Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fql_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N HIS 1.A ND1 no hydrogen 3.043 N/A HIS 2.A N ASP 56.A OD1 no hydrogen 2.728 N/A SER 4.A N PHE 55.A O no hydrogen 2.975 N/A SER 4.A OG VAL 53.A O no hydrogen 2.661 N/A SER 4.A OG PHE 55.A O no hydrogen 3.463 N/A THR 6.A N TYR 271.A O no hydrogen 3.015 N/A TRP 7.A NE1 THR 54.A OG1 no hydrogen 2.769 N/A THR 8.A N CYS 269.A O.A no hydrogen 2.882 N/A THR 8.A N CYS 269.A O.B no hydrogen 3.006 N/A THR 8.A OG1 ASN 268.A O no hydrogen 2.688 N/A THR 8.A OG1 CYS 269.A O.A no hydrogen 3.158 N/A ALA 10.A N THR 8.A OG1 no hydrogen 3.161 N/A THR 13.A OG1 SER 264.A OG no hydrogen 2.618 N/A SER 28.A N ASN 25.A OD1 no hydrogen 2.670 N/A SER 28.A OG ASN 25.A O no hydrogen 2.810 N/A SER 28.A OG ASN 25.A OD1 no hydrogen 3.365 N/A ASN 29.A N ASN 25.A O no hydrogen 2.709 N/A SER 30.A N ALA 26.A O no hydrogen 3.115 N/A SER 30.A N LEU 27.A O no hydrogen 3.282 N/A SER 30.A OG LEU 27.A O no hydrogen 2.540 N/A LEU 31.A N SER 28.A O no hydrogen 3.094 N/A LEU 32.A N SER 28.A O no hydrogen 2.927 N/A ARG 33.A N GLY 488.A O no hydrogen 3.037 N/A HIS 34.A N LEU 487.A O no hydrogen 3.016 N/A HIS 34.A ND1 LYS 486.A O no hydrogen 2.910 N/A LEU 37.A N HIS 34.A O no hydrogen 3.083 N/A VAL 38.A N HIS 35.A O no hydrogen 3.166 N/A TYR 39.A N PHE 146.A O no hydrogen 2.988 N/A ALA 40.A N THR 20.A O no hydrogen 2.916 N/A THR 41.A N GLU 144.A O no hydrogen 2.868 N/A THR 41.A OG1 LYS 142.A O no hydrogen 2.775 N/A THR 41.A OG1 GLU 144.A O no hydrogen 3.535 N/A SER 43.A N GLU 18.A OE1 no hydrogen 3.302 N/A SER 43.A N GLU 18.A OE2 no hydrogen 3.037 N/A SER 43.A OG GLU 18.A OE1 no hydrogen 2.631 N/A ARG 44.A N THR 42.A OG1 no hydrogen 3.318 N/A SER 45.A N THR 42.A O no hydrogen 3.159 N/A SER 45.A OG THR 42.A O no hydrogen 2.983 N/A ALA 46.A N SER 43.A O no hydrogen 3.015 N/A ARG 49.A NE ALA 152.A O no hydrogen 3.018 N/A ARG 49.A NH1 PRO 151.A O no hydrogen 3.000 N/A GLN 50.A N ALA 46.A O no hydrogen 2.899 N/A LYS 51.A N SER 47.A O no hydrogen 3.084 N/A LYS 52.A N LEU 48.A O no hydrogen 3.138 N/A VAL 53.A N ARG 49.A O no hydrogen 2.861 N/A THR 54.A N LYS 51.A O no hydrogen 3.466 N/A THR 54.A OG1 GLN 50.A O no hydrogen 2.569 N/A PHE 55.A N SER 4.A OG no hydrogen 3.055 N/A ARG 57.A N HIS 2.A O no hydrogen 2.879 N/A ARG 57.A NE HIS 2.A O no hydrogen 2.897 N/A ARG 57.A NH1 ARG 273.A O no hydrogen 2.760 N/A ARG 57.A NH2 SER 221.A O no hydrogen 2.875 N/A ARG 57.A NH2 VAL 223.A O no hydrogen 2.846 N/A ARG 57.A NH2 ARG 273.A O no hydrogen 3.520 N/A GLN 59.A NE2 ASP 227.A OD1 no hydrogen 2.853 N/A GLN 59.A NE2 ASP 227.A OD2 no hydrogen 3.528 N/A GLN 59.A NE2 TYR 341.A O no hydrogen 2.816 N/A VAL 60.A N ARG 340.A O no hydrogen 2.836 N/A TYR 65.A N ASP 62.A OD1 no hydrogen 3.161 N/A ARG 66.A N.A ASP 62.A O no hydrogen 3.105 N/A ARG 66.A N.B ASP 62.A O no hydrogen 3.099 N/A ARG 66.A NH1.A ASP 63.A OD1 no hydrogen 2.994 N/A ARG 66.A NH2.A LEU 61.A O no hydrogen 3.102 N/A ASP 67.A N ASP 63.A O no hydrogen 2.817 N/A VAL 68.A N HIS 64.A O no hydrogen 3.102 N/A LEU 69.A N TYR 65.A O no hydrogen 2.981 N/A LYS 70.A N ARG 66.A O.A no hydrogen 2.919 N/A LYS 70.A N ARG 66.A O.B no hydrogen 2.939 N/A GLU 71.A N ASP 67.A O no hydrogen 3.169 N/A MET 72.A N VAL 68.A O no hydrogen 2.839 N/A LYS 73.A N LEU 69.A O no hydrogen 2.891 N/A ALA 74.A N LYS 70.A O no hydrogen 3.047 N/A LYS 75.A N GLU 71.A O no hydrogen 3.123 N/A LYS 75.A NZ VAL 181.A O no hydrogen 2.900 N/A ALA 76.A N MET 72.A O no hydrogen 2.865 N/A SER 77.A N LYS 73.A O no hydrogen 3.090 N/A SER 77.A OG ALA 74.A O no hydrogen 2.638 N/A THR 78.A N LYS 75.A O no hydrogen 3.037 N/A THR 78.A OG1 LYS 75.A O no hydrogen 2.655 N/A VAL 79.A N ALA 76.A O no hydrogen 2.996 N/A LYS 80.A NZ ASP 239.A OD2 no hydrogen 3.196 N/A ALA 81.A N ASP 239.A O no hydrogen 3.036 N/A LYS 82.A N ASP 172.A OD2 no hydrogen 2.897 N/A LEU 84.A N MET 168.A O no hydrogen 3.065 N/A SER 85.A N GLU 88.A OE1 no hydrogen 2.879 N/A GLU 87.A N GLU 87.A OE1 no hydrogen 2.736 N/A GLU 88.A N SER 85.A OG no hydrogen 3.130 N/A ALA 89.A N SER 85.A O no hydrogen 3.034 N/A CYS 90.A N VAL 86.A O no hydrogen 2.783 N/A CYS 90.A SG VAL 86.A O no hydrogen 3.193 N/A LYS 91.A N GLU 87.A O no hydrogen 2.951 N/A LYS 91.A NZ ARG 110.A O no hydrogen 2.615 N/A LEU 92.A N ALA 89.A O no hydrogen 3.173 N/A THR 93.A N CYS 90.A O no hydrogen 3.085 N/A THR 93.A OG1 ALA 89.A O no hydrogen 3.347 N/A THR 93.A OG1 CYS 90.A O no hydrogen 3.122 N/A SER 97.A N PRO 94.A O no hydrogen 3.166 N/A SER 97.A OG ASP 554.A OD1 no hydrogen 2.485 N/A SER 97.A OG ASP 554.A OD2 no hydrogen 3.479 N/A SER 100.A N TYR 104.A O no hydrogen 2.685 N/A SER 100.A OG ASP 159.A OD1 no hydrogen 3.295 N/A SER 100.A OG ASP 159.A OD2 no hydrogen 2.674 N/A LYS 101.A N ASP 159.A OD1 no hydrogen 2.785 N/A LYS 101.A NZ ASP 136.A OD2 no hydrogen 2.732 N/A PHE 102.A N SER 100.A OG no hydrogen 2.926 N/A GLY 105.A N ASP 108.A OD2 no hydrogen 2.949 N/A VAL 109.A N GLY 105.A O no hydrogen 3.125 N/A ARG 110.A N ALA 106.A O no hydrogen 2.849 N/A ARG 110.A NH2 LYS 91.A O no hydrogen 2.969 N/A ARG 110.A NH2 THR 93.A O no hydrogen 2.988 N/A ASN 111.A N LYS 107.A O no hydrogen 2.813 N/A LEU 112.A N VAL 109.A O no hydrogen 3.073 N/A SER 113.A N ASP 108.A O no hydrogen 2.950 N/A SER 113.A OG ASP 108.A O no hydrogen 3.213 N/A LYS 115.A NZ GLY 103.A O no hydrogen 3.412 N/A VAL 117.A N SER 113.A O no hydrogen 3.000 N/A ASN 118.A N SER 114.A O no hydrogen 2.876 N/A HIS 119.A N LYS 115.A O no hydrogen 3.048 N/A ILE 120.A N ALA 116.A O no hydrogen 2.923 N/A ARG 121.A N VAL 117.A O no hydrogen 2.894 N/A SER 122.A N ASN 118.A O no hydrogen 3.012 N/A SER 122.A OG HIS 119.A O no hydrogen 2.618 N/A VAL 123.A N HIS 119.A O no hydrogen 2.867 N/A TRP 124.A N ILE 120.A O no hydrogen 2.930 N/A TRP 124.A NE1 GLU 243.A OE1 no hydrogen 2.989 N/A LYS 125.A N ARG 121.A O no hydrogen 3.037 N/A LYS 125.A NZ GLU 129.A OE1 no hydrogen 3.340 N/A LYS 125.A NZ GLU 129.A OE2 no hydrogen 2.689 N/A ASP 126.A N SER 122.A O no hydrogen 3.012 N/A LEU 127.A N VAL 123.A O no hydrogen 2.916 N/A LEU 128.A N TRP 124.A O no hydrogen 3.052 N/A GLU 129.A N LYS 125.A O no hydrogen 3.018 N/A ASP 130.A N ASP 126.A O no hydrogen 2.845 N/A GLU 132.A N ASP 130.A OD1 no hydrogen 2.835 N/A THR 133.A N ASP 130.A OD1 no hydrogen 3.117 N/A THR 133.A OG1 ASP 130.A OD1 no hydrogen 3.398 N/A THR 133.A OG1 ASP 130.A OD2 no hydrogen 2.542 N/A ILE 135.A N ARG 254.A O no hydrogen 2.818 N/A THR 137.A N PRO 260.A O no hydrogen 3.232 N/A THR 137.A OG1 PRO 260.A O no hydrogen 2.805 N/A THR 138.A N PHE 157.A O no hydrogen 2.808 N/A ILE 139.A N THR 262.A O no hydrogen 3.037 N/A MET 140.A N ILE 155.A O no hydrogen 3.005 N/A LYS 142.A N ARG 153.A O no hydrogen 2.751 N/A LYS 142.A NZ SER 551.A O no hydrogen 3.256 N/A ASN 143.A ND2 GLU 18.A OE2 no hydrogen 2.796 N/A ASN 143.A ND2 THR 41.A O no hydrogen 3.088 N/A GLU 144.A N THR 41.A OG1 no hydrogen 2.985 N/A PHE 146.A N TYR 39.A O no hydrogen 2.888 N/A CYS 147.A SG LEU 37.A O no hydrogen 3.928 N/A CYS 147.A SG VAL 148.A O no hydrogen 3.513 N/A VAL 148.A N LEU 37.A O no hydrogen 2.743 N/A LYS 150.A N TYR 39.A OH no hydrogen 2.816 N/A ALA 152.A N SER 45.A OG no hydrogen 2.856 N/A ILE 155.A N MET 140.A O no hydrogen 2.907 N/A VAL 156.A N SER 277.A OG no hydrogen 3.062 N/A PHE 157.A N THR 138.A O no hydrogen 3.011 N/A GLY 161.A N ASP 159.A OD2 no hydrogen 3.289 N/A ARG 163.A N ASP 159.A O no hydrogen 2.996 N/A ARG 163.A NE ASP 554.A OD2 no hydrogen 2.996 N/A ARG 163.A NH1 SER 97.A OG no hydrogen 2.741 N/A ARG 163.A NH1 ALA 98.A O no hydrogen 2.863 N/A ARG 163.A NH2 PRO 158.A O no hydrogen 2.877 N/A VAL 164.A N LEU 160.A O no hydrogen 2.991 N/A CYS 165.A N GLY 161.A O no hydrogen 3.137 N/A CYS 165.A SG ILE 120.A O no hydrogen 3.515 N/A CYS 165.A SG GLY 161.A O no hydrogen 3.535 N/A GLU 166.A N VAL 162.A O no hydrogen 2.793 N/A LYS 167.A N ARG 163.A O no hydrogen 3.332 N/A LYS 167.A NZ ASP 554.A O no hydrogen 2.742 N/A LYS 167.A NZ ASP 554.A OD2 no hydrogen 3.281 N/A MET 168.A N VAL 164.A O no hydrogen 3.139 N/A ALA 169.A N CYS 165.A O no hydrogen 3.023 N/A LEU 170.A N GLU 166.A O no hydrogen 2.837 N/A TYR 171.A N LYS 167.A O no hydrogen 2.969 N/A VAL 174.A N LEU 170.A O no hydrogen 2.866 N/A SER 175.A N TYR 171.A O no hydrogen 3.048 N/A SER 175.A OG TYR 171.A O no hydrogen 2.645 N/A THR 176.A N VAL 173.A O no hydrogen 3.165 N/A THR 176.A OG1 ASP 172.A O no hydrogen 2.780 N/A LEU 177.A N VAL 173.A O no hydrogen 2.825 N/A GLN 179.A N GLN 179.A OE1 no hydrogen 2.818 N/A GLN 179.A NE2 SER 175.A O no hydrogen 2.922 N/A VAL 181.A N LEU 177.A O no hydrogen 2.975 N/A MET 182.A N PRO 178.A O no hydrogen 2.830 N/A GLY 183.A N GLN 179.A O no hydrogen 2.989 N/A SER 185.A N MET 182.A O no hydrogen 3.081 N/A SER 185.A OG MET 308.A O no hydrogen 2.996 N/A TYR 186.A N GLY 183.A O no hydrogen 3.071 N/A GLY 187.A N VAL 310.A O no hydrogen 2.778 N/A GLN 189.A NE2 GLY 183.A O no hydrogen 2.894 N/A GLN 189.A NE2 TYR 186.A O no hydrogen 2.979 N/A TYR 190.A OH SER 184.A O no hydrogen 2.739 N/A SER 191.A N GLN 194.A OE1 no hydrogen 2.928 N/A SER 191.A OG LEU 461.A O no hydrogen 3.476 N/A GLY 193.A N LEU 461.A O no hydrogen 2.891 N/A GLN 194.A N SER 191.A OG no hydrogen 3.113 N/A ARG 195.A N SER 191.A O no hydrogen 2.772 N/A ARG 195.A NH1 GLY 187.A O no hydrogen 2.762 N/A ARG 195.A NH2 GLY 187.A O no hydrogen 2.817 N/A ARG 195.A NH2 TYR 443.A OH no hydrogen 3.304 N/A VAL 196.A N PRO 192.A O no hydrogen 3.045 N/A GLU 197.A N GLY 193.A O no hydrogen 3.138 N/A PHE 198.A N GLN 194.A O no hydrogen 2.947 N/A LEU 199.A N ARG 195.A O no hydrogen 2.957 N/A VAL 200.A N VAL 196.A O no hydrogen 2.903 N/A ASN 201.A N GLU 197.A O no hydrogen 2.908 N/A ALA 202.A N PHE 198.A O no hydrogen 2.903 N/A TRP 203.A N LEU 199.A O no hydrogen 2.828 N/A LYS 204.A N VAL 200.A O no hydrogen 2.791 N/A ALA 205.A N ASN 201.A O no hydrogen 2.842 N/A LYS 206.A N TRP 203.A O no hydrogen 3.238 N/A LYS 206.A NZ ASP 305.A O no hydrogen 2.748 N/A LYS 206.A NZ ASP 305.A OD2 no hydrogen 3.006 N/A LYS 206.A NZ THR 307.A OG1 no hydrogen 2.909 N/A LYS 207.A N GLU 320.A OE1 no hydrogen 2.720 N/A CYS 208.A N GLU 320.A OE2 no hydrogen 2.967 N/A MET 210.A N CYS 319.A O no hydrogen 2.869 N/A GLY 211.A N GLU 352.A O no hydrogen 2.922 N/A PHE 212.A N VAL 317.A O no hydrogen 2.992 N/A TYR 214.A N LEU 315.A O no hydrogen 2.960 N/A TYR 214.A OH ALA 343.A O no hydrogen 2.813 N/A ARG 217.A N PRO 344.A O no hydrogen 2.866 N/A CYS 218.A SG.A LYS 52.A O no hydrogen 3.746 N/A CYS 218.A SG.B SER 221.A OG no hydrogen 3.314 N/A SER 221.A N CYS 218.A O.A no hydrogen 2.969 N/A SER 221.A N CYS 218.A O.B no hydrogen 3.019 N/A SER 221.A OG VAL 53.A O no hydrogen 2.798 N/A THR 222.A N CYS 218.A O.A no hydrogen 3.327 N/A THR 222.A N PHE 219.A O no hydrogen 2.931 N/A THR 222.A OG1 PHE 219.A O no hydrogen 2.701 N/A THR 222.A OG1 SER 342.A O no hydrogen 3.301 N/A VAL 223.A N ASP 220.A O no hydrogen 3.364 N/A THR 224.A N ASP 227.A OD2 no hydrogen 3.008 N/A THR 224.A OG1 GLN 59.A OE1 no hydrogen 2.744 N/A ASP 227.A N THR 224.A OG1 no hydrogen 3.055 N/A ILE 228.A N THR 224.A O no hydrogen 3.161 N/A ARG 229.A N GLU 225.A O no hydrogen 2.971 N/A ARG 229.A NE GLU 225.A OE2 no hydrogen 2.748 N/A ARG 229.A NH1 GLU 225.A OE2 no hydrogen 3.009 N/A ARG 229.A NH1 GLU 253.A OE1 no hydrogen 3.429 N/A ARG 229.A NH1 GLU 253.A OE2 no hydrogen 3.038 N/A ARG 229.A NH2 GLU 253.A OE1 no hydrogen 2.979 N/A VAL 230.A N ASN 226.A O no hydrogen 2.791 N/A GLU 231.A N ASP 227.A O no hydrogen 2.903 N/A GLU 232.A N ILE 228.A O no hydrogen 3.007 N/A SER 233.A N ARG 229.A O no hydrogen 2.967 N/A SER 233.A OG VAL 230.A O no hydrogen 2.582 N/A ILE 234.A N VAL 230.A O no hydrogen 3.038 N/A TYR 235.A N GLU 231.A O no hydrogen 3.014 N/A GLN 236.A N GLU 232.A O no hydrogen 2.866 N/A GLN 236.A NE2 GLU 232.A OE2 no hydrogen 3.132 N/A GLN 236.A NE2 ARG 245.A O no hydrogen 3.119 N/A CYS 237.A N ILE 234.A O no hydrogen 3.032 N/A CYS 237.A SG LYS 73.A O no hydrogen 3.747 N/A CYS 237.A SG SER 233.A O no hydrogen 3.308 N/A CYS 238.A N TYR 235.A O no hydrogen 3.190 N/A CYS 238.A SG ALA 76.A O no hydrogen 3.994 N/A CYS 238.A SG TYR 235.A O no hydrogen 3.372 N/A ASP 239.A N VAL 79.A O no hydrogen 2.808 N/A ARG 245.A N ALA 241.A O no hydrogen 3.025 N/A ARG 245.A NH1 CYS 238.A O no hydrogen 2.797 N/A ARG 245.A NH2 GLN 236.A O no hydrogen 2.848 N/A ARG 245.A NH2 GLN 236.A OE1 no hydrogen 3.195 N/A ARG 245.A NH2 CYS 238.A O no hydrogen 3.335 N/A GLN 246.A N PRO 242.A O no hydrogen 3.106 N/A GLN 246.A NE2 LEU 128.A O no hydrogen 2.860 N/A ALA 247.A N GLU 243.A O no hydrogen 2.864 N/A ILE 248.A N ALA 244.A O no hydrogen 2.846 N/A ARG 249.A N ARG 245.A O no hydrogen 2.981 N/A ARG 249.A NE GLU 232.A OE1 no hydrogen 3.304 N/A ARG 249.A NE GLU 232.A OE2 no hydrogen 3.081 N/A ARG 249.A NH1 GLU 232.A OE1 no hydrogen 2.876 N/A ARG 249.A NH1 GLU 253.A OE1 no hydrogen 2.972 N/A ARG 249.A NH2 GLU 253.A OE1 no hydrogen 2.956 N/A SER 250.A N.A GLN 246.A O no hydrogen 2.900 N/A SER 250.A N.B GLN 246.A O no hydrogen 2.912 N/A SER 250.A OG.A LEU 127.A O no hydrogen 2.982 N/A SER 250.A OG.A ASP 130.A O no hydrogen 2.730 N/A SER 250.A OG.B LEU 127.A O no hydrogen 2.537 N/A SER 250.A OG.B ASP 130.A O no hydrogen 3.285 N/A SER 250.A OG.B GLN 246.A O no hydrogen 3.209 N/A LEU 251.A N ALA 247.A O no hydrogen 2.827 N/A THR 252.A N ILE 248.A O no hydrogen 2.947 N/A THR 252.A OG1 ILE 248.A O no hydrogen 2.969 N/A GLU 253.A N ARG 249.A O no hydrogen 3.091 N/A ARG 254.A N SER 250.A O.A no hydrogen 2.873 N/A ARG 254.A N SER 250.A O.B no hydrogen 2.855 N/A ARG 254.A NE THR 133.A O no hydrogen 2.704 N/A ARG 254.A NH1 ASP 126.A OD2 no hydrogen 2.865 N/A ARG 254.A NH2 ASP 126.A O no hydrogen 3.219 N/A ARG 254.A NH2 ASP 126.A OD2 no hydrogen 2.925 N/A ARG 254.A NH2 ASP 130.A O no hydrogen 2.864 N/A LEU 255.A N LEU 251.A O no hydrogen 2.848 N/A TYR 256.A N LEU 251.A O no hydrogen 2.873 N/A TYR 256.A OH GLU 166.A OE1 no hydrogen 2.748 N/A ILE 257.A N THR 252.A O no hydrogen 2.979 N/A GLY 258.A N LEU 255.A O no hydrogen 3.271 N/A GLY 259.A N ARG 272.A O no hydrogen 3.190 N/A LEU 261.A N GLY 270.A O no hydrogen 2.785 N/A THR 262.A N THR 137.A O no hydrogen 2.870 N/A THR 262.A OG1 ASP 136.A OD1 no hydrogen 2.601 N/A ASN 263.A N GLN 267.A O no hydrogen 2.946 N/A ASN 263.A ND2 LEU 11.A O no hydrogen 2.928 N/A ASN 263.A ND2 GLN 267.A OE1 no hydrogen 2.839 N/A SER 264.A OG THR 13.A O no hydrogen 3.293 N/A SER 264.A OG THR 13.A OG1 no hydrogen 2.618 N/A SER 264.A OG PRO 14.A O no hydrogen 2.860 N/A LYS 265.A N ASN 263.A OD1 no hydrogen 3.030 N/A GLY 266.A N ASN 263.A O no hydrogen 3.028 N/A GLN 267.A N ASN 263.A OD1 no hydrogen 2.766 N/A ASN 268.A ND2 LEU 261.A O no hydrogen 3.288 N/A ASN 268.A ND2 GLY 270.A O no hydrogen 3.232 N/A CYS 269.A N.A LEU 261.A O no hydrogen 2.663 N/A CYS 269.A N.B LEU 261.A O no hydrogen 2.635 N/A CYS 269.A SG.A ALA 10.A O no hydrogen 3.957 N/A CYS 269.A SG.A LEU 11.A O no hydrogen 3.369 N/A CYS 269.A SG.A GLN 267.A O no hydrogen 3.996 N/A CYS 269.A SG.B ALA 10.A O no hydrogen 3.609 N/A GLY 270.A N LEU 261.A O no hydrogen 3.363 N/A TYR 271.A N THR 6.A O no hydrogen 2.900 N/A ARG 272.A N GLY 259.A O no hydrogen 2.891 N/A ARG 272.A NH1 LEU 255.A O no hydrogen 2.819 N/A ARG 272.A NH2 LEU 255.A O no hydrogen 3.226 N/A ARG 272.A NH2 TYR 256.A O no hydrogen 3.201 N/A ARG 272.A NH2 CYS 274.A O no hydrogen 2.922 N/A ARG 273.A N SER 4.A O no hydrogen 2.862 N/A ARG 273.A NE MET 3.A O no hydrogen 3.116 N/A CYS 274.A SG SER 4.A O no hydrogen 3.728 N/A CYS 274.A SG ARG 275.A O no hydrogen 3.691 N/A ARG 275.A N ASP 220.A O no hydrogen 3.180 N/A ARG 275.A NE ASN 286.A OD1 no hydrogen 2.759 N/A ARG 275.A NH1 GLU 231.A OE1 no hydrogen 3.297 N/A ARG 275.A NH1 GLU 231.A OE2 no hydrogen 2.478 N/A ARG 275.A NH1 ASN 286.A OD1 no hydrogen 3.144 N/A ARG 275.A NH2 GLU 231.A OE1 no hydrogen 2.841 N/A GLY 278.A N VAL 156.A O no hydrogen 2.810 N/A VAL 279.A N THR 282.A OG1 no hydrogen 3.130 N/A LEU 280.A N GLU 166.A OE1 no hydrogen 2.882 N/A THR 282.A N VAL 279.A O no hydrogen 3.232 N/A THR 282.A OG1 ALA 276.A O no hydrogen 2.703 N/A THR 282.A OG1 VAL 279.A O no hydrogen 3.051 N/A SER 283.A OG.B TYR 550.A O no hydrogen 2.719 N/A GLY 285.A N THR 281.A O no hydrogen 2.633 N/A ASN 286.A N THR 282.A O no hydrogen 2.964 N/A ASN 286.A ND2 ASP 220.A OD1 no hydrogen 2.990 N/A THR 287.A N SER 283.A O.A no hydrogen 2.893 N/A THR 287.A N SER 283.A O.B no hydrogen 2.903 N/A THR 287.A OG1 SER 283.A O.A no hydrogen 2.770 N/A THR 287.A OG1 SER 283.A O.B no hydrogen 2.702 N/A LEU 288.A N CYS 284.A O no hydrogen 2.949 N/A THR 289.A N GLY 285.A O no hydrogen 2.923 N/A THR 289.A OG1 GLU 231.A OE2 no hydrogen 2.401 N/A THR 289.A OG1 GLY 285.A O no hydrogen 3.015 N/A CYS 290.A N ASN 286.A O no hydrogen 2.767 N/A TYR 291.A N THR 287.A O no hydrogen 2.919 N/A LEU 292.A N LEU 288.A O no hydrogen 2.873 N/A LYS 293.A N THR 289.A O no hydrogen 3.006 N/A LYS 293.A NZ ASP 227.A OD2 no hydrogen 2.820 N/A LYS 293.A NZ TYR 341.A O no hydrogen 2.884 N/A LYS 293.A NZ SER 342.A O no hydrogen 3.111 N/A ALA 294.A N CYS 290.A O no hydrogen 2.861 N/A ALA 295.A N TYR 291.A O no hydrogen 2.713 N/A ALA 296.A N LEU 292.A O no hydrogen 3.066 N/A ALA 297.A N LYS 293.A O no hydrogen 2.796 N/A CYS 298.A N ALA 294.A O no hydrogen 2.811 N/A CYS 298.A SG ALA 294.A O no hydrogen 3.339 N/A ARG 299.A N ALA 295.A O no hydrogen 3.384 N/A ARG 299.A NH1 GLU 71.A OE1 no hydrogen 3.051 N/A ARG 299.A NH1 GLU 71.A OE2 no hydrogen 3.366 N/A ARG 299.A NH2 GLU 71.A OE2 no hydrogen 3.225 N/A ALA 300.A N ALA 296.A O no hydrogen 2.915 N/A ALA 301.A N ALA 297.A O no hydrogen 2.770 N/A LYS 302.A N ARG 299.A O no hydrogen 3.144 N/A LEU 303.A N CYS 298.A O no hydrogen 3.065 N/A GLN 304.A NE2 LYS 302.A O no hydrogen 3.555 N/A THR 307.A N ILE 318.A O no hydrogen 2.700 N/A LEU 309.A N VAL 316.A O no hydrogen 2.878 N/A VAL 310.A N SER 185.A O no hydrogen 2.925 N/A CYS 311.A N ASP 314.A O no hydrogen 2.931 N/A GLY 312.A N THR 287.A OG1 no hydrogen 2.880 N/A ASP 314.A N CYS 311.A O no hydrogen 2.958 N/A VAL 316.A N LEU 309.A O no hydrogen 3.064 N/A VAL 317.A N PHE 212.A O no hydrogen 3.016 N/A ILE 318.A N THR 307.A O no hydrogen 2.817 N/A CYS 319.A N MET 210.A O no hydrogen 2.733 N/A CYS 319.A SG MET 210.A O no hydrogen 3.708 N/A GLU 320.A N GLN 304.A O no hydrogen 2.896 N/A SER 321.A N CYS 208.A O no hydrogen 2.790 N/A SER 321.A OG ASP 327.A OD2 no hydrogen 2.663 N/A ALA 322.A N ASP 327.A OD1 no hydrogen 2.925 N/A GLY 323.A N SER 321.A OG no hydrogen 3.075 N/A GLU 326.A N GLU 326.A OE1 no hydrogen 2.833 N/A ASP 327.A N GLY 323.A O no hydrogen 2.769 N/A GLU 328.A N THR 324.A O no hydrogen 2.951 N/A ALA 329.A N GLN 325.A O no hydrogen 3.042 N/A SER 330.A N GLU 326.A O no hydrogen 2.945 N/A SER 330.A OG GLU 326.A O no hydrogen 2.863 N/A LEU 331.A N ASP 327.A O no hydrogen 2.885 N/A ARG 332.A N GLU 328.A O no hydrogen 3.037 N/A ALA 333.A N ALA 329.A O no hydrogen 2.971 N/A PHE 334.A N SER 330.A O no hydrogen 2.769 N/A THR 335.A N LEU 331.A O no hydrogen 2.893 N/A THR 335.A OG1 LEU 331.A O no hydrogen 2.921 N/A GLU 336.A N ARG 332.A O no hydrogen 2.898 N/A ALA 337.A N ALA 333.A O no hydrogen 3.043 N/A MET 338.A N PHE 334.A O no hydrogen 2.964 N/A THR 339.A N THR 335.A O no hydrogen 2.874 N/A THR 339.A OG1 THR 335.A O no hydrogen 2.740 N/A ARG 340.A N GLU 336.A O no hydrogen 2.979 N/A ARG 340.A NH1 ASP 62.A OD2 no hydrogen 3.448 N/A TYR 341.A N ALA 337.A O no hydrogen 2.964 N/A TYR 341.A OH ASP 62.A OD1 no hydrogen 2.667 N/A TYR 341.A OH ASP 62.A OD2 no hydrogen 3.230 N/A SER 342.A N THR 339.A O no hydrogen 2.968 N/A SER 342.A OG THR 222.A O no hydrogen 2.882 N/A ALA 343.A N MET 338.A O no hydrogen 2.752 N/A GLY 346.A N ASP 215.A O no hydrogen 2.733 N/A ASP 347.A N ASP 215.A OD2 no hydrogen 3.460 N/A GLU 352.A N GLY 211.A O no hydrogen 2.769 N/A TYR 353.A OH ASP 327.A OD2 no hydrogen 2.549 N/A GLU 356.A N ASP 354.A OD1 no hydrogen 3.067 N/A LEU 357.A N ASP 354.A O no hydrogen 3.108 N/A ILE 358.A N LEU 355.A O no hydrogen 3.269 N/A SER 360.A N SER 363.A O no hydrogen 2.935 N/A SER 363.A N SER 360.A O no hydrogen 2.918 N/A SER 363.A OG CYS 361.A O no hydrogen 2.949 N/A SER 363.A OG TYR 410.A OH no hydrogen 2.513 N/A ASN 364.A N THR 380.A O no hydrogen 2.882 N/A ASN 364.A ND2 GLU 356.A O no hydrogen 3.530 N/A ASN 364.A ND2 VAL 365.A O no hydrogen 2.951 N/A SER 366.A N TYR 378.A O no hydrogen 2.807 N/A ALA 368.A N VAL 376.A O no hydrogen 2.829 N/A HIS 369.A N HIS 470.A O no hydrogen 2.981 N/A HIS 369.A ND1 GLY 373.A O no hydrogen 3.072 N/A ASP 370.A N LYS 374.A O no hydrogen 3.000 N/A ALA 371.A N SER 468.A OG no hydrogen 2.958 N/A SER 372.A N ASP 370.A OD1 no hydrogen 2.879 N/A SER 372.A OG ASP 370.A OD1 no hydrogen 2.652 N/A GLY 373.A N ASP 370.A O no hydrogen 2.842 N/A LYS 374.A N ASP 370.A OD1 no hydrogen 3.143 N/A LYS 374.A NZ ASP 370.A OD2 no hydrogen 2.605 N/A VAL 376.A N ALA 368.A O no hydrogen 2.811 N/A TYR 378.A N SER 366.A O no hydrogen 2.968 N/A THR 380.A N ASN 364.A O no hydrogen 2.892 N/A THR 380.A OG1 ARG 381.A O no hydrogen 3.525 N/A THR 380.A OG1 GLU 476.A OE2 no hydrogen 2.667 N/A ARG 381.A NE ASP 382.A O no hydrogen 2.984 N/A THR 384.A N ASP 382.A OD1 no hydrogen 2.837 N/A THR 384.A OG1 ASP 382.A OD1 no hydrogen 2.466 N/A LEU 387.A N PRO 383.A O no hydrogen 2.888 N/A ALA 388.A N THR 384.A O no hydrogen 2.928 N/A ARG 389.A N THR 385.A O no hydrogen 2.923 N/A ARG 389.A NE VAL 145.A O no hydrogen 2.745 N/A ARG 389.A NH1 VAL 145.A O no hydrogen 3.205 N/A ALA 390.A N PRO 386.A O no hydrogen 2.935 N/A ALA 391.A N LEU 387.A O no hydrogen 2.946 N/A TRP 392.A N ALA 388.A O no hydrogen 3.146 N/A GLU 393.A N ARG 389.A O no hydrogen 2.864 N/A THR 394.A N ALA 390.A O no hydrogen 2.929 N/A THR 394.A N ALA 391.A O no hydrogen 3.309 N/A THR 394.A OG1 ALA 390.A O no hydrogen 2.671 N/A THR 394.A OG1 HIS 423.A NE2 no hydrogen 2.966 N/A ALA 395.A N ALA 391.A O no hydrogen 3.166 N/A ARG 396.A N TRP 392.A O no hydrogen 2.836 N/A ARG 396.A NE GLU 19.A OE1 no hydrogen 2.970 N/A ARG 396.A NE GLU 19.A OE2 no hydrogen 3.420 N/A THR 398.A OG1 VAL 400.A O no hydrogen 3.323 N/A ASN 401.A N ASP 439.A O no hydrogen 2.740 N/A SER 402.A N GLU 393.A OE2 no hydrogen 3.209 N/A SER 402.A OG GLU 393.A OE1 no hydrogen 3.174 N/A SER 402.A OG GLU 393.A OE2 no hydrogen 2.663 N/A TRP 403.A N GLU 393.A OE1 no hydrogen 3.228 N/A LEU 404.A N ASN 401.A O no hydrogen 2.957 N/A ASN 406.A N SER 402.A O no hydrogen 2.896 N/A ILE 407.A N TRP 403.A O no hydrogen 2.924 N/A ILE 408.A N LEU 404.A O no hydrogen 3.020 N/A MET 409.A N.A GLY 405.A O no hydrogen 2.785 N/A MET 409.A N.B GLY 405.A O no hydrogen 2.812 N/A TYR 410.A N ASN 406.A O no hydrogen 2.817 N/A TYR 410.A OH SER 363.A OG no hydrogen 2.513 N/A THR 413.A N TYR 410.A O no hydrogen 2.985 N/A THR 413.A OG1 TYR 410.A O no hydrogen 2.741 N/A TRP 415.A NE1 THR 380.A OG1 no hydrogen 3.143 N/A ALA 416.A N THR 413.A OG1 no hydrogen 3.053 N/A ARG 417.A N THR 413.A O no hydrogen 3.189 N/A ARG 417.A NH2 LEU 469.A O no hydrogen 3.005 N/A ARG 417.A NH2 TYR 472.A OH no hydrogen 2.967 N/A MET 418.A N LEU 414.A O no hydrogen 3.060 N/A ILE 419.A N TRP 415.A O no hydrogen 2.992 N/A LEU 420.A N TRP 415.A O no hydrogen 3.324 N/A MET 421.A N ALA 416.A O no hydrogen 2.992 N/A THR 422.A OG1 MET 418.A O no hydrogen 2.749 N/A HIS 423.A N ILE 419.A O no hydrogen 2.911 N/A HIS 423.A NE2 THR 394.A OG1 no hydrogen 2.966 N/A PHE 424.A N LEU 420.A O no hydrogen 3.035 N/A PHE 425.A N MET 421.A O no hydrogen 2.962 N/A SER 426.A N THR 422.A O no hydrogen 3.031 N/A ILE 427.A N HIS 423.A O no hydrogen 3.217 N/A LEU 428.A N PHE 424.A O no hydrogen 2.882 N/A LEU 429.A N PHE 425.A O no hydrogen 2.902 N/A ALA 430.A N SER 426.A O no hydrogen 3.059 N/A GLN 431.A N ILE 427.A O no hydrogen 2.821 N/A GLU 432.A N LEU 429.A O no hydrogen 3.174 N/A GLN 433.A N LEU 428.A O no hydrogen 2.906 N/A LYS 436.A N GLN 433.A O no hydrogen 3.172 N/A LEU 438.A N ILE 449.A O no hydrogen 2.818 N/A CYS 440.A N TYR 447.A O no hydrogen 2.783 N/A CYS 440.A SG TYR 447.A O no hydrogen 3.748 N/A ILE 442.A N ALA 445.A O no hydrogen 2.937 N/A TYR 443.A OH TYR 190.A O no hydrogen 2.633 N/A ALA 445.A N ILE 442.A O no hydrogen 3.143 N/A CYS 446.A N ILE 555.A O no hydrogen 2.849 N/A CYS 446.A SG CYS 440.A O no hydrogen 3.746 N/A TYR 447.A N CYS 440.A O no hydrogen 2.746 N/A SER 448.A N HIS 557.A O no hydrogen 2.893 N/A ILE 449.A N LEU 438.A O no hydrogen 2.876 N/A ASP 453.A N GLU 450.A O no hydrogen 2.894 N/A LEU 454.A N PRO 451.A O no hydrogen 3.064 N/A ILE 457.A N ASP 453.A O no hydrogen 3.072 N/A ILE 458.A N LEU 454.A O no hydrogen 2.816 N/A GLN 459.A N PRO 455.A O no hydrogen 3.013 N/A GLN 459.A NE2 ILE 534.A O no hydrogen 3.446 N/A ARG 460.A N GLN 456.A O no hydrogen 3.051 N/A ARG 460.A NH2 ALA 537.A O no hydrogen 2.976 N/A ARG 460.A NH2 LEU 540.A O no hydrogen 2.837 N/A LEU 461.A N ILE 457.A O no hydrogen 2.976 N/A HIS 462.A N ILE 458.A O no hydrogen 2.747 N/A HIS 462.A NE2 ILE 408.A O no hydrogen 2.694 N/A GLY 463.A N GLN 459.A O no hydrogen 2.819 N/A ALA 466.A N GLY 463.A O no hydrogen 3.217 N/A PHE 467.A N LEU 464.A O no hydrogen 3.101 N/A SER 468.A N SER 465.A O no hydrogen 3.051 N/A HIS 470.A N HIS 369.A O no hydrogen 2.680 N/A HIS 470.A ND1 SER 471.A OG no hydrogen 3.127 N/A HIS 470.A NE2 ASP 370.A O no hydrogen 3.084 N/A SER 471.A OG HIS 470.A ND1 no hydrogen 3.127 N/A TYR 472.A OH PRO 412.A O no hydrogen 2.639 N/A SER 473.A OG SER 366.A OG no hydrogen 3.332 N/A GLU 476.A N SER 473.A OG no hydrogen 3.083 N/A ILE 477.A N SER 473.A O no hydrogen 2.795 N/A ASN 478.A N PRO 474.A O no hydrogen 2.889 N/A ARG 479.A N GLY 475.A O no hydrogen 2.967 N/A ARG 479.A NH1 ASN 364.A OD1 no hydrogen 2.848 N/A ARG 479.A NH1 GLU 476.A OE1 no hydrogen 2.999 N/A ARG 479.A NH2 ASN 364.A OD1 no hydrogen 3.312 N/A VAL 480.A N GLU 476.A O no hydrogen 3.032 N/A ALA 481.A N ILE 477.A O no hydrogen 2.965 N/A SER 482.A N ASN 478.A O no hydrogen 2.849 N/A SER 482.A OG ASN 478.A O no hydrogen 2.958 N/A CYS 483.A N ARG 479.A O no hydrogen 3.005 N/A CYS 483.A SG THR 384.A OG1 no hydrogen 3.591 N/A LEU 484.A N VAL 480.A O no hydrogen 2.965 N/A ARG 485.A N ALA 481.A O no hydrogen 3.066 N/A LYS 486.A N SER 482.A O no hydrogen 2.985 N/A LYS 486.A NZ THR 384.A OG1 no hydrogen 2.782 N/A LEU 487.A N CYS 483.A O no hydrogen 2.933 N/A VAL 489.A N LEU 484.A O no hydrogen 2.889 N/A VAL 494.A N PRO 491.A O no hydrogen 2.890 N/A TRP 495.A N PRO 491.A O no hydrogen 3.291 N/A ARG 496.A N LEU 492.A O no hydrogen 2.841 N/A ARG 496.A NH2 TRP 523.A O no hydrogen 2.942 N/A HIS 497.A N ARG 493.A O no hydrogen 3.165 N/A ARG 498.A N VAL 494.A O no hydrogen 2.927 N/A ARG 498.A NH2 SER 30.A O no hydrogen 2.982 N/A ALA 499.A N TRP 495.A O no hydrogen 2.766 N/A ARG 500.A N ARG 496.A O no hydrogen 3.059 N/A ARG 500.A NE ALA 524.A O no hydrogen 2.791 N/A ARG 500.A NH1 ALA 524.A O no hydrogen 3.539 N/A SER 501.A N HIS 497.A O no hydrogen 3.479 N/A VAL 502.A N ARG 498.A O no hydrogen 3.004 N/A ARG 503.A N ALA 499.A O no hydrogen 2.764 N/A ALA 504.A N ARG 500.A O no hydrogen 3.078 N/A ARG 505.A N SER 501.A O no hydrogen 3.041 N/A ARG 505.A NH1 SER 426.A O no hydrogen 3.503 N/A ARG 505.A NH2 SER 501.A OG no hydrogen 3.409 N/A LEU 506.A N VAL 502.A O no hydrogen 2.921 N/A LEU 507.A N ARG 503.A O no hydrogen 2.858 N/A SER 508.A N ALA 504.A O no hydrogen 3.165 N/A SER 508.A OG ALA 504.A O no hydrogen 2.784 N/A GLN 509.A N LEU 506.A O no hydrogen 3.093 N/A GLY 510.A N LEU 507.A O no hydrogen 3.253 N/A ARG 512.A NH1 GLU 450.A OE1 no hydrogen 3.071 N/A ARG 512.A NH1 ASP 453.A OD1 no hydrogen 2.940 N/A ARG 512.A NH2 GLU 450.A OE1 no hydrogen 3.117 N/A ALA 514.A N GLY 510.A O no hydrogen 3.024 N/A THR 515.A N GLY 511.A O no hydrogen 3.220 N/A THR 515.A OG1 GLY 511.A O no hydrogen 3.477 N/A CYS 516.A N ARG 512.A O no hydrogen 2.872 N/A CYS 516.A SG PRO 451.A O no hydrogen 4.027 N/A CYS 516.A SG LEU 452.A O no hydrogen 3.668 N/A CYS 516.A SG ARG 512.A O no hydrogen 3.481 N/A GLY 517.A N ALA 513.A O no hydrogen 2.952 N/A LYS 518.A N ALA 514.A O no hydrogen 2.838 N/A TYR 519.A N THR 515.A O no hydrogen 2.863 N/A TYR 519.A OH THR 532.A O no hydrogen 2.497 N/A LEU 520.A N CYS 516.A O no hydrogen 2.911 N/A ALA 524.A N PHE 521.A O no hydrogen 2.957 N/A VAL 525.A N ASN 522.A O no hydrogen 3.415 N/A ILE 534.A N GLN 459.A OE1 no hydrogen 2.757 N/A ALA 537.A N ILE 534.A O no hydrogen 3.165 N/A SER 538.A OG PRO 535.A O no hydrogen 3.401 N/A GLN 539.A N ALA 536.A O no hydrogen 2.893 N/A LEU 540.A N ALA 537.A O no hydrogen 3.192 N/A ASP 541.A N SER 560.A O no hydrogen 2.841 N/A SER 543.A N ASP 541.A OD1 no hydrogen 3.036 N/A TRP 545.A N LEU 542.A O no hydrogen 3.031 N/A PHE 546.A N TYR 447.A OH no hydrogen 2.931 N/A GLY 549.A N TYR 443.A O no hydrogen 2.983 N/A SER 551.A N SER 277.A O no hydrogen 3.028 N/A GLY 553.A N GLY 549.A O no hydrogen 2.727 N/A TYR 556.A N LEU 92.A O no hydrogen 2.785 N/A TYR 556.A OH ASP 439.A OD1 no hydrogen 2.829 N/A HIS 557.A N CYS 446.A O no hydrogen 2.980 N/A HIS 557.A NE2 TYR 171.A OH no hydrogen 2.840 N/A LEU 559.A N SER 448.A O no hydrogen 3.218 N/A