Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xxn_3A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 6.A N GLU 6.A OE1 no hydrogen 2.655 N/A ALA 8.A N ARG 4.A O no hydrogen 3.055 N/A LEU 9.A N PRO 5.A O no hydrogen 2.849 N/A LYS 10.A N GLU 6.A O no hydrogen 2.968 N/A ARG 11.A N ASN 7.A O no hydrogen 2.951 N/A ALA 12.A N ALA 8.A O no hydrogen 2.956 N/A ASN 13.A N LEU 9.A O no hydrogen 2.853 N/A GLU 14.A N LYS 10.A O no hydrogen 2.962 N/A PHE 15.A N ARG 11.A O no hydrogen 2.978 N/A LEU 16.A N ALA 12.A O no hydrogen 2.908 N/A GLU 17.A N ASN 13.A O no hydrogen 2.882 N/A VAL 18.A N GLU 14.A O no hydrogen 3.016 N/A VAL 18.A N PHE 15.A O no hydrogen 3.194 N/A GLY 19.A N LEU 16.A O no hydrogen 3.254 N/A ALA 24.A N LYS 20.A O no hydrogen 3.012 N/A LEU 25.A N LYS 21.A O no hydrogen 2.899 N/A ASP 26.A N GLN 22.A O no hydrogen 2.911 N/A VAL 27.A N PRO 23.A O no hydrogen 2.938 N/A LEU 28.A N ALA 24.A O no hydrogen 2.996 N/A TYR 29.A N LEU 25.A O no hydrogen 2.881 N/A ASP 30.A N ASP 26.A O no hydrogen 2.906 N/A VAL 31.A N VAL 27.A O no hydrogen 2.979 N/A MET 32.A N LEU 28.A O no hydrogen 2.953 N/A LYS 33.A N TYR 29.A O no hydrogen 2.906 N/A SER 34.A N ASP 30.A O no hydrogen 2.935 N/A SER 34.A OG ASP 30.A O no hydrogen 2.535 N/A HIS 37.A NE2 GLN 3.A O no hydrogen 2.663 N/A ARG 38.A NH1 LYS 33.A O no hydrogen 3.301 N/A ARG 38.A NH2 MET 32.A O no hydrogen 2.464 N/A GLN 41.A N HIS 44.A ND1 no hydrogen 3.154 N/A HIS 44.A N GLN 41.A O no hydrogen 3.184 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.742 N/A MET 48.A N HIS 44.A O no hydrogen 3.024 N/A LEU 49.A N GLU 45.A O no hydrogen 2.930 N/A LYS 50.A N PRO 46.A O no hydrogen 2.977 N/A TYR 51.A N ILE 47.A O no hydrogen 2.885 N/A TYR 51.A OH LEU 63.A O no hydrogen 2.449 N/A LEU 52.A N MET 48.A O no hydrogen 2.957 N/A GLU 53.A N LEU 49.A O no hydrogen 2.829 N/A LEU 54.A N LYS 50.A O no hydrogen 2.963 N/A CYS 55.A N TYR 51.A O no hydrogen 2.871 N/A CYS 55.A SG TYR 51.A O no hydrogen 3.216 N/A VAL 56.A N LEU 52.A O no hydrogen 2.862 N/A ASP 57.A N GLU 53.A O no hydrogen 2.938 N/A LEU 58.A N LEU 54.A O no hydrogen 2.895 N/A LYS 60.A N CYS 55.A O no hydrogen 3.263 N/A LYS 60.A NZ LEU 58.A O no hydrogen 3.339 N/A ALA 64.A N LYS 60.A O no hydrogen 2.953 N/A LYS 65.A N SER 61.A O no hydrogen 2.872 N/A GLU 66.A N HIS 62.A O no hydrogen 3.055 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 3.078 N/A GLY 67.A N LEU 63.A O no hydrogen 2.962 N/A LEU 68.A N ALA 64.A O no hydrogen 2.902 N/A TYR 69.A N LYS 65.A O no hydrogen 2.939 N/A GLN 70.A N GLU 66.A O no hydrogen 2.897 N/A TYR 71.A N GLY 67.A O no hydrogen 2.979 N/A TYR 71.A OH SER 82.A OG no hydrogen 3.036 N/A LYS 72.A N LEU 68.A O no hydrogen 2.902 N/A ASN 73.A N TYR 69.A O no hydrogen 2.948 N/A ILE 74.A N GLN 70.A O no hydrogen 2.920 N/A CYS 75.A N TYR 71.A O no hydrogen 2.911 N/A CYS 75.A SG TYR 71.A O no hydrogen 3.136 N/A ILE 80.A N VAL 78.A O no hydrogen 2.648 N/A LYS 81.A NZ VAL 78.A O no hydrogen 3.176 N/A SER 82.A OG TYR 71.A OH no hydrogen 3.036 N/A GLU 84.A N ILE 80.A O no hydrogen 2.951 N/A ASP 85.A N LYS 81.A O no hydrogen 2.926 N/A VAL 86.A N SER 82.A O no hydrogen 2.881 N/A VAL 87.A N LEU 83.A O no hydrogen 2.990 N/A ARG 88.A N GLU 84.A O no hydrogen 2.946 N/A ALA 89.A N ASP 85.A O no hydrogen 2.911 N/A TYR 90.A N VAL 86.A O no hydrogen 2.880 N/A LEU 91.A N VAL 87.A O no hydrogen 2.963 N/A LYS 92.A N ARG 88.A O no hydrogen 2.903 N/A MET 93.A N ALA 89.A O no hydrogen 2.884 N/A ALA 94.A N TYR 90.A O no hydrogen 2.984 N/A GLU 95.A N LEU 91.A O no hydrogen 2.870 N/A GLU 96.A N LYS 92.A O no hydrogen 2.906 N/A LYS 97.A N MET 93.A O no hydrogen 2.919 N/A LYS 97.A NZ ASP 57.A OD1 no hydrogen 3.483 N/A THR 98.A N ALA 94.A O no hydrogen 2.933 N/A THR 98.A OG1 ALA 94.A O no hydrogen 3.183 N/A THR 98.A OG1 GLU 95.A O no hydrogen 2.630 N/A GLU 99.A N GLU 95.A O no hydrogen 2.906 N/A ALA 100.A N GLU 96.A O no hydrogen 2.882 N/A ALA 101.A N LYS 97.A O no hydrogen 2.899 N/A LYS 102.A N THR 98.A O no hydrogen 2.927 N/A LYS 102.A NZ GLU 99.A OE1 no hydrogen 3.311 N/A GLU 103.A N GLU 99.A O no hydrogen 2.925 N/A GLU 104.A N ALA 100.A O no hydrogen 2.875 N/A SER 105.A N ALA 101.A O no hydrogen 2.882 N/A SER 105.A OG ASP 133.A OD1 no hydrogen 2.830 N/A GLN 106.A N LYS 102.A O no hydrogen 2.914 N/A GLN 106.A NE2 GLN 129.A OE1 no hydrogen 2.913 N/A GLN 107.A N GLU 103.A O no hydrogen 2.913 N/A MET 108.A N GLU 104.A O no hydrogen 2.851 N/A VAL 109.A N SER 105.A O no hydrogen 2.933 N/A LEU 110.A N GLN 106.A O no hydrogen 2.942 N/A ASP 111.A N GLN 107.A O no hydrogen 2.865 N/A ILE 112.A N MET 108.A O no hydrogen 2.894 N/A GLU 113.A N VAL 109.A O no hydrogen 2.934 N/A SER 117.A OG THR 114.A O no hydrogen 2.945 N/A VAL 118.A N THR 114.A O no hydrogen 2.955 N/A LEU 120.A N GLU 116.A O no hydrogen 2.961 N/A SER 121.A N SER 117.A O no hydrogen 2.860 N/A SER 121.A OG SER 117.A O no hydrogen 2.995 N/A SER 121.A OG VAL 118.A O no hydrogen 2.719 N/A ALA 122.A N VAL 118.A O no hydrogen 2.906 N/A VAL 123.A N LEU 119.A O no hydrogen 2.949 N/A SER 124.A N LEU 120.A O no hydrogen 2.890 N/A SER 124.A OG VAL 123.A O no hydrogen 2.745 N/A GLN 129.A NE2 GLN 106.A OE1 no hydrogen 2.919 N/A GLN 129.A NE2 ASP 133.A OD2 no hydrogen 2.531 N/A ASP 130.A N ASP 127.A OD1 no hydrogen 2.706 N/A ARG 131.A N ASP 127.A O no hydrogen 2.964 N/A THR 132.A N THR 128.A O no hydrogen 2.890 N/A THR 132.A OG1 THR 128.A O no hydrogen 2.773 N/A THR 132.A OG1 GLN 129.A O no hydrogen 2.656 N/A ASP 133.A N GLN 129.A O no hydrogen 2.903 N/A ARG 134.A N ASP 130.A O no hydrogen 2.893 N/A LEU 135.A N ARG 131.A O no hydrogen 2.921 N/A LEU 136.A N THR 132.A O no hydrogen 2.889 N/A THR 138.A N ASP 133.A O no hydrogen 3.069 N/A VAL 141.A N LEU 137.A O no hydrogen 3.180 N/A LYS 142.A N THR 138.A O no hydrogen 2.950 N/A PHE 143.A N PRO 139.A O no hydrogen 2.900 N/A LEU 144.A N TRP 140.A O no hydrogen 2.902 N/A TRP 145.A N VAL 141.A O no hydrogen 2.960 N/A GLU 146.A N LYS 142.A O no hydrogen 2.878 N/A SER 147.A N PHE 143.A O no hydrogen 2.885 N/A SER 147.A OG PHE 143.A O no hydrogen 3.318 N/A SER 147.A OG LEU 144.A O no hydrogen 2.609 N/A TYR 148.A N LEU 144.A O no hydrogen 2.932 N/A ARG 149.A N TRP 145.A O no hydrogen 2.933 N/A GLN 150.A N GLU 146.A O no hydrogen 2.946 N/A GLN 150.A NE2 GLU 146.A OE1 no hydrogen 2.723 N/A CYS 151.A N SER 147.A O no hydrogen 2.924 N/A CYS 151.A SG SER 147.A O no hydrogen 3.162 N/A CYS 151.A SG TYR 148.A O no hydrogen 3.146 N/A LEU 152.A N TYR 148.A O no hydrogen 3.021 N/A ASP 153.A N ARG 149.A O no hydrogen 2.874 N/A LEU 154.A N GLN 150.A O no hydrogen 2.869 N/A LEU 155.A N LEU 152.A O no hydrogen 2.893 N/A ARG 156.A NE ASP 153.A O no hydrogen 2.421 N/A ARG 156.A NH1 HIS 195.A ND1 no hydrogen 3.050 N/A SER 159.A N THR 207.A O no hydrogen 3.232 N/A SER 159.A N THR 207.A OG1 no hydrogen 3.335 N/A VAL 161.A N ASN 158.A O no hydrogen 2.990 N/A TYR 165.A N VAL 161.A O no hydrogen 2.942 N/A HIS 166.A N GLU 162.A O no hydrogen 2.882 N/A ASP 167.A N ARG 163.A O no hydrogen 2.947 N/A ILE 168.A N LEU 164.A O no hydrogen 2.904 N/A ALA 169.A N TYR 165.A O no hydrogen 2.933 N/A GLN 170.A N HIS 166.A O no hydrogen 2.926 N/A GLN 171.A N ASP 167.A O no hydrogen 2.921 N/A ALA 172.A N ILE 168.A O no hydrogen 2.865 N/A PHE 173.A N ALA 169.A O no hydrogen 2.938 N/A LYS 174.A N GLN 170.A O no hydrogen 2.927 N/A PHE 175.A N GLN 171.A O no hydrogen 2.885 N/A CYS 176.A N ALA 172.A O no hydrogen 2.925 N/A CYS 176.A SG ARG 181.A O no hydrogen 3.202 N/A LEU 177.A N PHE 173.A O no hydrogen 2.884 N/A GLN 178.A N LYS 174.A O no hydrogen 2.883 N/A TYR 179.A N PHE 175.A O no hydrogen 2.946 N/A THR 180.A N CYS 176.A O no hydrogen 2.900 N/A THR 180.A OG1 TYR 179.A O no hydrogen 2.724 N/A THR 180.A OG1 THR 180.A O no hydrogen 2.524 N/A ARG 181.A NE GLU 184.A OE2 no hydrogen 3.137 N/A ARG 181.A NH2 GLU 184.A OE2 no hydrogen 3.466 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.578 N/A PHE 185.A N ARG 181.A O no hydrogen 2.898 N/A ARG 186.A N LYS 182.A O no hydrogen 2.930 N/A ARG 186.A NE GLU 239.A OE2 no hydrogen 3.202 N/A LYS 187.A N ALA 183.A O no hydrogen 2.925 N/A LEU 188.A N GLU 184.A O no hydrogen 2.886 N/A CYS 189.A N PHE 185.A O no hydrogen 2.967 N/A CYS 189.A SG PHE 185.A O no hydrogen 3.204 N/A ASP 190.A N ARG 186.A O no hydrogen 2.951 N/A ASN 191.A N LYS 187.A O no hydrogen 2.899 N/A LEU 192.A N LEU 188.A O no hydrogen 2.858 N/A ARG 193.A N CYS 189.A O no hydrogen 2.965 N/A ARG 193.A NE ASP 246.A OD2 no hydrogen 2.548 N/A MET 194.A N ASP 190.A O no hydrogen 2.964 N/A HIS 195.A N ASN 191.A O no hydrogen 2.868 N/A LEU 196.A N LEU 192.A O no hydrogen 2.912 N/A SER 197.A N ARG 193.A O no hydrogen 2.929 N/A SER 197.A OG MET 194.A O no hydrogen 2.331 N/A GLN 198.A N MET 194.A O no hydrogen 2.899 N/A ILE 199.A N HIS 195.A O no hydrogen 2.873 N/A GLN 200.A N LEU 196.A O no hydrogen 2.992 N/A ARG 201.A N SER 197.A O no hydrogen 2.875 N/A ARG 201.A N GLN 198.A O no hydrogen 3.250 N/A ARG 201.A NH2 HIS 202.A NE2 no hydrogen 3.151 N/A HIS 202.A N GLN 198.A O no hydrogen 2.921 N/A THR 207.A OG1 THR 207.A O no hydrogen 2.520 N/A ALA 208.A N GLN 205.A O no hydrogen 3.392 N/A ASN 212.A N ASN 210.A OD1 no hydrogen 3.056 N/A ASN 212.A ND2 ASN 210.A OD1 no hydrogen 2.507 N/A ASN 213.A N ASN 210.A O no hydrogen 3.240 N/A GLU 215.A N GLU 215.A OE1 no hydrogen 2.868 N/A SER 216.A OG ASN 210.A O no hydrogen 2.795 N/A SER 216.A OG ASN 213.A O no hydrogen 2.826 N/A GLN 217.A N ASN 213.A O no hydrogen 2.929 N/A GLN 217.A NE2 LYS 256.A O no hydrogen 2.869 N/A SER 218.A N PRO 214.A O no hydrogen 2.877 N/A SER 218.A OG PRO 214.A O no hydrogen 2.635 N/A SER 218.A OG GLU 215.A O no hydrogen 2.799 N/A MET 219.A N GLU 215.A O no hydrogen 2.955 N/A HIS 220.A N SER 216.A O no hydrogen 2.930 N/A LEU 221.A N GLN 217.A O no hydrogen 2.951 N/A GLU 222.A N SER 218.A O no hydrogen 2.938 N/A THR 223.A N MET 219.A O no hydrogen 3.012 N/A THR 223.A OG1 MET 219.A O no hydrogen 2.868 N/A THR 223.A OG1 HIS 220.A O no hydrogen 2.583 N/A ARG 224.A N HIS 220.A O no hydrogen 2.948 N/A ARG 224.A NH1 HIS 220.A O no hydrogen 3.522 N/A ARG 224.A NH1 THR 223.A OG1 no hydrogen 3.359 N/A LEU 225.A N LEU 221.A O no hydrogen 2.904 N/A VAL 226.A N GLU 222.A O no hydrogen 2.974 N/A GLN 227.A N THR 223.A O no hydrogen 2.939 N/A LEU 228.A N ARG 224.A O no hydrogen 2.943 N/A ASP 229.A N LEU 225.A O no hydrogen 2.897 N/A SER 230.A N VAL 226.A O no hydrogen 2.941 N/A SER 230.A OG VAL 226.A O no hydrogen 3.116 N/A SER 230.A OG GLN 227.A O no hydrogen 2.586 N/A ALA 231.A N GLN 227.A O no hydrogen 2.916 N/A ILE 232.A N LEU 228.A O no hydrogen 2.895 N/A SER 233.A N ASP 229.A O no hydrogen 2.885 N/A SER 233.A OG ASP 229.A O no hydrogen 3.172 N/A SER 233.A OG SER 230.A O no hydrogen 2.524 N/A MET 234.A N SER 230.A O no hydrogen 3.046 N/A GLU 235.A N ILE 232.A O no hydrogen 2.916 N/A LEU 236.A N ALA 231.A O no hydrogen 2.786 N/A ALA 240.A N LEU 236.A O no hydrogen 2.922 N/A PHE 241.A N TRP 237.A O no hydrogen 2.810 N/A LYS 242.A N GLN 238.A O no hydrogen 2.978 N/A LYS 242.A NZ GLN 238.A O no hydrogen 2.935 N/A LYS 242.A NZ GLU 239.A OE2 no hydrogen 3.157 N/A ALA 243.A N GLU 239.A O no hydrogen 2.877 N/A VAL 244.A N ALA 240.A O no hydrogen 2.883 N/A GLU 245.A N PHE 241.A O no hydrogen 2.942 N/A ASP 246.A N LYS 242.A O no hydrogen 2.941 N/A ILE 247.A N ALA 243.A O no hydrogen 2.884 N/A HIS 248.A N VAL 244.A O no hydrogen 2.902 N/A GLY 249.A N GLU 245.A O no hydrogen 2.886 N/A LEU 250.A N ASP 246.A O no hydrogen 2.915 N/A PHE 251.A N ILE 247.A O no hydrogen 2.942 N/A SER 252.A N HIS 248.A O no hydrogen 2.919 N/A SER 252.A OG HIS 248.A O no hydrogen 2.999 N/A SER 252.A OG GLY 249.A O no hydrogen 2.514 N/A LEU 253.A N GLY 249.A O no hydrogen 2.918 N/A SER 254.A N LEU 250.A O no hydrogen 2.891 N/A SER 254.A OG GLN 217.A OE1 no hydrogen 2.596 N/A MET 263.A N LYS 259.A O no hydrogen 3.019 N/A ALA 264.A N PRO 260.A O no hydrogen 2.846 N/A ASN 265.A N GLN 261.A O no hydrogen 2.961 N/A TYR 266.A N LEU 262.A O no hydrogen 2.940 N/A TYR 267.A N MET 263.A O no hydrogen 2.844 N/A ASN 268.A N ALA 264.A O no hydrogen 2.918 N/A LYS 269.A N ASN 265.A O no hydrogen 2.922 N/A VAL 270.A N TYR 266.A O no hydrogen 2.960 N/A SER 271.A N TYR 267.A O no hydrogen 2.846 N/A SER 271.A OG TYR 267.A O no hydrogen 3.176 N/A SER 271.A OG ASN 268.A O no hydrogen 2.334 N/A THR 272.A N ASN 268.A O no hydrogen 2.998 N/A THR 272.A OG1 ASN 268.A O no hydrogen 3.511 N/A THR 272.A OG1 LYS 269.A O no hydrogen 2.271 N/A VAL 273.A N LYS 269.A O no hydrogen 2.947 N/A PHE 274.A N VAL 270.A O no hydrogen 2.913 N/A TRP 275.A N SER 271.A O no hydrogen 2.894 N/A LYS 276.A N THR 272.A O no hydrogen 2.976 N/A LYS 276.A NZ THR 272.A O no hydrogen 3.235 N/A SER 277.A N VAL 273.A O no hydrogen 2.943 N/A SER 277.A OG VAL 273.A O no hydrogen 2.796 N/A GLY 278.A N PHE 274.A O no hydrogen 2.892 N/A PHE 282.A N ASN 279.A OD1 no hydrogen 3.007 N/A HIS 283.A N ASN 279.A O no hydrogen 2.900 N/A HIS 283.A ND1 SER 271.A O no hydrogen 2.533 N/A HIS 283.A NE2 TYR 418.A OH no hydrogen 2.373 N/A ALA 284.A N ALA 280.A O no hydrogen 2.874 N/A SER 285.A N LEU 281.A O no hydrogen 2.953 N/A SER 285.A OG PHE 282.A O no hydrogen 2.456 N/A THR 286.A N PHE 282.A O no hydrogen 2.925 N/A THR 286.A OG1 HIS 283.A O no hydrogen 2.735 N/A LEU 287.A N HIS 283.A O no hydrogen 2.957 N/A HIS 288.A N ALA 284.A O no hydrogen 2.859 N/A ARG 289.A N SER 285.A O no hydrogen 2.929 N/A LEU 290.A N THR 286.A O no hydrogen 2.871 N/A TYR 291.A N LEU 287.A O no hydrogen 2.872 N/A HIS 292.A N HIS 288.A O no hydrogen 2.897 N/A LEU 293.A N ARG 289.A O no hydrogen 2.990 N/A SER 294.A N LEU 290.A O no hydrogen 2.836 N/A SER 294.A OG LEU 290.A O no hydrogen 3.168 N/A SER 294.A OG TYR 291.A O no hydrogen 3.082 N/A ARG 295.A N TYR 291.A O no hydrogen 2.899 N/A ARG 295.A NH1 TYR 291.A OH no hydrogen 2.625 N/A GLU 296.A N LEU 293.A O no hydrogen 3.320 N/A MET 297.A N LEU 293.A O no hydrogen 2.939 N/A LYS 299.A NZ ARG 295.A O no hydrogen 2.392 N/A ASN 300.A N ASN 300.A OD1 no hydrogen 2.627 N/A GLN 307.A N GLN 303.A O no hydrogen 2.930 N/A ARG 308.A N ASP 304.A O no hydrogen 2.883 N/A ARG 308.A NE GLU 412.A OE1 no hydrogen 3.216 N/A ARG 308.A NH2 GLU 414.A OE2 no hydrogen 3.026 N/A MET 309.A N GLU 305.A O no hydrogen 2.928 N/A SER 310.A N MET 306.A O no hydrogen 2.931 N/A SER 310.A OG MET 306.A O no hydrogen 2.686 N/A THR 311.A N GLN 307.A O no hydrogen 2.906 N/A THR 311.A OG1 GLN 307.A O no hydrogen 2.954 N/A THR 311.A OG1 ARG 308.A O no hydrogen 2.785 N/A ARG 312.A N ARG 308.A O no hydrogen 2.935 N/A VAL 313.A N MET 309.A O no hydrogen 2.874 N/A LEU 314.A N SER 310.A O no hydrogen 2.896 N/A LEU 315.A N THR 311.A O no hydrogen 2.896 N/A ALA 316.A N ARG 312.A O no hydrogen 2.895 N/A THR 317.A N VAL 313.A O no hydrogen 2.910 N/A LEU 318.A N LEU 314.A O no hydrogen 2.944 N/A SER 319.A N LEU 315.A O no hydrogen 2.818 N/A SER 319.A OG LEU 315.A O no hydrogen 2.611 N/A SER 319.A OG TYR 418.A O no hydrogen 3.384 N/A THR 327.A OG1 THR 327.A O no hydrogen 2.571 N/A ILE 329.A N ASP 328.A OD1 no hydrogen 2.696 N/A ARG 331.A N THR 327.A O no hydrogen 2.911 N/A ARG 331.A NE ASP 336.A OD1 no hydrogen 3.357 N/A LEU 332.A N ASP 328.A O no hydrogen 2.996 N/A LEU 333.A N ILE 329.A O no hydrogen 2.832 N/A ASP 334.A N ALA 330.A O no hydrogen 2.940 N/A GLU 341.A N GLY 337.A O no hydrogen 2.887 N/A GLN 343.A N GLU 341.A O no hydrogen 2.598 N/A LEU 346.A N LYS 342.A O no hydrogen 3.012 N/A ALA 347.A N GLN 343.A O no hydrogen 2.829 N/A THR 348.A N ARG 344.A O no hydrogen 2.875 N/A LEU 349.A N ARG 345.A O no hydrogen 2.961 N/A LEU 350.A N LEU 346.A O no hydrogen 2.950 N/A GLY 351.A N ALA 347.A O no hydrogen 2.866 N/A ARG 358.A NE ILE 320.A O no hydrogen 2.679 N/A ARG 358.A NH2 ILE 320.A O no hydrogen 2.732 N/A LEU 361.A N ARG 358.A O no hydrogen 2.995 N/A ILE 362.A N ARG 358.A O no hydrogen 2.904 N/A ASN 363.A N ILE 359.A O no hydrogen 3.022 N/A MET 365.A N LEU 361.A O no hydrogen 3.005 N/A ARG 367.A N ASN 363.A O no hydrogen 2.924 N/A PHE 368.A N ASP 364.A O no hydrogen 2.912 N/A VAL 370.A N MET 365.A O no hydrogen 3.348 N/A TYR 373.A N VAL 370.A O no hydrogen 3.438 N/A VAL 378.A N VAL 375.A O no hydrogen 3.177 N/A LYS 379.A NZ LEU 371.A O no hydrogen 2.368 N/A LYS 379.A NZ VAL 374.A O no hydrogen 3.110 N/A ASN 383.A ND2 ASP 380.A OD1 no hydrogen 3.369 N/A TRP 384.A N ASP 380.A O no hydrogen 2.904 N/A LEU 385.A N LEU 381.A O no hydrogen 2.900 N/A VAL 387.A N ASN 383.A O no hydrogen 2.972 N/A GLU 388.A N ASN 383.A O no hydrogen 2.589 N/A LEU 392.A N ASN 390.A OD1 no hydrogen 3.197 N/A LYS 393.A N ASN 390.A O no hydrogen 3.451 N/A LEU 394.A N ASN 390.A O no hydrogen 2.889 N/A CYS 395.A SG LEU 449.A O no hydrogen 3.238 N/A GLU 396.A N GLU 396.A OE1 no hydrogen 2.748 N/A ARG 397.A N LYS 393.A O no hydrogen 2.976 N/A ARG 397.A NH1 GLU 388.A OE1 no hydrogen 2.560 N/A VAL 398.A N LEU 394.A O no hydrogen 2.870 N/A THR 399.A N CYS 395.A O no hydrogen 2.952 N/A THR 399.A OG1 CYS 395.A O no hydrogen 3.230 N/A THR 399.A OG1 GLU 396.A O no hydrogen 2.811 N/A LYS 400.A N GLU 396.A O no hydrogen 2.953 N/A LYS 400.A NZ GLU 377.A O no hydrogen 3.562 N/A LYS 400.A NZ GLU 377.A OE2 no hydrogen 3.347 N/A VAL 401.A N ARG 397.A O no hydrogen 2.989 N/A LEU 402.A N VAL 398.A O no hydrogen 2.856 N/A ASN 403.A N THR 399.A O no hydrogen 2.903 N/A TRP 404.A N LYS 400.A O no hydrogen 2.965 N/A VAL 405.A N VAL 401.A O no hydrogen 2.972 N/A ARG 406.A N LEU 402.A O no hydrogen 2.889 N/A ARG 406.A NE LEU 402.A O no hydrogen 3.043 N/A GLU 407.A N ASN 403.A O no hydrogen 2.831 N/A GLN 408.A N TRP 404.A O no hydrogen 3.091 N/A GLU 410.A N GLU 410.A OE1 no hydrogen 2.966 N/A GLU 414.A N GLU 414.A OE1 no hydrogen 2.913 N/A LEU 415.A N GLU 412.A O no hydrogen 3.051 N/A GLN 416.A N GLU 412.A O no hydrogen 2.992 N/A GLN 416.A NE2 VAL 405.A O no hydrogen 2.370 N/A GLN 416.A NE2 GLU 412.A O no hydrogen 3.106 N/A GLN 417.A NE2 GLU 414.A O no hydrogen 3.367 N/A TYR 418.A N LEU 415.A O no hydrogen 2.885 N/A TYR 418.A OH HIS 283.A NE2 no hydrogen 2.373 N/A VAL 419.A N LEU 415.A O no hydrogen 3.019 N/A LEU 422.A N TYR 418.A O no hydrogen 3.433 N/A GLN 423.A N VAL 419.A O no hydrogen 2.966 N/A ASN 424.A N PRO 420.A O no hydrogen 2.917 N/A ASN 425.A N GLN 421.A O no hydrogen 2.852 N/A ASN 425.A ND2 ILE 320.A O no hydrogen 3.441 N/A THR 426.A N LEU 422.A O no hydrogen 2.919 N/A ILE 427.A N GLN 423.A O no hydrogen 2.958 N/A LEU 428.A N ASN 424.A O no hydrogen 2.935 N/A ARG 429.A N ASN 425.A O no hydrogen 2.912 N/A LEU 430.A N THR 426.A O no hydrogen 2.877 N/A LEU 431.A N ILE 427.A O no hydrogen 2.901 N/A GLN 432.A N LEU 428.A O no hydrogen 2.926 N/A GLN 433.A N ARG 429.A O no hydrogen 2.946 N/A GLN 433.A NE2 GLU 388.A O no hydrogen 3.472 N/A VAL 434.A N LEU 430.A O no hydrogen 2.897 N/A SER 435.A N LEU 431.A O no hydrogen 2.870 N/A SER 435.A OG LEU 431.A O no hydrogen 3.163 N/A SER 435.A OG GLN 432.A O no hydrogen 2.826 N/A GLN 436.A N GLN 432.A O no hydrogen 2.829 N/A ILE 437.A N GLN 433.A O no hydrogen 3.025 N/A TYR 438.A N VAL 434.A O no hydrogen 2.868 N/A ILE 441.A N LEU 482.A O no hydrogen 2.994 N/A PHE 443.A N ARG 480.A O no hydrogen 3.126 N/A SER 444.A N GLU 442.A OE2 no hydrogen 2.823 N/A LEU 446.A N GLU 442.A O no hydrogen 2.982 N/A THR 447.A N PHE 443.A O no hydrogen 2.912 N/A THR 447.A OG1 PHE 443.A O no hydrogen 3.565 N/A THR 447.A OG1 SER 444.A O no hydrogen 2.602 N/A SER 448.A N SER 444.A O no hydrogen 2.947 N/A SER 448.A OG SER 444.A O no hydrogen 2.981 N/A SER 448.A OG ARG 445.A O no hydrogen 2.833 N/A LEU 449.A N ARG 445.A O no hydrogen 2.819 N/A VAL 450.A N LEU 446.A O no hydrogen 2.921 N/A PHE 456.A N ASP 454.A OD1 no hydrogen 3.473 N/A GLN 457.A N GLN 457.A OE1 no hydrogen 2.890 N/A LEU 458.A N ASP 454.A O no hydrogen 2.922 N/A GLU 459.A N ALA 455.A O no hydrogen 2.899 N/A ARG 460.A N PHE 456.A O no hydrogen 2.968 N/A ALA 461.A N GLN 457.A O no hydrogen 2.849 N/A ILE 462.A N LEU 458.A O no hydrogen 2.929 N/A VAL 463.A N GLU 459.A O no hydrogen 2.922 N/A ASP 464.A N ARG 460.A O no hydrogen 2.945 N/A ALA 465.A N ALA 461.A O no hydrogen 2.896 N/A ALA 466.A N ILE 462.A O no hydrogen 2.869 N/A ARG 467.A N VAL 463.A O no hydrogen 2.907 N/A HIS 468.A N ASP 464.A O no hydrogen 2.946 N/A CYS 469.A SG ALA 465.A O no hydrogen 3.307 N/A ARG 474.A N SER 483.A O no hydrogen 2.850 N/A ASP 476.A N THR 481.A O no hydrogen 2.949 N/A THR 481.A N ASP 476.A O no hydrogen 2.904 N/A THR 481.A OG1 ILE 441.A O no hydrogen 2.888 N/A LEU 482.A N ILE 441.A O no hydrogen 2.669 N/A SER 483.A N ARG 474.A O no hydrogen 2.901 N/A SER 483.A OG SER 486.A OG no hydrogen 3.227 N/A PHE 484.A N GLN 439.A O no hydrogen 2.505 N/A GLY 485.A N GLN 472.A O no hydrogen 2.697 N/A SER 486.A OG SER 483.A OG no hydrogen 3.227 N/A SER 486.A OG GLY 485.A O no hydrogen 2.491 N/A TYR 490.A OH ASP 470.A OD2 no hydrogen 3.295 N/A THR 492.A OG1 ASP 470.A OD1 no hydrogen 3.521 N/A ARG 493.A N ASP 470.A OD2 no hydrogen 2.769 N/A GLU 494.A N GLU 494.A OE1 no hydrogen 2.895 N/A SER 504.A OG GLU 508.A OE2 no hydrogen 2.104 N/A GLN 509.A N MET 505.A O no hydrogen 2.947 N/A GLN 509.A N PRO 506.A O no hydrogen 3.146 N/A ILE 510.A N PRO 506.A O no hydrogen 2.908 N/A ARG 511.A N SER 507.A O no hydrogen 2.877 N/A THR 515.A OG1 ASN 512.A O no hydrogen 2.453 N/A ALA 516.A N ASN 512.A O no hydrogen 3.474 N/A MET 517.A N GLN 513.A O no hydrogen 3.221 N/A SER 518.A N LEU 514.A O no hydrogen 2.924 N/A SER 518.A OG LEU 514.A O no hydrogen 3.086 N/A SER 518.A OG THR 515.A O no hydrogen 2.669 N/A SER 519.A N THR 515.A O no hydrogen 2.930 N/A SER 519.A OG THR 515.A O no hydrogen 3.004 N/A VAL 520.A N ALA 516.A O no hydrogen 2.887 N/A LEU 521.A N MET 517.A O no hydrogen 2.949 N/A ALA 522.A N SER 518.A O no hydrogen 2.913 N/A LYS 523.A N SER 519.A O no hydrogen 2.929 N/A ALA 524.A N VAL 520.A O no hydrogen 2.847 N/A LEU 525.A N LEU 521.A O no hydrogen 2.933 N/A GLU 526.A N ALA 522.A O no hydrogen 2.919 N/A VAL 527.A N LYS 523.A O no hydrogen 2.922 N/A VAL 527.A N ALA 524.A O no hydrogen 3.348 N/A ILE 528.A N ALA 524.A O no hydrogen 2.905 N/A LYS 529.A N LEU 525.A O no hydrogen 2.952 N/A LYS 529.A NZ GLU 526.A O no hydrogen 3.527 N/A LEU 534.A N PRO 530.A O no hydrogen 3.049 N/A GLN 535.A N ALA 531.A O no hydrogen 2.867 N/A GLN 535.A NE2 ALA 531.A O no hydrogen 3.642 N/A GLU 536.A N HIS 532.A O no hydrogen 2.922 N/A LYS 537.A N ILE 533.A O no hydrogen 2.897 N/A LYS 537.A NZ GLU 538.A OE2 no hydrogen 3.144 N/A GLU 538.A N LEU 534.A O no hydrogen 2.890 N/A GLU 539.A N GLN 535.A O no hydrogen 2.926 N/A GLN 540.A N GLU 536.A O no hydrogen 2.918 N/A HIS 541.A N LYS 537.A O no hydrogen 2.895 N/A GLN 542.A N GLU 538.A O no hydrogen 2.895 N/A LEU 543.A N GLU 539.A O no hydrogen 2.907 N/A ALA 544.A N GLN 540.A O no hydrogen 2.908 N/A VAL 545.A N HIS 541.A O no hydrogen 2.887 N/A THR 546.A N GLN 542.A O no hydrogen 2.957 N/A THR 546.A OG1 GLN 542.A O no hydrogen 3.061 N/A THR 546.A OG1 LEU 543.A O no hydrogen 2.893 N/A ALA 547.A N LEU 543.A O no hydrogen 2.874 N/A TYR 548.A N ALA 544.A O no hydrogen 2.915 N/A LEU 549.A N VAL 545.A O no hydrogen 2.914 N/A LYS 550.A N THR 546.A O no hydrogen 2.920 N/A ASN 551.A N ALA 547.A O no hydrogen 2.871 N/A SER 552.A N LEU 549.A O no hydrogen 3.353 N/A SER 552.A OG TYR 548.A O no hydrogen 2.801 N/A LYS 554.A NZ LYS 550.A O no hydrogen 2.472 N/A GLU 555.A N GLU 555.A OE1 no hydrogen 3.275 N/A GLN 557.A NE2 ARG 553.A O no hydrogen 2.718 N/A ARG 558.A N LYS 554.A O no hydrogen 2.954 N/A ILE 559.A N GLU 555.A O no hydrogen 2.855 N/A LEU 560.A N HIS 556.A O no hydrogen 2.981 N/A ALA 561.A N GLN 557.A O no hydrogen 2.908 N/A ARG 562.A N ARG 558.A O no hydrogen 2.882 N/A ARG 563.A N ILE 559.A O no hydrogen 2.864 N/A ARG 563.A NE GLN 564.A OE1 no hydrogen 2.561 N/A ARG 563.A NH2 GLN 564.A OE1 no hydrogen 2.995 N/A GLN 564.A N LEU 560.A O no hydrogen 2.957 N/A THR 565.A N ALA 561.A O no hydrogen 2.905 N/A THR 565.A OG1 GLU 568.A OE2 no hydrogen 2.902 N/A ILE 566.A N ARG 562.A O no hydrogen 2.877 N/A GLU 567.A N ARG 563.A O no hydrogen 2.891 N/A GLU 568.A N GLN 564.A O no hydrogen 3.017 N/A ARG 569.A N THR 565.A O no hydrogen 2.862 N/A LYS 570.A N ILE 566.A O no hydrogen 2.887 N/A GLU 571.A N GLU 567.A O no hydrogen 3.006 N/A ARG 572.A N GLU 568.A O no hydrogen 2.882 N/A ARG 572.A NE GLU 568.A O no hydrogen 3.517 N/A LEU 573.A N ARG 569.A O no hydrogen 2.865 N/A GLU 574.A N LYS 570.A O no hydrogen 2.927 N/A SER 575.A N GLU 571.A O no hydrogen 2.964 N/A SER 575.A OG GLU 571.A O no hydrogen 2.929 N/A SER 575.A OG ARG 572.A O no hydrogen 2.676 N/A LEU 576.A N ARG 572.A O no hydrogen 2.894 N/A ASN 577.A N LEU 573.A O no hydrogen 2.894 N/A ILE 578.A N GLU 574.A O no hydrogen 2.911 N/A GLN 579.A N SER 575.A O no hydrogen 2.961 N/A GLN 579.A NE2 LEU 576.A O no hydrogen 3.678 N/A ARG 580.A N LEU 576.A O no hydrogen 2.849 N/A GLU 581.A N ASN 577.A O no hydrogen 2.942 N/A LYS 582.A N ILE 578.A O no hydrogen 2.912 N/A GLU 583.A N GLN 579.A O no hydrogen 2.932 N/A GLU 584.A N ARG 580.A O no hydrogen 2.890 N/A LEU 585.A N GLU 581.A O no hydrogen 2.926 N/A GLU 586.A N LYS 582.A O no hydrogen 2.972 N/A GLN 587.A N GLU 583.A O no hydrogen 2.882 N/A ARG 588.A N GLU 584.A O no hydrogen 2.917 N/A GLU 589.A N LEU 585.A O no hydrogen 2.933 N/A ALA 590.A N GLU 586.A O no hydrogen 2.883 N/A GLU 591.A N GLN 587.A O no hydrogen 2.933 N/A LYS 596.A N GLN 592.A O no hydrogen 2.907 N/A ALA 597.A N LYS 593.A O no hydrogen 2.905 N/A GLU 598.A N VAL 594.A O no hydrogen 2.896 N/A GLU 599.A N ARG 595.A O no hydrogen 2.923 N/A GLU 600.A N LYS 596.A O no hydrogen 2.903 N/A ARG 601.A N ALA 597.A O no hydrogen 2.884 N/A LEU 602.A N GLU 598.A O no hydrogen 2.926 N/A ARG 603.A N GLU 599.A O no hydrogen 2.926 N/A GLN 604.A N GLU 600.A O no hydrogen 2.870 N/A GLU 605.A N ARG 601.A O no hydrogen 2.889 N/A ALA 606.A N LEU 602.A O no hydrogen 2.951 N/A LYS 607.A N ARG 603.A O no hydrogen 2.902 N/A GLU 608.A N GLN 604.A O no hydrogen 2.863 N/A ARG 609.A N GLU 605.A O no hydrogen 2.910 N/A GLU 610.A N ALA 606.A O no hydrogen 2.943 N/A LYS 611.A N LYS 607.A O no hydrogen 2.883 N/A GLU 612.A N GLU 608.A O no hydrogen 2.866 N/A ARG 613.A N ARG 609.A O no hydrogen 2.925 N/A ILE 614.A N GLU 610.A O no hydrogen 2.918 N/A LEU 615.A N LYS 611.A O no hydrogen 2.877 N/A GLN 616.A N GLU 612.A O no hydrogen 2.909 N/A GLU 617.A N ARG 613.A O no hydrogen 2.919 N/A HIS 618.A N ILE 614.A O no hydrogen 2.884 N/A GLU 619.A N LEU 615.A O no hydrogen 2.921 N/A GLN 620.A N GLN 616.A O no hydrogen 2.908 N/A ILE 621.A N GLU 617.A O no hydrogen 2.896 N/A LYS 622.A N HIS 618.A O no hydrogen 2.892 N/A LYS 623.A N GLU 619.A O no hydrogen 2.929 N/A LYS 624.A N GLN 620.A O no hydrogen 2.900 N/A THR 625.A N ILE 621.A O no hydrogen 2.884 N/A VAL 626.A N LYS 622.A O no hydrogen 2.897 N/A ARG 627.A N LYS 623.A O no hydrogen 2.913 N/A GLU 628.A N LYS 624.A O no hydrogen 2.889 N/A ARG 629.A N THR 625.A O no hydrogen 2.898 N/A THR 634.A N GLN 630.A O no hydrogen 2.907 N/A GLU 635.A N ILE 631.A O no hydrogen 2.904 N/A LEU 636.A N LYS 632.A O no hydrogen 2.905 N/A GLY 637.A N LYS 633.A O no hydrogen 2.902 N/A ALA 638.A N THR 634.A O no hydrogen 2.892 N/A LYS 639.A N GLU 635.A O no hydrogen 2.908 N/A ALA 640.A N LEU 636.A O no hydrogen 2.900 N/A PHE 641.A N GLY 637.A O no hydrogen 2.894 N/A LYS 642.A N ALA 638.A O no hydrogen 2.909 N/A ASP 643.A N LYS 639.A O no hydrogen 2.900 N/A ILE 644.A N ALA 640.A O no hydrogen 2.902 N/A ASP 645.A N PHE 641.A O no hydrogen 2.902 N/A ILE 646.A N LYS 642.A O no hydrogen 2.894 N/A GLU 647.A N ASP 643.A O no hydrogen 2.897 N/A ASP 648.A N ILE 644.A O no hydrogen 2.912 N/A LEU 649.A N ASP 645.A O no hydrogen 2.890 N/A GLU 650.A N ILE 646.A O no hydrogen 2.886 N/A GLU 651.A N GLU 647.A O no hydrogen 2.906 N/A LEU 652.A N ASP 648.A O no hydrogen 2.910 N/A ASP 653.A N LEU 649.A O no hydrogen 2.881 N/A PRO 654.A N GLU 650.A O no hydrogen 2.894 N/A ASP 655.A N GLU 651.A O no hydrogen 2.903 N/A PHE 656.A N LEU 652.A O no hydrogen 2.906 N/A ILE 657.A N ASP 653.A O no hydrogen 2.951 N/A MET 658.A N PRO 654.A O no hydrogen 2.896 N/A ALA 659.A N ASP 655.A O no hydrogen 3.021 N/A LYS 660.A N PHE 656.A O no hydrogen 2.908 N/A GLN 661.A N ILE 657.A O no hydrogen 2.874 N/A VAL 662.A N MET 658.A O no hydrogen 2.911 N/A GLU 663.A N ALA 659.A O no hydrogen 2.896 N/A GLN 664.A N LYS 660.A O no hydrogen 2.891 N/A LEU 665.A N GLN 661.A O no hydrogen 2.893 N/A GLU 666.A N VAL 662.A O no hydrogen 2.907 N/A LYS 667.A N GLU 663.A O no hydrogen 2.886 N/A GLU 668.A N GLN 664.A O no hydrogen 2.896 N/A LYS 669.A N LEU 665.A O no hydrogen 2.904 N/A LYS 670.A N GLU 666.A O no hydrogen 2.896 N/A GLU 671.A N LYS 667.A O no hydrogen 2.894 N/A LEU 672.A N GLU 668.A O no hydrogen 2.900 N/A GLN 673.A N LYS 669.A O no hydrogen 2.898 N/A LYS 678.A N ILE 674.A O no hydrogen 2.908 N/A SER 679.A N PRO 675.A O no hydrogen 2.903 N/A ALA 680.A N LEU 676.A O no hydrogen 2.900 N/A TYR 681.A N ILE 677.A O no hydrogen 2.903 N/A GLU 682.A N LYS 678.A O no hydrogen 2.907 N/A GLU 683.A N SER 679.A O no hydrogen 2.899 N/A GLN 684.A N ALA 680.A O no hydrogen 2.901 N/A ARG 685.A N TYR 681.A O no hydrogen 2.906 N/A ILE 686.A N GLU 682.A O no hydrogen 2.905 N/A LYS 687.A N GLU 683.A O no hydrogen 2.901 N/A ASP 688.A N GLN 684.A O no hydrogen 2.902 N/A MET 689.A N ARG 685.A O no hydrogen 2.906 N/A ASP 690.A N ILE 686.A O no hydrogen 2.902 N/A LEU 691.A N LYS 687.A O no hydrogen 2.900 N/A TRP 692.A N ASP 688.A O no hydrogen 2.904 N/A