Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ql0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N HIS 17.A O no hydrogen 2.978 N/A GLN 5.A NE2 ILE 7.A O no hydrogen 2.776 N/A ILE 8.A N CYS 27.A O no hydrogen 2.848 N/A HIS 9.A ND1 ASP 29.A OD2 no hydrogen 2.867 N/A LEU 10.A N ASP 29.A O no hydrogen 3.267 N/A SER 14.A OG PRO 15.A O no hydrogen 3.378 N/A VAL 16.A N VAL 94.A O no hydrogen 2.945 N/A HIS 17.A N ALA 1.A O no hydrogen 2.866 N/A HIS 17.A ND1 ASP 78.A OD1 no hydrogen 3.315 N/A ALA 18.A N TYR 96.A O no hydrogen 2.834 N/A VAL 19.A N GLU 3.A O no hydrogen 3.054 N/A CYS 20.A N THR 98.A O no hydrogen 2.843 N/A CYS 20.A SG VAL 21.A O no hydrogen 3.799 N/A LEU 22.A N ILE 100.A O no hydrogen 2.840 N/A THR 24.A N VAL 21.A O no hydrogen 3.185 N/A THR 24.A OG1 VAL 21.A O no hydrogen 2.620 N/A ILE 26.A N VAL 68.A O no hydrogen 2.820 N/A CYS 27.A N SER 6.A O no hydrogen 2.782 N/A LEU 28.A N ALA 66.A O no hydrogen 2.712 N/A ASP 29.A N ILE 8.A O no hydrogen 2.830 N/A LEU 30.A N THR 64.A O no hydrogen 2.890 N/A SER 31.A OG ASP 62.A O no hydrogen 2.884 N/A GLY 32.A N ASP 29.A OD1 no hydrogen 2.925 N/A CYS 33.A SG LEU 30.A O no hydrogen 3.904 N/A CYS 33.A SG TYR 86.A OH no hydrogen 3.237 N/A ALA 34.A N SER 31.A O no hydrogen 3.158 N/A CYS 38.A N PRO 35.A O no hydrogen 3.133 N/A CYS 38.A SG CYS 40.A O no hydrogen 3.337 N/A CYS 38.A SG TYR 87.A O no hydrogen 3.689 N/A GLN 39.A N TYR 87.A O no hydrogen 2.914 N/A CYS 40.A N TYR 87.A O no hydrogen 3.003 N/A PHE 41.A N TRP 58.A O no hydrogen 3.005 N/A THR 42.A N THR 85.A O no hydrogen 3.063 N/A HIS 44.A N SER 83.A O no hydrogen 2.998 N/A SER 46.A N LYS 81.A O no hydrogen 3.127 N/A SER 46.A OG ASP 80.A OD1 no hydrogen 2.965 N/A SER 46.A OG LYS 81.A O no hydrogen 3.563 N/A ARG 48.A NH1 ASP 80.A OD1 no hydrogen 3.464 N/A ARG 48.A NH1 ASP 80.A OD2 no hydrogen 2.938 N/A VAL 49.A N SER 46.A O no hydrogen 3.050 N/A LEU 50.A N LYS 69.A O no hydrogen 2.838 N/A ASP 52.A N THR 67.A O no hydrogen 2.831 N/A TRP 58.A N PHE 41.A O no hydrogen 2.887 N/A LEU 60.A N GLN 39.A O no hydrogen 3.026 N/A THR 64.A N SER 31.A OG no hydrogen 2.976 N/A THR 64.A OG1 SER 61.A O no hydrogen 2.877 N/A ALA 66.A N LEU 28.A O no hydrogen 3.077 N/A THR 67.A N ASP 52.A O no hydrogen 2.922 N/A THR 67.A OG1 ASP 52.A O no hydrogen 3.440 N/A VAL 68.A N ILE 26.A O no hydrogen 2.843 N/A LYS 69.A N LEU 50.A O no hydrogen 3.100 N/A THR 71.A N ARG 48.A O no hydrogen 2.911 N/A THR 71.A OG1 ARG 48.A O no hydrogen 3.226 N/A SER 74.A N GLY 99.A O no hydrogen 2.897 N/A SER 74.A OG ASP 80.A OD2 no hydrogen 3.436 N/A ASP 78.A N THR 98.A OG1 no hydrogen 2.896 N/A LYS 81.A N SER 46.A OG no hydrogen 2.981 N/A VAL 82.A N LEU 95.A O no hydrogen 2.865 N/A SER 83.A N HIS 44.A O no hydrogen 2.888 N/A VAL 84.A N ALA 93.A O no hydrogen 2.865 N/A THR 85.A N THR 42.A O no hydrogen 2.874 N/A TYR 86.A N GLY 91.A O no hydrogen 2.880 N/A TYR 86.A OH LEU 30.A O no hydrogen 2.587 N/A TYR 87.A N CYS 40.A O no hydrogen 2.817 N/A ALA 93.A N VAL 84.A O no hydrogen 2.940 N/A LEU 95.A N VAL 82.A O no hydrogen 2.969 N/A TYR 96.A N VAL 16.A O no hydrogen 2.755 N/A LEU 97.A N ASP 80.A O no hydrogen 3.004 N/A THR 98.A N ALA 18.A O no hydrogen 2.972 N/A GLY 99.A N SER 74.A OG no hydrogen 2.880 N/A ILE 100.A N CYS 20.A O no hydrogen 3.053 N/A GLU 101.A N GLN 168.A O no hydrogen 2.806 N/A SER 103.A N ASN 166.A O no hydrogen 2.848 N/A SER 103.A OG GLU 101.A OE1 no hydrogen 3.261 N/A SER 103.A OG GLU 105.A OE2 no hydrogen 3.141 N/A LEU 104.A N ASP 262.A OD2 no hydrogen 2.869 N/A GLU 105.A N THR 164.A O no hydrogen 2.767 N/A ARG 110.A N ASP 107.A O no hydrogen 3.211 N/A ARG 110.A NE GLY 134.A O no hydrogen 2.951 N/A ARG 110.A NH1 ILE 127.A O no hydrogen 3.449 N/A ARG 110.A NH1 GLY 129.A O no hydrogen 3.329 N/A ARG 110.A NH2 ILE 127.A O no hydrogen 2.753 N/A ASN 111.A N ASP 107.A OD1 no hydrogen 2.805 N/A ASN 111.A ND2 GLU 115.A OE1 no hydrogen 2.592 N/A GLY 112.A N ASP 107.A OD2 no hydrogen 2.811 N/A GLU 115.A N VAL 106.A O no hydrogen 3.249 N/A SER 117.A N GLU 105.A OE1 no hydrogen 3.144 N/A SER 117.A OG GLU 105.A OE1 no hydrogen 2.963 N/A SER 118.A N TYR 109.A OH no hydrogen 3.491 N/A SER 118.A OG TYR 109.A OH no hydrogen 3.093 N/A LYS 120.A NZ TYR 260.A OH no hydrogen 2.791 N/A GLN 121.A N ASP 119.A OD2 no hydrogen 3.042 N/A ALA 122.A N ASP 119.A OD2 no hydrogen 2.899 N/A LYS 123.A N ASP 119.A O no hydrogen 3.274 N/A LYS 123.A NZ LEU 104.A O no hydrogen 2.665 N/A LYS 123.A NZ ASP 262.A OD1 no hydrogen 3.217 N/A LYS 123.A NZ ASP 262.A OD2 no hydrogen 2.759 N/A LYS 124.A N GLN 121.A O no hydrogen 3.170 N/A LYS 124.A NZ GLN 121.A OE1 no hydrogen 2.794 N/A LYS 125.A N ALA 122.A O no hydrogen 3.022 N/A TRP 126.A NE1 ALA 135.A O no hydrogen 2.886 N/A ILE 127.A N TRP 133.A O no hydrogen 2.792 N/A GLY 129.A N TRP 637.A O no hydrogen 2.938 N/A GLY 132.A N GLY 129.A O no hydrogen 3.018 N/A TRP 133.A N ILE 127.A O no hydrogen 3.187 N/A TRP 133.A NE1 ALA 122.A O no hydrogen 2.823 N/A GLY 134.A N ILE 108.A O no hydrogen 2.836 N/A LEU 137.A N ARG 267.A O no hydrogen 2.922 N/A ASN 140.A N ALA 228.A O no hydrogen 2.962 N/A ASN 140.A ND2 GLU 227.A OE1 no hydrogen 3.168 N/A ASN 140.A ND2 GLU 227.A OE2 no hydrogen 3.248 N/A CYS 141.A SG.A VAL 139.A O no hydrogen 3.627 N/A ASN 142.A N ASN 140.A OD1 no hydrogen 2.850 N/A ASN 142.A ND2 GLU 156.A OE2 no hydrogen 3.064 N/A ALA 144.A N ASN 142.A OD1 no hydrogen 2.924 N/A ASP 145.A N ASN 142.A O no hydrogen 3.083 N/A VAL 146.A N PRO 143.A O no hydrogen 3.168 N/A LYS 150.A N PHE 200.A O no hydrogen 2.924 N/A LYS 150.A NZ TYR 194.A OH no hydrogen 2.932 N/A ILE 152.A N SER 198.A O no hydrogen 3.013 N/A GLU 156.A N PHE 153.A O no hydrogen 2.911 N/A ILE 157.A N PHE 153.A O no hydrogen 2.812 N/A ASN 159.A N GLU 156.A O no hydrogen 3.243 N/A LEU 160.A N ILE 157.A O no hydrogen 3.248 N/A SER 161.A N VAL 226.A O no hydrogen 2.890 N/A SER 161.A OG ILE 136.A O no hydrogen 2.737 N/A SER 161.A OG HIS 336.A NE2 no hydrogen 3.332 N/A MET 163.A N PHE 224.A O no hydrogen 2.987 N/A THR 164.A N GLU 105.A O no hydrogen 2.873 N/A THR 164.A OG1.A THR 223.A OG1 no hydrogen 3.157 N/A THR 164.A OG1.B GLU 222.A O no hydrogen 3.198 N/A LEU 165.A N GLU 222.A O no hydrogen 2.843 N/A ASN 166.A N SER 103.A O no hydrogen 2.828 N/A VAL 167.A N LEU 220.A O no hydrogen 2.944 N/A GLN 168.A N GLU 101.A O no hydrogen 2.991 N/A GLY 169.A N ASN 218.A O no hydrogen 3.016 N/A ILE 173.A N PRO 170.A O no hydrogen 2.904 N/A LEU 174.A N PRO 170.A O no hydrogen 2.946 N/A LYS 175.A N SER 171.A O no hydrogen 2.985 N/A LYS 175.A NZ CYS 172.A O no hydrogen 2.967 N/A LYS 176.A N ILE 173.A O no hydrogen 2.952 N/A TYR 177.A N LEU 174.A O no hydrogen 2.934 N/A ARG 178.A N VAL 247.A O no hydrogen 2.878 N/A ARG 178.A NH1 GLU 249.A OE2 no hydrogen 3.417 N/A ARG 178.A NH1 GLU 256.A OE1 no hydrogen 3.532 N/A ARG 178.A NH1 GLU 256.A OE2 no hydrogen 2.754 N/A ARG 178.A NH2 GLU 256.A OE1 no hydrogen 2.778 N/A ARG 178.A NH2 GLU 256.A OE2 no hydrogen 3.560 N/A LEU 179.A N LEU 213.A O no hydrogen 3.052 N/A VAL 180.A N SER 245.A O no hydrogen 2.944 N/A LEU 181.A N TYR 211.A O no hydrogen 2.862 N/A HIS 182.A N SER 243.A O no hydrogen 2.832 N/A HIS 182.A NE2 SER 245.A OG no hydrogen 2.604 N/A THR 183.A N HIS 209.A O no hydrogen 3.148 N/A THR 183.A OG1 SER 241.A O no hydrogen 2.477 N/A SER 184.A N GLU 187.A OE1 no hydrogen 3.354 N/A SER 184.A OG GLU 186.A OE2 no hydrogen 3.138 N/A SER 184.A OG GLU 187.A OE1 no hydrogen 2.634 N/A GLU 187.A N SER 184.A OG no hydrogen 3.305 N/A SER 188.A N SER 184.A O no hydrogen 2.977 N/A SER 188.A OG LYS 185.A O no hydrogen 2.747 N/A SER 188.A OG GLY 205.A O no hydrogen 3.384 N/A LYS 189.A N GLU 186.A O no hydrogen 3.189 N/A LYS 189.A NZ PRO 206.A O no hydrogen 3.366 N/A LYS 190.A N GLU 187.A O no hydrogen 2.942 N/A ARG 192.A N GLU 227.A O no hydrogen 2.849 N/A ARG 192.A NE GLU 227.A OE2 no hydrogen 2.928 N/A ARG 192.A NH2 GLU 227.A OE2 no hydrogen 2.695 N/A VAL 193.A N LEU 204.A O no hydrogen 2.818 N/A TYR 194.A N TYR 225.A O no hydrogen 2.781 N/A TRP 195.A N GLU 201.A O no hydrogen 2.867 N/A TRP 195.A NE1 GLU 222.A OE1 no hydrogen 2.787 N/A GLN 197.A N THR 199.A O no hydrogen 2.790 N/A PHE 200.A N LYS 150.A O no hydrogen 2.771 N/A GLU 201.A N TRP 195.A O no hydrogen 2.802 N/A LEU 202.A N THR 148.A O no hydrogen 2.922 N/A VAL 203.A N VAL 193.A O no hydrogen 2.877 N/A LEU 204.A N VAL 193.A O no hydrogen 3.456 N/A GLY 205.A N GLN 208.A O no hydrogen 2.858 N/A GLN 208.A N GLY 205.A O no hydrogen 3.043 N/A GLN 208.A NE2 VAL 203.A O no hydrogen 2.884 N/A TYR 211.A N LEU 181.A O no hydrogen 2.828 N/A TYR 211.A OH GLU 201.A OE2 no hydrogen 3.007 N/A LEU 213.A N LEU 179.A O no hydrogen 2.849 N/A HIS 219.A ND1 ASN 218.A OD1 no hydrogen 2.792 N/A LEU 220.A N VAL 167.A O no hydrogen 2.906 N/A LYS 221.A NZ ASN 166.A OD1 no hydrogen 3.329 N/A GLU 222.A N LEU 165.A O no hydrogen 3.037 N/A THR 223.A OG1 THR 164.A OG1.A no hydrogen 3.157 N/A PHE 224.A N MET 163.A O no hydrogen 2.846 N/A TYR 225.A N TYR 194.A O no hydrogen 2.895 N/A VAL 226.A N SER 161.A O no hydrogen 2.797 N/A GLU 227.A N ARG 192.A O no hydrogen 2.972 N/A ALA 228.A N LEU 138.A O no hydrogen 2.981 N/A ILE 229.A N LYS 190.A O no hydrogen 2.909 N/A SER 233.A N PHE 236.A O no hydrogen 2.877 N/A SER 233.A OG GLU 235.A OE1 no hydrogen 2.992 N/A PHE 236.A N SER 233.A O no hydrogen 3.214 N/A LEU 239.A N SER 237.A OG no hydrogen 3.110 N/A ILE 240.A N PHE 266.A O no hydrogen 2.933 N/A SER 241.A N GLU 187.A OE2 no hydrogen 2.782 N/A SER 241.A OG GLU 187.A OE2 no hydrogen 3.203 N/A TYR 242.A N VAL 264.A O no hydrogen 2.941 N/A SER 243.A N HIS 182.A O no hydrogen 2.789 N/A SER 243.A OG THR 263.A OG1 no hydrogen 2.752 N/A VAL 244.A N ASP 262.A O no hydrogen 2.916 N/A SER 245.A N VAL 180.A O no hydrogen 2.898 N/A SER 245.A OG HIS 182.A NE2 no hydrogen 2.604 N/A LEU 246.A N TYR 260.A O no hydrogen 2.894 N/A VAL 247.A N ARG 178.A O no hydrogen 2.817 N/A GLU 248.A N THR 257.A O no hydrogen 2.817 N/A SER 250.A OG ASP 251.A O no hydrogen 2.630 N/A SER 250.A OG ILE 254.A O no hydrogen 2.751 N/A SER 253.A N ASP 251.A OD1 no hydrogen 2.930 N/A SER 253.A OG ASP 251.A OD1 no hydrogen 2.597 N/A THR 257.A N GLU 248.A O no hydrogen 3.495 N/A LEU 259.A N LEU 246.A O no hydrogen 2.970 N/A ASP 262.A N VAL 244.A O no hydrogen 2.952 N/A THR 263.A OG1 SER 243.A OG no hydrogen 2.752 N/A VAL 264.A N TYR 242.A O no hydrogen 2.879 N/A PHE 266.A N ILE 240.A O no hydrogen 2.781 N/A ARG 267.A N ALA 135.A O no hydrogen 2.959 N/A ARG 267.A NH1 SER 237.A O no hydrogen 3.219 N/A VAL 268.A N GLY 238.A O no hydrogen 2.763 N/A ALA 269.A N LEU 137.A O no hydrogen 2.875 N/A CYS 271.A N GLN 426.A OE1 no hydrogen 2.802 N/A VAL 272.A N TYR 331.A O no hydrogen 2.797 N/A PHE 273.A N GLN 429.A OE1 no hydrogen 2.992 N/A CYS 276.A SG.A PHE 450.A O no hydrogen 2.912 N/A GLN 278.A N PRO 275.A O no hydrogen 3.115 N/A GLN 278.A NE2 VAL 630.A O no hydrogen 2.902 N/A LEU 281.A N ARG 628.A O no hydrogen 2.805 N/A GLU 282.A N ARG 628.A O no hydrogen 3.125 N/A VAL 283.A N GLN 308.A O no hydrogen 2.748 N/A TYR 284.A N ASN 626.A O no hydrogen 2.911 N/A TYR 284.A OH GLU 282.A OE1 no hydrogen 2.621 N/A LEU 285.A N ALA 310.A O no hydrogen 2.883 N/A CYS 286.A N CYS 624.A O no hydrogen 2.968 N/A CYS 286.A SG GLU 288.A OE1.B no hydrogen 3.482 N/A CYS 286.A SG TYR 313.A O no hydrogen 3.575 N/A ARG 287.A NH2 SER 311.A OG no hydrogen 2.799 N/A GLN 290.A N ARG 287.A O no hydrogen 3.054 N/A GLN 290.A NE2 GLU 288.A O no hydrogen 3.661 N/A PHE 294.A N ASP 610.A OD2 no hydrogen 2.968 N/A ASP 296.A N LEU 291.A O no hydrogen 2.828 N/A THR 297.A N GLY 293.A O no hydrogen 3.021 N/A THR 297.A OG1 GLY 293.A O no hydrogen 2.719 N/A VAL 298.A N PHE 294.A O no hydrogen 2.886 N/A THR 299.A N VAL 295.A O no hydrogen 2.999 N/A THR 299.A OG1 VAL 295.A O no hydrogen 2.519 N/A LYS 300.A N ASP 296.A O no hydrogen 2.924 N/A LYS 300.A NZ ASP 296.A OD2 no hydrogen 2.807 N/A LEU 301.A N THR 297.A O no hydrogen 2.837 N/A SER 302.A N VAL 298.A O no hydrogen 2.982 N/A SER 302.A OG SER 307.A O no hydrogen 2.924 N/A GLU 303.A N THR 299.A O no hydrogen 3.157 N/A LYS 304.A N LYS 300.A O no hydrogen 3.115 N/A LYS 304.A NZ THR 606.A OG1 no hydrogen 3.367 N/A SER 305.A N SER 302.A O no hydrogen 3.154 N/A SER 305.A OG LEU 301.A O no hydrogen 2.835 N/A ASN 306.A N.A GLU 303.A O no hydrogen 3.363 N/A ASN 306.A N.B GLU 303.A O no hydrogen 3.357 N/A SER 307.A N SER 302.A O no hydrogen 2.977 N/A SER 307.A OG GLN 308.A O no hydrogen 3.512 N/A GLN 308.A N LEU 281.A O no hydrogen 3.158 N/A ALA 310.A N VAL 283.A O no hydrogen 2.838 N/A VAL 312.A N LEU 285.A O no hydrogen 2.884 N/A ASN 317.A N ASP 315.A OD1 no hydrogen 3.110 N/A ARG 318.A N ASP 315.A O no hydrogen 3.182 N/A ARG 318.A NE ASP 315.A OD2 no hydrogen 3.188 N/A ARG 318.A NH1 ASP 344.A OD1 no hydrogen 3.461 N/A ARG 318.A NH1 ASP 344.A OD2 no hydrogen 2.676 N/A ARG 318.A NH2 GLU 326.A OE1 no hydrogen 2.912 N/A ARG 318.A NH2 ASP 344.A OD1 no hydrogen 2.813 N/A GLY 320.A N GLY 619.A O no hydrogen 3.299 N/A ARG 321.A NE ASP 325.A OD1 no hydrogen 3.172 N/A ARG 321.A NH2 ASP 325.A OD1 no hydrogen 2.899 N/A GLN 324.A N ARG 321.A O no hydrogen 3.165 N/A ASP 325.A N ARG 321.A O no hydrogen 2.918 N/A GLU 326.A N TRP 322.A O no hydrogen 2.835 N/A ALA 328.A N LEU 343.A O no hydrogen 2.990 N/A CYS 330.A N LEU 341.A O no hydrogen 2.929 N/A CYS 330.A SG ALA 328.A O no hydrogen 3.674 N/A CYS 330.A SG LEU 341.A O no hydrogen 3.815 N/A TYR 331.A N VAL 272.A O no hydrogen 2.933 N/A THR 332.A N THR 339.A O no hydrogen 2.872 N/A THR 332.A OG1 ALA 269.A O no hydrogen 3.383 N/A THR 332.A OG1 PRO 270.A O no hydrogen 2.932 N/A ALA 334.A N LYS 337.A O no hydrogen 2.775 N/A HIS 336.A ND1 THR 158.A O no hydrogen 2.783 N/A LYS 337.A N ALA 334.A O no hydrogen 3.147 N/A LYS 337.A NZ ASN 159.A OD1 no hydrogen 2.746 N/A LYS 337.A NZ THR 339.A OG1 no hydrogen 2.776 N/A THR 339.A N THR 332.A O no hydrogen 2.806 N/A LEU 341.A N CYS 330.A O no hydrogen 2.905 N/A ILE 342.A N GLY 365.A O no hydrogen 3.054 N/A LEU 343.A N ALA 328.A O no hydrogen 2.892 N/A ASP 344.A N MET 367.A O no hydrogen 2.859 N/A THR 345.A N GLU 326.A O no hydrogen 2.857 N/A THR 345.A OG1 GLU 326.A O no hydrogen 3.517 N/A THR 345.A OG1 THR 345.A O no hydrogen 2.670 N/A GLN 347.A N GLU 326.A OE1 no hydrogen 3.274 N/A GLN 347.A NE2 ASP 380.A O no hydrogen 3.360 N/A LYS 357.A N PHE 354.A O no hydrogen 3.166 N/A TYR 358.A N PRO 355.A O no hydrogen 3.288 N/A SER 359.A N MET 356.A O no hydrogen 3.127 N/A SER 359.A OG SER 311.A O no hydrogen 2.383 N/A LEU 360.A N MET 356.A O no hydrogen 3.277 N/A SER 361.A OG GLU 282.A OE1 no hydrogen 3.523 N/A SER 361.A OG GLU 282.A OE2 no hydrogen 2.606 N/A ILE 364.A N SER 361.A O no hydrogen 2.983 N/A GLY 365.A N SER 340.A O no hydrogen 2.853 N/A TYR 366.A N CYS 141.A O.A no hydrogen 2.884 N/A TYR 366.A N CYS 141.A O.B no hydrogen 2.837 N/A TYR 366.A OH ASP 344.A OD2 no hydrogen 2.739 N/A MET 367.A N ILE 342.A O no hydrogen 2.953 N/A GLN 369.A N ASP 344.A O no hydrogen 2.825 N/A GLN 369.A NE2 ASP 370.A O no hydrogen 2.964 N/A GLU 372.A N ASP 380.A OD2 no hydrogen 2.758 N/A ASP 373.A N ASP 380.A OD2 no hydrogen 2.762 N/A LYS 375.A NZ ASP 373.A OD1 no hydrogen 2.979 N/A SER 378.A N LYS 375.A O no hydrogen 3.264 N/A SER 378.A OG ASP 373.A O no hydrogen 2.880 N/A SER 378.A OG ASP 373.A OD2 no hydrogen 3.072 N/A ASP 380.A N SER 378.A OG no hydrogen 3.072 N/A SER 381.A OG ASP 325.A O no hydrogen 2.831 N/A ILE 382.A N THR 345.A OG1 no hydrogen 2.919 N/A ASN 384.A N SER 381.A O no hydrogen 2.891 N/A ASN 384.A ND2 MET 379.A O no hydrogen 2.843 N/A ASN 384.A ND2 GLY 406.A O no hydrogen 3.024 N/A MET 386.A N LEU 404.A O no hydrogen 2.985 N/A SER 388.A N ARG 402.A O no hydrogen 2.897 N/A SER 388.A OG PRO 389.A O no hydrogen 2.957 N/A SER 388.A OG ARG 402.A O no hydrogen 3.357 N/A VAL 391.A N TYR 398.A O no hydrogen 3.242 N/A VAL 393.A N LYS 396.A O no hydrogen 2.850 N/A LYS 396.A N VAL 393.A O no hydrogen 2.904 N/A LYS 396.A NZ PRO 641.A OXT no hydrogen 2.956 N/A TYR 398.A N VAL 391.A O no hydrogen 2.842 N/A GLY 401.A N TYR 398.A O no hydrogen 2.946 N/A ARG 402.A N SER 388.A OG no hydrogen 2.773 N/A ARG 402.A NE ALA 430.A O no hydrogen 2.759 N/A ARG 402.A NH1 GLU 534.A O no hydrogen 2.964 N/A ARG 402.A NH1 GLU 534.A OE1 no hydrogen 2.956 N/A ARG 402.A NH2 ALA 430.A O no hydrogen 2.969 N/A VAL 403.A N GLN 429.A O no hydrogen 2.968 N/A LEU 404.A N MET 386.A O no hydrogen 2.696 N/A ILE 405.A N VAL 432.A O no hydrogen 2.979 N/A GLY 406.A N ASN 384.A OD1 no hydrogen 3.100 N/A SER 407.A N LEU 434.A O no hydrogen 2.798 N/A ARG 413.A NH1 ALA 377.A O no hydrogen 2.928 N/A ARG 413.A NH1 MET 440.A O no hydrogen 2.912 N/A ARG 413.A NH2 ASP 437.A O no hydrogen 2.883 N/A ARG 413.A NH2 LEU 439.A O no hydrogen 2.829 N/A SER 416.A N ASP 380.A OD1 no hydrogen 2.953 N/A SER 416.A OG ASP 380.A OD1 no hydrogen 2.712 N/A SER 416.A OG ASP 380.A OD2 no hydrogen 3.213 N/A THR 418.A N GLU 372.A OE2 no hydrogen 3.366 N/A THR 418.A OG1 GLU 372.A OE2 no hydrogen 2.612 N/A LEU 419.A N SER 416.A OG no hydrogen 3.265 N/A ARG 420.A N SER 416.A O no hydrogen 2.944 N/A ARG 420.A NH1.B GLU 433.A OE1 no hydrogen 3.100 N/A ASP 421.A N LYS 417.A O no hydrogen 2.895 N/A PHE 422.A N THR 418.A O no hydrogen 3.075 N/A LEU 423.A N LEU 419.A O no hydrogen 3.056 N/A TYR 424.A N ARG 420.A O no hydrogen 3.044 N/A TYR 424.A OH GLU 433.A OE1 no hydrogen 2.584 N/A ALA 425.A N ASP 421.A O no hydrogen 2.885 N/A GLN 426.A N LEU 423.A O no hydrogen 3.155 N/A GLN 426.A NE2 PRO 232.A O no hydrogen 2.852 N/A GLN 426.A NE2 PHE 422.A O no hydrogen 2.844 N/A GLN 427.A N TYR 424.A O no hydrogen 3.348 N/A VAL 428.A N GLN 426.A O no hydrogen 2.896 N/A GLN 429.A NE2 PHE 273.A O no hydrogen 2.831 N/A GLN 429.A NE2 LEU 400.A O no hydrogen 2.919 N/A VAL 432.A N VAL 403.A O no hydrogen 2.846 N/A LEU 434.A N ILE 405.A O no hydrogen 2.814 N/A TYR 435.A N ASN 527.A OD1 no hydrogen 2.798 N/A SER 436.A N SER 407.A O no hydrogen 2.906 N/A SER 436.A OG GLY 442.A O no hydrogen 2.592 N/A ASP 437.A N SER 407.A O no hydrogen 3.108 N/A TRP 438.A NE1 TYR 435.A O no hydrogen 2.893 N/A LEU 439.A N SER 436.A O no hydrogen 3.025 N/A MET 440.A N ALA 557.A O no hydrogen 2.843 N/A THR 441.A OG1 GLU 446.A OE1 no hydrogen 3.274 N/A GLY 442.A N LEU 439.A O no hydrogen 2.953 N/A HIS 443.A N THR 441.A OG1 no hydrogen 3.162 N/A GLU 446.A N HIS 443.A O no hydrogen 3.239 N/A PHE 447.A N VAL 444.A O no hydrogen 2.976 N/A MET 448.A N VAL 444.A O no hydrogen 3.112 N/A CYS 449.A N LEU 461.A O no hydrogen 3.047 N/A CYS 449.A SG PHE 450.A O no hydrogen 3.829 N/A ILE 451.A N LEU 459.A O no hydrogen 3.031 N/A THR 453.A N GLY 457.A O no hydrogen 2.994 N/A LYS 455.A NZ PHE 458.A O no hydrogen 3.267 N/A LYS 456.A NZ GLY 536.A O no hydrogen 2.876 N/A LYS 456.A NZ ASP 541.A OD2 no hydrogen 2.695 N/A LEU 459.A N ILE 451.A O no hydrogen 3.014 N/A LEU 460.A N ASP 541.A O no hydrogen 2.807 N/A LEU 461.A N CYS 449.A O no hydrogen 2.795 N/A LEU 462.A N ILE 543.A O no hydrogen 3.006 N/A ALA 463.A N PHE 447.A O no hydrogen 2.794 N/A SER 464.A N ILE 545.A O no hydrogen 2.808 N/A SER 464.A OG SER 466.A OG no hydrogen 3.183 N/A SER 464.A OG GLU 544.A OE1 no hydrogen 3.387 N/A SER 466.A N GLU 521.A OE1 no hydrogen 2.959 N/A SER 466.A OG SER 464.A OG no hydrogen 3.183 N/A SER 466.A OG GLU 521.A OE1 no hydrogen 3.385 N/A SER 466.A OG GLU 521.A OE2 no hydrogen 2.786 N/A ALA 467.A N SER 464.A OG no hydrogen 3.150 N/A CYS 468.A N SER 464.A O no hydrogen 3.302 N/A TYR 469.A N PRO 465.A O no hydrogen 2.945 N/A LYS 470.A N SER 466.A O no hydrogen 2.889 N/A LEU 471.A N ALA 467.A O no hydrogen 3.024 N/A PHE 472.A N CYS 468.A O no hydrogen 2.977 N/A ARG 473.A N TYR 469.A O no hydrogen 2.865 N/A GLU 474.A N LYS 470.A O no hydrogen 3.114 N/A LYS 475.A N LEU 471.A O no hydrogen 3.104 N/A LYS 475.A NZ GLU 478.A OE1 no hydrogen 3.133 N/A GLN 476.A N PHE 472.A O no hydrogen 2.919 N/A LYS 477.A N ARG 473.A O no hydrogen 3.001 N/A GLU 478.A N GLU 474.A O no hydrogen 3.048 N/A GLY 479.A N GLN 476.A O no hydrogen 3.079 N/A TYR 480.A N LYS 475.A O no hydrogen 2.941 N/A ALA 483.A N TYR 480.A O no hydrogen 2.866 N/A LEU 485.A N LYS 502.A O no hydrogen 2.827 N/A PHE 486.A N PHE 580.A O no hydrogen 2.804 N/A ASP 487.A N LEU 484.A O no hydrogen 3.358 N/A ARG 490.A N.A GLN 493.A OE1 no hydrogen 3.139 N/A ARG 490.A N.B GLN 493.A OE1 no hydrogen 3.137 N/A LEU 494.A N ARG 490.A O.A no hydrogen 3.089 N/A LEU 494.A N ARG 490.A O.B no hydrogen 3.089 N/A LEU 495.A N ALA 491.A O no hydrogen 2.942 N/A SER 496.A N ASP 492.A O no hydrogen 2.888 N/A SER 496.A OG ASP 492.A O no hydrogen 2.925 N/A SER 496.A OG GLN 493.A O no hydrogen 3.528 N/A ASN 497.A N LEU 494.A O no hydrogen 3.007 N/A ASN 497.A ND2 GLN 493.A O no hydrogen 2.719 N/A ASN 497.A ND2 ASP 612.A OD1 no hydrogen 2.926 N/A GLY 498.A N LEU 495.A O no hydrogen 3.198 N/A ARG 499.A N LEU 494.A O no hydrogen 2.992 N/A ARG 499.A NE TYR 560.A O no hydrogen 2.719 N/A ARG 499.A NH1 GLU 552.A OE2 no hydrogen 3.040 N/A ARG 499.A NH1 PRO 559.A O no hydrogen 2.848 N/A ARG 499.A NH2 GLY 498.A O no hydrogen 3.104 N/A ARG 499.A NH2 GLU 552.A OE2 no hydrogen 2.833 N/A LYS 502.A N LEU 485.A O no hydrogen 3.284 N/A LYS 502.A NZ GLU 500.A OE2 no hydrogen 2.721 N/A THR 503.A N GLN 506.A OE1 no hydrogen 2.975 N/A ILE 504.A N ALA 483.A O no hydrogen 2.906 N/A ASP 505.A N GLY 481.A O no hydrogen 3.035 N/A GLN 506.A N THR 503.A OG1 no hydrogen 3.062 N/A LEU 507.A N.A THR 503.A O no hydrogen 2.911 N/A LEU 507.A N.B THR 503.A O no hydrogen 2.908 N/A LEU 508.A N ILE 504.A O no hydrogen 2.890 N/A ALA 509.A N ASP 505.A O no hydrogen 3.159 N/A ALA 509.A N GLN 506.A O no hydrogen 3.296 N/A ASP 510.A N LEU 507.A O.A no hydrogen 3.245 N/A ASP 510.A N LEU 507.A O.B no hydrogen 3.307 N/A LEU 513.A N ASP 510.A OD1 no hydrogen 3.070 N/A LYS 514.A N ASP 510.A O no hydrogen 3.159 N/A LYS 514.A NZ GLU 511.A OE1 no hydrogen 3.246 N/A LYS 515.A N GLU 511.A O no hydrogen 2.999 N/A GLN 516.A N SER 512.A O no hydrogen 2.950 N/A GLN 516.A NE2 SER 512.A O no hydrogen 3.334 N/A GLN 516.A NE2 SER 512.A OG no hydrogen 2.844 N/A ASN 517.A N LEU 513.A O no hydrogen 2.933 N/A ASN 517.A ND2 LEU 513.A O no hydrogen 2.961 N/A ASN 517.A ND2 PHE 549.A O no hydrogen 2.957 N/A GLU 518.A N LYS 514.A O no hydrogen 2.853 N/A TYR 519.A N LYS 515.A O no hydrogen 3.118 N/A TYR 519.A OH TYR 410.A OH no hydrogen 2.702 N/A VAL 520.A N GLN 516.A O no hydrogen 3.126 N/A GLU 521.A N ASN 517.A O no hydrogen 2.824 N/A LYS 522.A N GLU 518.A O no hydrogen 3.054 N/A CYS 523.A N TYR 519.A O no hydrogen 3.158 N/A CYS 523.A SG TYR 519.A O no hydrogen 3.377 N/A ILE 524.A N VAL 520.A O no hydrogen 2.932 N/A HIS 525.A N GLU 521.A O no hydrogen 2.966 N/A HIS 525.A ND1 GLU 521.A O no hydrogen 2.985 N/A LEU 526.A N LYS 522.A O no hydrogen 3.195 N/A ASN 527.A ND2 TYR 435.A O no hydrogen 2.857 N/A ASN 527.A ND2 CYS 523.A O no hydrogen 2.848 N/A ARG 528.A N ILE 524.A O no hydrogen 2.811 N/A ARG 528.A NE GLU 539.A OE1 no hydrogen 2.837 N/A ARG 528.A NH1 GLU 539.A OE1 no hydrogen 3.437 N/A ARG 528.A NH1 GLU 539.A OE2 no hydrogen 2.645 N/A ARG 528.A NH1 GLU 544.A OE2 no hydrogen 3.259 N/A ARG 528.A NH2 GLU 544.A OE2 no hydrogen 2.972 N/A ASP 529.A N HIS 525.A O no hydrogen 3.162 N/A ILE 530.A N LEU 526.A O no hydrogen 3.259 N/A LEU 531.A N ASN 527.A O no hydrogen 2.854 N/A LYS 532.A N ARG 528.A O no hydrogen 2.898 N/A LYS 532.A NZ GLU 539.A OE1 no hydrogen 2.628 N/A THR 533.A N ASP 529.A O no hydrogen 3.007 N/A THR 533.A OG1 ASP 529.A O no hydrogen 3.164 N/A GLU 534.A N ILE 530.A O no hydrogen 2.818 N/A LEU 535.A N LEU 531.A O no hydrogen 2.894 N/A LEU 537.A N LYS 532.A O no hydrogen 3.094 N/A VAL 538.A N ASP 541.A OD2 no hydrogen 2.997 N/A GLN 540.A N GLN 540.A OE1 no hydrogen 2.843 N/A ASP 541.A N VAL 538.A O no hydrogen 2.978 N/A ILE 542.A N GLU 539.A O no hydrogen 2.999 N/A ILE 543.A N LEU 460.A O no hydrogen 2.852 N/A ILE 545.A N LEU 462.A O no hydrogen 2.851 N/A GLN 547.A N SER 464.A O no hydrogen 3.260 N/A GLN 547.A NE2 LEU 548.A O no hydrogen 2.985 N/A GLN 547.A NE2 PHE 561.A O no hydrogen 3.351 N/A PHE 549.A N ASN 517.A OD1 no hydrogen 2.934 N/A CYS 550.A N ARG 558.A O no hydrogen 2.919 N/A CYS 550.A SG GLU 552.A OE2 no hydrogen 3.308 N/A CYS 550.A SG ARG 558.A O no hydrogen 3.898 N/A LEU 551.A N GLN 516.A OE1 no hydrogen 2.901 N/A GLU 552.A N PHE 556.A O no hydrogen 2.929 N/A ARG 554.A NE SER 555.A O no hydrogen 3.032 N/A ARG 554.A NH2 SER 555.A O no hydrogen 2.899 N/A PHE 556.A N GLU 552.A O no hydrogen 2.867 N/A ALA 557.A N TRP 438.A O no hydrogen 2.822 N/A ARG 558.A N CYS 550.A O no hydrogen 2.874 N/A ARG 558.A NH1 LEU 615.A O no hydrogen 2.945 N/A ARG 558.A NH1 THR 616.A O no hydrogen 3.445 N/A ARG 558.A NH2 GLU 552.A OE1 no hydrogen 3.090 N/A ARG 558.A NH2 GLU 552.A OE2 no hydrogen 3.390 N/A TYR 560.A N LEU 548.A O no hydrogen 2.959 N/A LEU 564.A N GLN 547.A OE1 no hydrogen 2.934 N/A LEU 565.A N ASP 563.A OD1 no hydrogen 3.116 N/A ARG 566.A N.A ASP 563.A O no hydrogen 2.960 N/A ARG 566.A N.B ASP 563.A O no hydrogen 2.979 N/A ARG 566.A NH1.A GLN 324.A OE1 no hydrogen 3.164 N/A ILE 568.A N GLY 575.A O no hydrogen 2.827 N/A MET 570.A N.A ASN 573.A O no hydrogen 2.865 N/A MET 570.A N.B ASN 573.A O no hydrogen 2.881 N/A LYS 572.A NZ LEU 601.A O no hydrogen 3.443 N/A ASN 573.A N MET 570.A O.A no hydrogen 2.943 N/A ASN 573.A N MET 570.A O.B no hydrogen 2.994 N/A ASN 573.A ND2 SER 305.A OG no hydrogen 2.898 N/A LEU 574.A N LYS 604.A O no hydrogen 2.870 N/A GLY 575.A N ILE 568.A O no hydrogen 2.865 N/A ILE 576.A N THR 606.A O no hydrogen 2.839 N/A LYS 578.A N ILE 608.A O no hydrogen 3.052 N/A LYS 578.A NZ GLU 591.A OE1 no hydrogen 2.711 N/A ILE 584.A N THR 587.A O no hydrogen 2.888 N/A LYS 585.A NZ TYR 480.A OH no hydrogen 2.776 N/A THR 587.A N ILE 584.A O no hydrogen 3.428 N/A CYS 589.A N PRO 582.A O no hydrogen 2.952 N/A CYS 589.A SG PRO 582.A O no hydrogen 3.406 N/A GLU 592.A N CYS 588.A O no hydrogen 3.002 N/A LYS 593.A N CYS 589.A O no hydrogen 2.955 N/A ILE 594.A N LEU 590.A O no hydrogen 2.983 N/A CYS 595.A N GLU 591.A O no hydrogen 2.911 N/A CYS 595.A SG GLU 591.A O no hydrogen 3.265 N/A CYS 595.A SG GLU 599.A OE2 no hydrogen 3.359 N/A CYS 596.A N GLU 592.A O no hydrogen 2.894 N/A CYS 596.A SG GLU 592.A O no hydrogen 3.373 N/A LEU 597.A N LYS 593.A O no hydrogen 3.069 N/A LEU 598.A N ILE 594.A O no hydrogen 2.896 N/A GLU 599.A N CYS 595.A O no hydrogen 2.861 N/A LEU 601.A N LEU 598.A O no hydrogen 3.075 N/A GLY 602.A N GLU 599.A O no hydrogen 2.913 N/A PHE 603.A N LEU 598.A O no hydrogen 3.373 N/A LYS 604.A N LYS 572.A O no hydrogen 2.877 N/A THR 606.A N LEU 574.A O no hydrogen 2.881 N/A ILE 608.A N ILE 576.A O no hydrogen 2.816 N/A CYS 613.A N ASP 610.A OD1 no hydrogen 3.250 N/A CYS 613.A SG ALA 623.A O no hydrogen 3.517 N/A TYR 614.A N ASP 610.A O no hydrogen 3.169 N/A LEU 615.A N PHE 611.A O no hydrogen 3.000 N/A THR 616.A N CYS 613.A O no hydrogen 3.278 N/A THR 616.A OG1 ASP 612.A O no hydrogen 2.750 N/A THR 616.A OG1 CYS 613.A O no hydrogen 2.866 N/A ASP 620.A N GLU 617.A O no hydrogen 3.040 N/A CYS 622.A SG ALA 623.A O no hydrogen 3.709 N/A CYS 624.A N CYS 286.A O no hydrogen 3.235 N/A ASN 626.A N TYR 284.A O no hydrogen 2.977 N/A ASN 626.A ND2 LEU 323.A O no hydrogen 2.796 N/A ASN 626.A ND2 MET 327.A O no hydrogen 3.080 N/A ARG 628.A N GLU 282.A O no hydrogen 2.797 N/A ARG 628.A NE GLU 282.A OE1 no hydrogen 2.752 N/A ARG 628.A NH1 GLU 282.A OE1 no hydrogen 3.430 N/A ARG 629.A NH1 GLN 278.A O no hydrogen 3.000 N/A ARG 629.A NH1 VAL 569.A O no hydrogen 3.006 N/A ARG 629.A NH2 VAL 569.A O no hydrogen 2.843 N/A VAL 630.A N VAL 279.A O no hydrogen 2.873 N/A TRP 636.A NE1 GLN 333.A O no hydrogen 2.663 N/A LYS 638.A N LYS 635.A O no hydrogen 3.018 N/A MET 639.A N TRP 636.A O no hydrogen 3.225 N/A