 279.A O no hydrogen 3.109 N/A ARG 284.A N GLN 280.A O no hydrogen 2.815 N/A ALA 285.A N TYR 281.A O no hydrogen 3.040 N/A GLN 286.A N ASP 283.A O no hydrogen 3.128 N/A THR 287.A N ARG 284.A O no hydrogen 3.165 N/A THR 287.A OG1 ARG 284.A O no hydrogen 3.419 N/A GLU 288.A N ARG 284.A O no hydrogen 2.876 N/A VAL 292.A N GLU 288.A O no hydrogen 2.996 N/A VAL 293.A N PRO 289.A O no hydrogen 2.893 N/A LYS 294.A N ALA 290.A O no hydrogen 3.054 N/A ALA 295.A N ALA 291.A O no hydrogen 2.961 N/A ALA 296.A N VAL 292.A O no hydrogen 2.884 N/A LYS 297.A N VAL 293.A O no hydrogen 2.860 N/A LYS 297.A NZ GLU 330.A OE1 no hydrogen 2.770 N/A GLN 298.A N LYS 294.A O no hydrogen 2.867 N/A SER 299.A N ALA 295.A O no hydrogen 3.129 N/A SER 299.A OG ALA 295.A O no hydrogen 3.504 N/A MET 300.A N ALA 296.A O no hydrogen 2.871 N/A ALA 301.A N LYS 297.A O no hydrogen 2.988 N/A VAL 302.A N GLN 298.A O no hydrogen 3.316 N/A HIS 303.A N SER 299.A O no hydrogen 2.908 N/A HIS 303.A ND1 TYR 271.A OH no hydrogen 2.711 N/A VAL 304.A N MET 300.A O no hydrogen 2.792 N/A GLN 305.A N ALA 301.A O no hydrogen 2.979 N/A GLN 305.A NE2 GLN 305.A O no hydrogen 3.228 N/A GLN 305.A NE2 ASP 309.A OD1 no hydrogen 3.004 N/A ALA 306.A N VAL 302.A O no hydrogen 3.096 N/A MET 307.A N HIS 303.A O no hydrogen 3.055 N/A LEU 308.A N VAL 304.A O no hydrogen 2.885 N/A ASP 309.A N GLN 305.A O no hydrogen 2.807 N/A PHE 310.A N ALA 306.A O no hydrogen 2.865 N/A GLN 311.A N MET 307.A O no hydrogen 2.948 N/A GLN 311.A NE2 ASP 338.A O no hydrogen 3.469 N/A LYS 312.A N LEU 308.A O no hydrogen 2.862 N/A GLN 313.A N ASP 309.A O no hydrogen 3.285 N/A GLN 313.A N PHE 310.A O no hydrogen 2.966 N/A GLY 314.A N GLN 311.A O no hydrogen 2.784 N/A VAL 315.A N PHE 310.A O no hydrogen 3.098 N/A THR 317.A OG1 VAL 315.A O no hydrogen 2.825 N/A PHE 318.A N VAL 258.A O no hydrogen 3.087 N/A ASP 319.A N PRO 340.A O no hydrogen 2.875 N/A TYR 320.A OH THR 146.A OG1 no hydrogen 2.585 N/A GLY 321.A N ASP 319.A OD2 no hydrogen 2.719 N/A ASN 322.A ND2 ASP 260.A OD1 no hydrogen 2.784 N/A ASN 322.A ND2 THR 262.A O no hydrogen 2.894 N/A ILE 324.A N ASN 322.A OD1 no hydrogen 3.150 N/A ARG 325.A NH1 PHE 339.A O no hydrogen 2.862 N/A ARG 325.A NH1 GLU 455.A OE2 no hydrogen 2.908 N/A ARG 325.A NH2 GLU 455.A OE1 no hydrogen 2.752 N/A ARG 325.A NH2 GLU 455.A OE2 no hydrogen 3.548 N/A GLN 326.A NE2 GLU 330.A OE2 no hydrogen 2.960 N/A MET 327.A N ASN 323.A O no hydrogen 3.221 N/A ALA 328.A N ILE 324.A O no hydrogen 3.046 N/A LYS 329.A N ARG 325.A O no hydrogen 2.849 N/A GLU 330.A N GLN 326.A O no hydrogen 3.013 N/A GLU 331.A N MET 327.A O no hydrogen 3.166 N/A GLU 331.A N ALA 328.A O no hydrogen 3.031 N/A GLY 332.A N LYS 329.A O no hydrogen 2.994 N/A VAL 333.A N ALA 328.A O no hydrogen 3.006 N/A ALA 336.A N VAL 333.A O no hydrogen 3.025 N/A ASP 338.A N ASP 335.A O no hydrogen 2.920 N/A GLY 341.A N GLU 455.A OE2 no hydrogen 3.051 N/A PHE 342.A N ASP 319.A O no hydrogen 2.908 N/A ALA 345.A N GLY 341.A O no hydrogen 3.099 N/A TYR 346.A N PHE 342.A O no hydrogen 2.841 N/A ILE 347.A N PHE 342.A O no hydrogen 3.198 N/A ILE 347.A N VAL 343.A O no hydrogen 3.152 N/A ARG 348.A N VAL 343.A O no hydrogen 2.898 N/A ARG 348.A NH1 GLU 455.A O no hydrogen 2.942 N/A ARG 348.A NH1 TYR 535.A OH no hydrogen 3.515 N/A ARG 348.A NH2 GLU 453.A O no hydrogen 2.994 N/A ARG 348.A NH2 GLU 455.A O no hydrogen 2.790 N/A LEU 350.A N ILE 347.A O no hydrogen 2.924 N/A PHE 351.A N ILE 347.A O no hydrogen 3.495 N/A CYS 352.A N ARG 348.A O no hydrogen 2.979 N/A CYS 352.A SG ARG 348.A O no hydrogen 3.561 N/A ARG 353.A N LEU 350.A O no hydrogen 2.976 N/A GLY 354.A N PHE 351.A O no hydrogen 2.872 N/A VAL 355.A N LEU 350.A O no hydrogen 2.988 N/A PHE 358.A N GLY 356.A O no hydrogen 2.763 N/A ARG 359.A N GLY 438.A O no hydrogen 3.110 N/A ARG 359.A NE PRO 357.A O no hydrogen 3.373 N/A ARG 359.A NH1 ILE 135.A O no hydrogen 2.969 N/A TRP 360.A N ARG 406.A O no hydrogen 3.036 N/A TRP 360.A NE1 THR 373.A OG1 no hydrogen 2.792 N/A ALA 361.A N VAL 436.A O no hydrogen 2.921 N/A ALA 362.A N PRO 404.A O no hydrogen 2.858 N/A LEU 363.A N PRO 434.A O no hydrogen 3.296 N/A SER 364.A OG ASP 369.A OD2 no hydrogen 2.650 N/A GLY 365.A N ALA 362.A O no hydrogen 2.981 N/A GLU 366.A N SER 364.A OG no hydrogen 2.834 N/A ASP 369.A N GLU 366.A O no hydrogen 2.953 N/A TYR 371.A N ALA 367.A O no hydrogen 3.021 N/A LYS 372.A N GLU 368.A O no hydrogen 2.903 N/A LYS 372.A NZ GLU 430.A O no hydrogen 3.093 N/A THR 373.A N ASP 369.A O no hydrogen 3.051 N/A THR 373.A OG1 ILE 370.A O no hydrogen 2.697 N/A ASP 374.A N ILE 370.A O no hydrogen 2.873 N/A ALA 375.A N TYR 371.A O no hydrogen 3.064 N/A LYS 376.A N LYS 372.A O no hydrogen 3.004 N/A LYS 376.A NZ GLU 379.A OE1 no hydrogen 3.524 N/A LYS 376.A NZ GLU 379.A OE2 no hydrogen 2.783 N/A VAL 377.A N THR 373.A O no hydrogen 2.844 N/A LYS 378.A N ASP 374.A O no hydrogen 3.094 N/A LYS 378.A NZ ASP 392.A OD1 no hydrogen 2.644 N/A GLU 379.A N ALA 375.A O no hydrogen 3.040 N/A LEU 380.A N LYS 376.A O no hydrogen 2.989 N/A ILE 381.A N VAL 377.A O no hydrogen 2.871 N/A HIS 386.A NE2 GLU 148.A OE2 no hydrogen 2.801 N/A LEU 387.A N ASP 384.A OD1 no hydrogen 3.054 N/A HIS 388.A N ASP 384.A O no hydrogen 2.937 N/A ARG 389.A N ALA 385.A O no hydrogen 2.867 N/A TRP 390.A N HIS 386.A O no hydrogen 2.854 N/A TRP 390.A NE1 ILE 407.A O no hydrogen 2.986 N/A LEU 391.A N LEU 387.A O no hydrogen 2.938 N/A ASP 392.A N HIS 388.A O no hydrogen 2.899 N/A MET 393.A N ARG 389.A O no hydrogen 2.779 N/A ALA 394.A N TRP 390.A O no hydrogen 2.791 N/A ARG 395.A N LEU 391.A O no hydrogen 2.990 N/A GLU 396.A N ASP 392.A O no hydrogen 2.984 N/A ARG 397.A N MET 393.A O no hydrogen 2.744 N/A ILE 398.A N ALA 394.A O no hydrogen 2.938 N/A GLN 401.A NE2 GLN 38.A O no hydrogen 2.817 N/A GLY 402.A N GLN 38.A OE1 no hydrogen 2.846 N/A LEU 403.A N ASN 33.A OD1 no hydrogen 2.783 N/A ARG 406.A N TRP 360.A O no hydrogen 2.843 N/A ARG 406.A NE ASP 374.A OD1 no hydrogen 2.850 N/A ARG 406.A NH1 GLN 140.A OE1 no hydrogen 3.010 N/A ARG 406.A NH2 ASP 374.A OD2 no hydrogen 2.856 N/A ILE 407.A N GLN 140.A OE1 no hydrogen 3.033 N/A CYS 408.A N PHE 358.A O no hydrogen 2.976 N/A TRP 409.A N GLN 144.A OE1 no hydrogen 2.791 N/A LEU 412.A N ARG 353.A O no hydrogen 3.098 N/A ARG 415.A N GLY 411.A O no hydrogen 3.143 N/A ARG 415.A NE VAL 410.A O no hydrogen 2.907 N/A ARG 415.A NH1 ASP 443.A OD2 no hydrogen 2.879 N/A ARG 415.A NH2 VAL 410.A O no hydrogen 3.270 N/A ARG 415.A NH2 ASP 443.A OD1 no hydrogen 2.881 N/A ARG 415.A NH2 ASP 443.A OD2 no hydrogen 3.480 N/A LYS 417.A N GLY 413.A O no hydrogen 3.377 N/A LYS 417.A NZ LEU 380.A O no hydrogen 2.957 N/A LEU 418.A N LEU 414.A O no hydrogen 2.967 N/A GLY 419.A N ARG 415.A O no hydrogen 2.914 N/A LEU 420.A N ALA 416.A O no hydrogen 2.934 N/A ALA 421.A N LYS 417.A O no hydrogen 3.116 N/A PHE 422.A N LEU 418.A O no hydrogen 2.862 N/A ASN 423.A N GLY 419.A O no hydrogen 2.961 N/A ASN 423.A ND2 THR 508.A O no hydrogen 3.115 N/A GLU 424.A N LEU 420.A O no hydrogen 2.989 N/A MET 425.A N ALA 421.A O no hydrogen 2.978 N/A VAL 426.A N PHE 422.A O no hydrogen 2.980 N/A ARG 427.A N ASN 423.A O no hydrogen 2.949 N/A ARG 427.A NE GLU 424.A OE1 no hydrogen 3.304 N/A ARG 427.A NE GLU 424.A OE2 no hydrogen 3.132 N/A ARG 427.A NH2 GLU 424.A OE2 no hydrogen 2.499 N/A SER 428.A N GLU 424.A O no hydrogen 2.936 N/A SER 428.A OG GLU 424.A O no hydrogen 3.469 N/A SER 428.A OG MET 425.A O no hydrogen 3.245 N/A GLY 429.A N VAL 426.A O no hydrogen 3.205 N/A GLU 430.A N SER 428.A OG no hydrogen 3.128 N/A LEU 431.A N MET 425.A O no hydrogen 3.027 N/A SER 432.A N ASP 369.A OD1 no hydrogen 2.949 N/A SER 432.A N ASP 369.A OD2 no hydrogen 3.350 N/A SER 432.A OG ASP 369.A OD1 no hydrogen 3.536 N/A SER 432.A OG ASP 369.A OD2 no hydrogen 2.898 N/A VAL 435.A N CYS 505.A O no hydrogen 3.237 N/A VAL 436.A N ALA 361.A O no hydrogen 3.012 N/A ILE 437.A N ILE 503.A O no hydrogen 2.839 N/A GLY 438.A N ARG 359.A O no hydrogen 2.873 N/A ARG 439.A NE ASP 522.A OD1 no hydrogen 2.721 N/A ARG 439.A NE ASP 522.A OD2 no hydrogen 3.394 N/A ARG 439.A NH1 ASP 440.A O no hydrogen 2.979 N/A ARG 439.A NH1 SER 499.A O no hydrogen 2.816 N/A ARG 439.A NH2 SER 499.A O no hydrogen 3.549 N/A ARG 439.A NH2 ASP 522.A OD2 no hydrogen 2.996 N/A HIS 441.A N ASP 440.A OD1 no hydrogen 2.730 N/A HIS 441.A ND1 HIS 498.A ND1 no hydrogen 2.848 N/A HIS 441.A NE2 SER 133.A OG no hydrogen 3.165 N/A SER 446.A N ASP 443.A O no hydrogen 3.407 N/A SER 446.A OG HIS 441.A O no hydrogen 2.689 N/A SER 446.A OG ASP 443.A O no hydrogen 3.430 N/A SER 448.A N GLN 497.A O no hydrogen 2.934 N/A SER 448.A OG VAL 464.A O no hydrogen 2.816 N/A SER 449.A N THR 454.A OG1 no hydrogen 2.770 N/A SER 449.A OG GLU 453.A OE1 no hydrogen 3.480 N/A ASN 451.A ND2 ASN 323.A OD1 no hydrogen 2.936 N/A ASN 451.A ND2 GLN 326.A OE1 no hydrogen 3.115 N/A ALA 452.A N SER 449.A O no hydrogen 2.870 N/A GLU 453.A N GLU 453.A OE1 no hydrogen 2.724 N/A THR 454.A N SER 449.A O no hydrogen 2.933 N/A THR 454.A OG1 ASP 462.A O no hydrogen 2.719 N/A GLU 455.A N ALA 452.A O no hydrogen 3.113 N/A ALA 456.A N ASP 462.A OD2 no hydrogen 2.861 N/A MET 457.A N ASP 462.A OD1 no hydrogen 2.935 N/A ARG 458.A N TYR 535.A OH no hydrogen 2.867 N/A ARG 458.A NH2 ALA 533.A O no hydrogen 2.912 N/A GLY 460.A N MET 457.A O no hydrogen 2.926 N/A SER 461.A N ASP 459.A OD1 no hydrogen 3.089 N/A SER 461.A OG ASP 459.A OD1 no hydrogen 2.647 N/A SER 461.A OG ASP 459.A OD2 no hydrogen 3.447 N/A VAL 464.A N SER 461.A O no hydrogen 2.983 N/A SER 465.A OG GLN 497.A OE1 no hydrogen 2.626 N/A LEU 470.A N ASP 466.A O no hydrogen 2.921 N/A ASN 471.A N TRP 467.A O no hydrogen 2.905 N/A ASN 471.A ND2 ASP 522.A OD2 no hydrogen 2.906 N/A ASN 471.A ND2 THR 525.A OG1 no hydrogen 2.862 N/A ALA 472.A N PRO 468.A O no hydrogen 2.988 N/A LEU 473.A N LEU 469.A O no hydrogen 2.989 N/A LEU 474.A N LEU 470.A O no hydrogen 2.819 N/A ASN 475.A N ASN 471.A O no hydrogen 2.851 N/A ASN 475.A ND2 ASN 471.A O no hydrogen 3.083 N/A ASN 475.A ND2 ASN 471.A OD1 no hydrogen 3.051 N/A ASN 475.A ND2 ASP 522.A OD2 no hydrogen 2.957 N/A THR 476.A N ALA 472.A O no hydrogen 3.018 N/A THR 476.A OG1 ALA 472.A O no hydrogen 2.939 N/A ALA 477.A N LEU 473.A O no hydrogen 2.947 N/A GLY 478.A N LEU 474.A O no hydrogen 2.901 N/A GLY 479.A N ASN 475.A O no hydrogen 3.078 N/A ALA 480.A N ASN 475.A O no hydrogen 3.016 N/A THR 481.A N VAL 502.A O no hydrogen 2.770 N/A TRP 482.A N VAL 502.A O no hydrogen 3.112 N/A TRP 482.A NE1 SER 133.A O no hydrogen 2.829 N/A VAL 483.A N VAL 98.A O no hydrogen 3.142 N/A SER 484.A N GLY 500.A O no hydrogen 2.986 N/A SER 484.A OG HIS 441.A NE2 no hydrogen 3.239 N/A LEU 485.A N ILE 100.A O no hydrogen 2.819 N/A HIS 486.A N HIS 498.A O no hydrogen 2.819 N/A HIS 486.A ND1 GLN 128.A O no hydrogen 2.891 N/A HIS 487.A N ASN 102.A O no hydrogen 3.221 N/A HIS 487.A ND1 SER 496.A O no hydrogen 3.191 N/A GLY 488.A N SER 496.A O no hydrogen 2.873 N/A GLY 489.A N HIS 498.A NE2 no hydrogen 2.767 N/A GLY 490.A N GLN 128.A OE1 no hydrogen 2.882 N/A VAL 491.A N GLY 489.A O no hydrogen 2.848 N/A GLY 492.A N GLY 488.A O no hydrogen 2.787 N/A PHE 495.A N GLY 492.A O no hydrogen 3.082 N/A SER 496.A OG GLY 489.A O no hydrogen 2.842 N/A GLN 497.A N SER 448.A O no hydrogen 3.047 N/A HIS 498.A N HIS 486.A O no hydrogen 2.956 N/A HIS 498.A ND1 HIS 441.A ND1 no hydrogen 2.848 N/A SER 499.A N SER 446.A O no hydrogen 2.847 N/A SER 499.A OG ASN 471.A OD1 no hydrogen 2.623 N/A GLY 500.A N SER 484.A O no hydrogen 2.861 N/A VAL 502.A N TRP 482.A O no hydrogen 2.961 N/A ILE 503.A N ILE 437.A O no hydrogen 2.807 N/A VAL 504.A N THR 481.A OG1 no hydrogen 2.996 N/A CYS 505.A N VAL 435.A O no hydrogen 2.820 N/A CYS 505.A SG GLY 419.A O no hydrogen 3.972 N/A GLY 507.A N ASN 423.A OD1 no hydrogen 2.761 N/A THR 508.A N ASP 506.A OD2 no hydrogen 3.007 N/A THR 508.A OG1 ASP 506.A OD2 no hydrogen 2.718 N/A ALA 511.A N THR 508.A OG1 no hydrogen 2.968 N/A ALA 512.A N THR 508.A O no hydrogen 3.019 N/A GLU 513.A N ASP 509.A O no hydrogen 3.134 N/A ARG 514.A N GLU 510.A O no hydrogen 3.174 N/A ARG 514.A NH1 ASN 94.A OD1 no hydrogen 2.836 N/A ILE 515.A N ALA 511.A O no hydrogen 2.743 N/A ALA 516.A N ALA 512.A O no hydrogen 3.009 N/A ARG 517.A NE GLY 478.A O no hydrogen 2.823 N/A ARG 517.A NH2 GLY 478.A O no hydrogen 3.149 N/A VAL 518.A N ARG 514.A O no hydrogen 2.802 N/A LEU 519.A N ILE 515.A O no hydrogen 2.885 N/A THR 520.A N ARG 517.A O no hydrogen 3.217 N/A THR 520.A OG1 ALA 516.A O no hydrogen 2.792 N/A ASN 521.A N ARG 517.A O no hydrogen 2.764 N/A ASP 522.A N VAL 518.A O no hydrogen 2.894 N/A GLY 524.A N THR 520.A O no hydrogen 2.920 N/A THR 525.A N ASN 521.A O no hydrogen 2.848 N/A THR 525.A OG1 ASP 522.A O no hydrogen 2.829 N/A GLY 526.A N PRO 523.A O no hydrogen 2.952 N/A VAL 527.A N PRO 523.A O no hydrogen 3.099 N/A MET 528.A N GLY 524.A O no hydrogen 2.806 N/A ARG 529.A N THR 525.A O no hydrogen 2.919 N/A ARG 529.A NH1 SER 461.A OG no hydrogen 2.911 N/A ARG 529.A NH2 ARG 529.A O no hydrogen 2.997 N/A HIS 530.A N GLY 526.A O no hydrogen 2.953 N/A HIS 530.A ND1 GLY 526.A O no hydrogen 2.855 N/A ALA 531.A N VAL 527.A O no hydrogen 2.782 N/A ASP 532.A N MET 528.A O no hydrogen 2.842 N/A ALA 533.A N ARG 529.A O no hydrogen 3.225 N/A GLY 534.A N ALA 531.A O no hydrogen 2.889 N/A TYR 535.A N HIS 530.A O no hydrogen 3.128 N/A ILE 539.A N TYR 535.A O no hydrogen 2.938 N/A ASP 540.A N ASP 536.A O no hydrogen 2.871 N/A CYS 541.A N ILE 537.A O no hydrogen 3.051 N/A ALA 542.A N ALA 538.A O no hydrogen 2.838 N/A LYS 543.A N ILE 539.A O no hydrogen 2.995 N/A GLU 544.A N ASP 540.A O no hydrogen 2.910 N/A GLN 545.A N CYS 541.A O no hydrogen 2.887 N/A GLY 546.A N LYS 543.A O no hydrogen 3.225 N/A LEU 547.A N ALA 542.A O no hydrogen 2.969 N/A LEU 549.A N THR 553.A OG1 no hydrogen 2.942 N/A ILE 552.A N LEU 549.A O no hydrogen 2.798 N/A THR 553.A N LEU 549.A O no hydrogen 2.747 N/A THR 553.A OG1 LEU 549.A O no hydrogen 3.064 N/A GLY 554.A N PRO 550.A O no hydrogen 3.151 N/A