Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nhm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 7.A N ILE 4.A O no hydrogen 3.001 N/A PHE 8.A N LYS 5.A O no hydrogen 3.141 N/A ASN 9.A N LEU 39.A O no hydrogen 2.882 N/A ASN 9.A ND2 GLU 38.A O no hydrogen 2.983 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 3.083 N/A LYS 11.A NZ HIS 37.A O no hydrogen 2.938 N/A ILE 12.A N ASN 9.A O no hydrogen 3.204 N/A TRP 13.A N PRO 10.A O no hydrogen 3.181 N/A TRP 13.A NE1 LYS 5.A O no hydrogen 2.922 N/A ASP 14.A N LYS 11.A O no hydrogen 3.064 N/A LYS 15.A NZ ASP 19.A OD1 no hydrogen 3.559 N/A LYS 15.A NZ ASP 19.A OD2 no hydrogen 2.786 N/A PHE 17.A N ASP 14.A OD2 no hydrogen 3.123 N/A GLN 18.A N ASP 14.A O no hydrogen 2.998 N/A GLN 18.A NE2 ILE 12.A O no hydrogen 2.818 N/A ASP 19.A N LYS 15.A O no hydrogen 2.915 N/A GLY 20.A N THR 16.A O no hydrogen 3.107 N/A LEU 21.A N PHE 17.A O no hydrogen 2.925 N/A LYS 22.A N GLN 18.A O no hydrogen 2.899 N/A LYS 23.A N ASP 19.A O no hydrogen 3.150 N/A GLU 24.A N GLY 20.A O no hydrogen 2.953 N/A ILE 25.A N LEU 21.A O no hydrogen 2.937 N/A GLU 26.A N LYS 22.A O no hydrogen 3.002 N/A ASP 27.A N LYS 23.A O no hydrogen 3.024 N/A SER 28.A N ILE 25.A O no hydrogen 3.238 N/A SER 28.A OG ILE 25.A O no hydrogen 2.779 N/A SER 28.A OG TYR 31.A O no hydrogen 3.421 N/A SER 28.A OG TRP 33.A O no hydrogen 3.139 N/A TYR 31.A OH PHE 204.A O no hydrogen 2.869 N/A TRP 33.A N SER 28.A OG no hydrogen 2.916 N/A TRP 33.A NE1 GLN 29.A O no hydrogen 2.852 N/A GLY 34.A N PHE 195.A O no hydrogen 2.959 N/A THR 35.A OG1 ILE 193.A O no hydrogen 2.774 N/A ILE 36.A N ILE 193.A O no hydrogen 3.008 N/A LEU 39.A N ASN 191.A O no hydrogen 3.010 N/A VAL 40.A N ASN 191.A OD1 no hydrogen 2.964 N/A ASN 41.A N MET 7.A O no hydrogen 2.829 N/A LEU 44.A N ASN 41.A OD1 no hydrogen 2.999 N/A LEU 45.A N ASN 41.A O no hydrogen 2.985 N/A ARG 46.A N ASP 42.A O no hydrogen 2.882 N/A ARG 46.A NE ASP 42.A OD1 no hydrogen 2.883 N/A ARG 46.A NH1 ASP 156.A OD1 no hydrogen 3.233 N/A ARG 46.A NH1 ASP 156.A OD2 no hydrogen 3.287 N/A ARG 46.A NH2 ASP 156.A OD1 no hydrogen 2.703 N/A ALA 47.A N ASP 43.A O no hydrogen 2.918 N/A VAL 48.A N LEU 44.A O no hydrogen 2.917 N/A ARG 49.A N LEU 45.A O no hydrogen 2.986 N/A ARG 49.A NE LEU 152.A O no hydrogen 2.889 N/A LYS 50.A N ARG 46.A O no hydrogen 3.129 N/A GLU 51.A N ALA 47.A O no hydrogen 3.031 N/A ILE 52.A N VAL 48.A O no hydrogen 2.921 N/A GLU 53.A N ARG 49.A O no hydrogen 3.030 N/A THR 54.A N LYS 50.A O no hydrogen 2.958 N/A THR 54.A OG1 LYS 50.A O no hydrogen 3.097 N/A GLU 55.A N GLU 51.A O no hydrogen 2.659 N/A ILE 56.A N ILE 52.A O no hydrogen 2.940 N/A THR 59.A N GLN 70.A O no hydrogen 2.773 N/A LYS 61.A N VAL 68.A O no hydrogen 2.712 N/A THR 63.A N TYR 66.A O no hydrogen 2.884 N/A TYR 66.A N THR 63.A OG1 no hydrogen 3.291 N/A TYR 66.A OH GLN 70.A OE1 no hydrogen 3.371 N/A ARG 67.A N HIS 133.A O no hydrogen 2.958 N/A ARG 67.A NE GLU 62.A OE2 no hydrogen 2.875 N/A ARG 67.A NH2 GLU 62.A OE2 no hydrogen 3.527 N/A ARG 67.A NH2 GLU 487.A O no hydrogen 2.819 N/A VAL 68.A N LYS 61.A O no hydrogen 2.927 N/A ASN 69.A N THR 127.A O no hydrogen 2.906 N/A ASN 69.A ND2 THR 127.A O no hydrogen 3.271 N/A ASN 69.A ND2 THR 127.A OG1 no hydrogen 3.058 N/A ASN 69.A ND2 THR 129.A OG1 no hydrogen 2.951 N/A GLN 70.A N THR 59.A O no hydrogen 2.929 N/A GLN 70.A NE2 ASN 126.A OD1 no hydrogen 3.634 N/A SER 71.A OG ILE 125.A O no hydrogen 2.776 N/A ALA 75.A N ASP 73.A OD2 no hydrogen 3.066 N/A ASN 76.A N ASP 73.A O no hydrogen 2.962 N/A GLY 79.A N ASN 76.A O no hydrogen 2.710 N/A LEU 80.A N SER 71.A O no hydrogen 2.537 N/A ASP 83.A N ASP 81.A OD2 no hydrogen 3.214 N/A ASP 84.A N ASP 81.A O no hydrogen 3.048 N/A SER 86.A N ASP 84.A OD2 no hydrogen 3.395 N/A SER 86.A OG ASP 84.A OD2 no hydrogen 2.359 N/A ARG 87.A NE GLU 55.A OE1 no hydrogen 3.379 N/A ARG 87.A NE GLU 55.A OE2 no hydrogen 2.969 N/A ARG 87.A NH1 GLU 55.A OE1 no hydrogen 2.989 N/A LEU 88.A N LEU 85.A O no hydrogen 2.781 N/A ASN 90.A N GLU 51.A OE2 no hydrogen 2.862 N/A LEU 91.A N GLU 51.A OE1 no hydrogen 2.994 N/A PHE 92.A N LEU 88.A O no hydrogen 2.921 N/A LYS 93.A N PRO 89.A O no hydrogen 2.979 N/A LEU 94.A N ASN 90.A O no hydrogen 2.875 N/A ARG 95.A N LEU 91.A O no hydrogen 2.952 N/A ARG 95.A NH1 TRP 82.A O no hydrogen 3.063 N/A GLN 96.A N PHE 92.A O no hydrogen 3.025 N/A GLN 96.A NE2 GLU 1.A OE2 no hydrogen 2.945 N/A ILE 97.A N LYS 93.A O no hydrogen 2.995 N/A LEU 98.A N LEU 94.A O no hydrogen 3.002 N/A TYR 99.A N ARG 95.A O no hydrogen 3.095 N/A TYR 99.A OH TRP 222.A O no hydrogen 2.716 N/A SER 100.A N ILE 97.A O no hydrogen 3.233 N/A SER 100.A OG ILE 97.A O no hydrogen 2.814 N/A LYS 101.A NZ ASP 105.A OD1 no hydrogen 3.359 N/A GLN 102.A N GLN 102.A OE1 no hydrogen 2.844 N/A GLN 102.A NE2 GLU 1.A O no hydrogen 3.597 N/A TYR 103.A N SER 100.A OG no hydrogen 3.099 N/A ARG 104.A N SER 100.A O no hydrogen 2.891 N/A ARG 104.A NE TYR 99.A O no hydrogen 2.834 N/A ARG 104.A NH1 LEU 116.A O no hydrogen 2.990 N/A ARG 104.A NH1 GLU 231.A OE1 no hydrogen 2.802 N/A ARG 104.A NH2 GLU 231.A OE1 no hydrogen 3.532 N/A ARG 104.A NH2 GLU 231.A OE2 no hydrogen 2.777 N/A ASP 105.A N LYS 101.A O no hydrogen 2.924 N/A PHE 106.A N GLN 102.A O no hydrogen 3.339 N/A PHE 107.A N TYR 103.A O no hydrogen 2.769 N/A GLY 108.A N ARG 104.A O no hydrogen 2.797 N/A TYR 109.A N ASP 105.A O no hydrogen 3.156 N/A TYR 109.A OH ASP 19.A OD1 no hydrogen 2.778 N/A VAL 110.A N PHE 106.A O no hydrogen 3.044 N/A THR 111.A N PHE 107.A O no hydrogen 3.166 N/A THR 111.A OG1 PHE 107.A O no hydrogen 2.843 N/A LYS 112.A N TYR 109.A O no hydrogen 3.272 N/A LYS 112.A NZ GLU 26.A OE1 no hydrogen 2.952 N/A ALA 113.A N GLY 108.A O no hydrogen 3.155 N/A LYS 115.A NZ GLU 231.A O no hydrogen 3.348 N/A SER 117.A N HIS 224.A O no hydrogen 2.840 N/A SER 117.A OG GLU 230.A OE1 no hydrogen 3.294 N/A SER 117.A OG GLU 230.A OE2 no hydrogen 2.734 N/A GLY 118.A N GLU 230.A OE1 no hydrogen 2.857 N/A SER 119.A N GLU 230.A OE1 no hydrogen 3.024 N/A SER 119.A OG GLU 230.A OE1 no hydrogen 3.530 N/A LYS 120.A N SER 117.A OG no hydrogen 2.848 N/A LYS 120.A NZ SER 143.A OG no hydrogen 3.104 N/A LYS 120.A NZ ILE 225.A O no hydrogen 2.871 N/A THR 121.A N SER 119.A O no hydrogen 2.984 N/A ASP 122.A N TYR 99.A OH no hydrogen 3.127 N/A SER 124.A N GLN 220.A O.A no hydrogen 2.767 N/A SER 124.A N GLN 220.A O.B no hydrogen 2.761 N/A ASN 126.A N SER 218.A O no hydrogen 3.238 N/A ASN 126.A ND2 SER 124.A OG no hydrogen 2.801 N/A THR 127.A N ASN 69.A O no hydrogen 2.973 N/A TYR 128.A N ARG 216.A O no hydrogen 2.936 N/A GLY 131.A N VAL 210.A O no hydrogen 2.805 N/A CYS 132.A N THR 129.A O no hydrogen 2.893 N/A CYS 132.A SG THR 129.A OG1 no hydrogen 3.529 N/A HIS 133.A N ARG 67.A O no hydrogen 2.894 N/A HIS 133.A ND1 GLY 131.A O no hydrogen 2.934 N/A LEU 134.A N VAL 207.A O no hydrogen 3.158 N/A LEU 135.A N ILE 65.A O no hydrogen 2.897 N/A THR 136.A OG1 PRO 346.A O no hydrogen 3.364 N/A HIS 137.A N HIS 205.A O no hydrogen 3.010 N/A HIS 137.A ND1 LEU 135.A O no hydrogen 2.895 N/A VAL 140.A N ASP 138.A OD1 no hydrogen 2.930 N/A SER 143.A OG HIS 224.A ND1 no hydrogen 2.748 N/A ARG 144.A N ILE 141.A O no hydrogen 3.242 N/A ARG 144.A NH2 ASP 139.A O no hydrogen 2.970 N/A ARG 145.A N TYR 223.A O no hydrogen 2.777 N/A ARG 145.A NH1 LYS 115.A O no hydrogen 2.731 N/A ILE 146.A N TYR 223.A O no hydrogen 3.144 N/A SER 147.A N PHE 196.A O no hydrogen 2.806 N/A SER 147.A OG.A ASP 139.A OD1 no hydrogen 2.808 N/A SER 147.A OG.B ASP 139.A OD1 no hydrogen 3.088 N/A PHE 148.A N GLY 221.A O no hydrogen 2.956 N/A ILE 149.A N ALA 194.A O no hydrogen 2.804 N/A LEU 150.A N ILE 219.A O no hydrogen 2.802 N/A TYR 151.A N GLN 192.A O no hydrogen 2.987 N/A LEU 152.A N LEU 217.A O no hydrogen 2.860 N/A ASP 156.A N ASP 154.A OD1 no hydrogen 2.970 N/A ARG 157.A N ASP 154.A O no hydrogen 3.328 N/A TRP 159.A N GLN 189.A OE1 no hydrogen 2.913 N/A TRP 159.A NE1 GLY 164.A O no hydrogen 2.841 N/A TYR 163.A N LYS 160.A O no hydrogen 2.923 N/A GLY 164.A N SER 161.A O no hydrogen 3.156 N/A GLY 165.A N GLU 209.A O no hydrogen 3.200 N/A GLY 166.A N GLU 208.A OE1 no hydrogen 2.875 N/A LEU 167.A N LEU 186.A O no hydrogen 2.945 N/A ARG 168.A N ASP 206.A O no hydrogen 2.970 N/A ARG 168.A NE ASP 206.A OD2 no hydrogen 2.760 N/A ARG 168.A NH1 ASP 206.A OD1 no hydrogen 2.738 N/A ARG 168.A NH1 ASP 206.A OD2 no hydrogen 3.497 N/A LEU 169.A N ALA 184.A O no hydrogen 2.942 N/A PHE 170.A N PHE 204.A O no hydrogen 3.024 N/A ILE 173.A N VAL 177.A O no hydrogen 2.817 N/A LEU 174.A N VAL 177.A O no hydrogen 3.351 N/A ASN 176.A N GLY 201.A O no hydrogen 2.887 N/A VAL 177.A N LEU 174.A O no hydrogen 2.714 N/A HIS 179.A N PRO 171.A O no hydrogen 2.756 N/A HIS 179.A NE2 GLN 363.A OE1 no hydrogen 2.787 N/A ASP 181.A N HIS 179.A ND1 no hydrogen 3.090 N/A SER 183.A N LEU 169.A O no hydrogen 2.832 N/A LEU 186.A N LEU 167.A O no hydrogen 2.753 N/A GLN 189.A N GLN 192.A OE1 no hydrogen 3.117 N/A GLN 189.A NE2 TRP 159.A O no hydrogen 2.791 N/A ASN 191.A N TYR 151.A O no hydrogen 2.905 N/A ASN 191.A ND2 VAL 40.A O no hydrogen 2.845 N/A GLN 192.A N GLN 189.A O no hydrogen 3.038 N/A GLN 192.A NE2 THR 35.A OG1 no hydrogen 2.977 N/A ILE 193.A N ILE 36.A O no hydrogen 2.920 N/A ALA 194.A N ILE 149.A O no hydrogen 2.968 N/A PHE 195.A N GLY 34.A O no hydrogen 2.971 N/A PHE 196.A N SER 147.A O no hydrogen 2.963 N/A VAL 198.A N ARG 145.A O no hydrogen 2.965 N/A LEU 199.A N SER 203.A OG no hydrogen 2.937 N/A PHE 202.A N LEU 199.A O no hydrogen 2.914 N/A SER 203.A N LEU 199.A O no hydrogen 3.062 N/A SER 203.A OG ASP 138.A O no hydrogen 2.963 N/A SER 203.A OG LEU 199.A O no hydrogen 3.250 N/A PHE 204.A N PHE 202.A O no hydrogen 2.779 N/A HIS 205.A N HIS 137.A O no hydrogen 2.959 N/A HIS 205.A ND1 SER 203.A O no hydrogen 2.934 N/A ASP 206.A N ARG 168.A O no hydrogen 2.946 N/A VAL 207.A N LEU 134.A O no hydrogen 2.793 N/A GLU 208.A N GLY 166.A O no hydrogen 2.860 N/A VAL 210.A N CYS 132.A O no hydrogen 3.049 N/A LYS 211.A N TYR 163.A O no hydrogen 2.727 N/A LYS 211.A NZ GLU 208.A OE2 no hydrogen 3.460 N/A LYS 214.A N VAL 212.A O no hydrogen 2.904 N/A ARG 216.A N TYR 128.A O no hydrogen 2.923 N/A ARG 216.A NE GLY 165.A O no hydrogen 2.692 N/A ARG 216.A NH2 GLY 165.A O no hydrogen 2.926 N/A SER 218.A N ASN 126.A O no hydrogen 3.064 N/A ILE 219.A N LEU 150.A O no hydrogen 2.819 N/A GLN 220.A N.A SER 124.A O no hydrogen 2.984 N/A GLN 220.A N.B SER 124.A O no hydrogen 2.942 N/A GLN 220.A NE2.A SER 124.A OG no hydrogen 2.951 N/A GLN 220.A NE2.B SER 147.A OG.B no hydrogen 3.312 N/A GLN 220.A NE2.B GLY 221.A O no hydrogen 3.045 N/A GLY 221.A N PHE 148.A O no hydrogen 2.893 N/A TRP 222.A N ASP 122.A O no hydrogen 2.992 N/A TRP 222.A NE1 ASP 139.A OD1 no hydrogen 3.081 N/A TYR 223.A N ILE 146.A O no hydrogen 2.880 N/A TYR 223.A OH LEU 98.A O no hydrogen 2.647 N/A HIS 224.A ND1 SER 143.A OG no hydrogen 2.748 N/A HIS 224.A NE2 ASP 122.A OD2 no hydrogen 2.702 N/A ILE 225.A N SER 143.A O no hydrogen 2.998 N/A GLN 227.A N GLU 230.A OE2 no hydrogen 2.929 N/A GLY 229.A N TYR 233.A O no hydrogen 2.765 N/A GLU 230.A N GLN 227.A O no hydrogen 2.912 N/A GLY 232.A N GLY 229.A O no hydrogen 3.057 N/A TYR 233.A N GLU 230.A O no hydrogen 2.921 N/A GLU 237.A N ILE 234.A O no hydrogen 3.409 N/A PHE 241.A N LEU 238.A O no hydrogen 3.122 N/A GLU 242.A N GLU 239.A O no hydrogen 3.303 N/A PHE 243.A N ILE 344.A O no hydrogen 2.929 N/A LYS 245.A NZ ASP 240.A O no hydrogen 2.857 N/A LYS 245.A NZ GLU 242.A O no hydrogen 2.757 N/A ARG 248.A NE ASP 542.A OD1 no hydrogen 2.806 N/A ARG 248.A NH1 ARG 455.A O no hydrogen 3.540 N/A ARG 248.A NH2 ARG 455.A O no hydrogen 2.865 N/A ARG 248.A NH2 ASP 542.A OD1 no hydrogen 3.527 N/A ARG 248.A NH2 ASP 542.A OD2 no hydrogen 2.931 N/A ASN 249.A N GLU 435.A O no hydrogen 2.987 N/A LEU 251.A N VAL 433.A O no hydrogen 2.921 N/A SER 252.A N GLU 255.A OE2 no hydrogen 3.328 N/A SER 252.A OG GLU 255.A OE2 no hydrogen 3.030 N/A GLU 255.A N SER 252.A OG no hydrogen 3.407 N/A VAL 256.A N SER 252.A O no hydrogen 3.263 N/A LYS 257.A N PHE 253.A O no hydrogen 2.983 N/A HIS 258.A N HIS 254.A O no hydrogen 3.183 N/A PHE 259.A N GLU 255.A O no hydrogen 3.152 N/A GLU 260.A N VAL 256.A O no hydrogen 3.027 N/A LYS 261.A N LYS 257.A O no hydrogen 2.911 N/A MET 262.A N HIS 258.A O no hydrogen 3.161 N/A LEU 263.A N PHE 259.A O no hydrogen 3.000 N/A LEU 267.A N VAL 265.A O no hydrogen 3.017 N/A SER 268.A N GLU 271.A OE1 no hydrogen 2.884 N/A GLU 271.A N SER 268.A OG no hydrogen 3.092 N/A PHE 272.A N SER 268.A O no hydrogen 2.939 N/A THR 273.A N GLU 269.A O no hydrogen 2.904 N/A THR 273.A OG1 GLU 269.A O no hydrogen 2.902 N/A TYR 274.A N ALA 270.A O no hydrogen 2.953 N/A LEU 275.A N GLU 271.A O no hydrogen 2.856 N/A SER 276.A N PHE 272.A O no hydrogen 2.856 N/A SER 276.A OG PHE 272.A O no hydrogen 3.397 N/A SER 276.A OG THR 273.A O no hydrogen 2.609 N/A GLN 277.A N TYR 274.A O no hydrogen 3.097 N/A TYR 278.A N LEU 275.A O no hydrogen 3.186 N/A ILE 279.A N LEU 275.A O no hydrogen 2.901 N/A SER 280.A N PHE 307.A O no hydrogen 2.858 N/A SER 280.A OG GLU 282.A OE2 no hydrogen 2.977 N/A HIS 283.A N SER 280.A O no hydrogen 3.053 N/A HIS 283.A NE2 GLU 305.A O no hydrogen 3.085 N/A HIS 283.A NE2 SER 306.A O no hydrogen 2.960 N/A LEU 284.A N PRO 281.A O no hydrogen 2.973 N/A SER 285.A OG GLU 282.A O no hydrogen 3.420 N/A GLY 288.A N SER 285.A OG no hydrogen 2.974 N/A ILE 289.A N SER 285.A O no hydrogen 2.950 N/A GLU 290.A N SER 286.A O no hydrogen 3.089 N/A LYS 291.A N LYS 287.A O no hydrogen 2.977 N/A LEU 292.A N GLY 288.A O no hydrogen 3.044 N/A GLN 293.A N ILE 289.A O no hydrogen 2.842 N/A GLN 293.A NE2 LEU 426.A O no hydrogen 3.016 N/A LYS 294.A N GLU 290.A O no hydrogen 2.969 N/A GLN 295.A N LYS 291.A O no hydrogen 2.966 N/A PHE 296.A N LEU 292.A O no hydrogen 2.901 N/A VAL 297.A N GLN 293.A O no hydrogen 2.967 N/A GLU 298.A N LYS 294.A O no hydrogen 3.064 N/A ASN 299.A N GLN 295.A O no hydrogen 2.930 N/A SER 300.A N PHE 296.A O no hydrogen 2.823 N/A LEU 302.A N LEU 512.A O no hydrogen 2.740 N/A GLN 303.A NE2 ASP 503.A OD2 no hydrogen 2.692 N/A ILE 304.A N PHE 510.A O no hydrogen 2.748 N/A PHE 307.A N ASN 508.A O no hydrogen 3.062 N/A LEU 308.A N ASN 508.A OD1 no hydrogen 2.765 N/A ASN 309.A N TYR 278.A O no hydrogen 2.824 N/A ASN 309.A ND2 SER 276.A O no hydrogen 3.017 N/A ASN 309.A ND2 GLN 277.A O no hydrogen 2.980 N/A LYS 312.A N ASN 309.A OD1 no hydrogen 2.839 N/A LYS 312.A NZ GLN 277.A O no hydrogen 3.130 N/A LYS 312.A NZ ASP 311.A OD2 no hydrogen 3.165 N/A SER 313.A N ASN 309.A O no hydrogen 2.917 N/A GLU 314.A N ASP 310.A O no hydrogen 2.916 N/A LEU 315.A N ASP 311.A O no hydrogen 3.150 N/A LEU 316.A N LYS 312.A O no hydrogen 3.005 N/A LYS 317.A N SER 313.A O no hydrogen 3.003 N/A LYS 318.A N GLU 314.A O no hydrogen 3.096 N/A VAL 319.A N LEU 315.A O no hydrogen 3.154 N/A ILE 320.A N LEU 316.A O no hydrogen 3.012 N/A LYS 321.A N LYS 317.A O no hydrogen 2.960 N/A GLN 322.A N LYS 318.A O no hydrogen 2.919 N/A GLN 322.A NE2 GLU 326.A OE1 no hydrogen 2.546 N/A GLN 322.A NE2 ARG 398.A O no hydrogen 2.945 N/A LYS 323.A N VAL 319.A O no hydrogen 3.076 N/A LYS 323.A NZ GLN 327.A OE1 no hydrogen 2.890 N/A LYS 323.A NZ GLU 405.A OE1 no hydrogen 2.952 N/A LYS 323.A NZ GLU 405.A OE2 no hydrogen 2.942 N/A GLU 324.A N ILE 320.A O no hydrogen 2.983 N/A LEU 325.A N LYS 321.A O no hydrogen 2.940 N/A LEU 325.A N GLN 322.A O no hydrogen 3.244 N/A GLU 326.A N GLN 322.A O no hydrogen 2.877 N/A GLN 327.A N LYS 323.A O no hydrogen 3.156 N/A GLN 327.A NE2 GLN 322.A OE1 no hydrogen 3.472 N/A GLN 327.A NE2 ARG 398.A O no hydrogen 3.474 N/A GLN 327.A NE2 ASN 401.A O no hydrogen 3.108 N/A CYS 329.A SG PRO 330.A O no hydrogen 3.657 N/A TYR 331.A OH PRO 444.A O no hydrogen 2.750 N/A SER 333.A N ASP 181.A OD2 no hydrogen 2.885 N/A SER 333.A OG ASP 181.A OD2 no hydrogen 2.853 N/A LYS 334.A N HIS 332.A ND1 no hydrogen 3.081 N/A ASP 335.A N HIS 332.A O no hydrogen 2.939 N/A VAL 336.A N SER 333.A O no hydrogen 3.285 N/A TRP 340.A N LYS 337.A O no hydrogen 2.985 N/A TRP 340.A NE1 GLU 405.A OE1 no hydrogen 2.857 N/A LYS 341.A N TYR 353.A O no hydrogen 2.812 N/A LYS 341.A NZ ASP 355.A OD2 no hydrogen 2.877 N/A LYS 341.A NZ LYS 357.A O no hydrogen 3.055 N/A LYS 341.A NZ GLU 358.A O no hydrogen 3.060 N/A ALA 343.A N TYR 351.A O no hydrogen 2.845 N/A ILE 344.A N PHE 243.A O no hydrogen 2.924 N/A LYS 348.A N PRO 345.A O no hydrogen 2.943 N/A LYS 348.A NZ GLU 242.A OE1 no hydrogen 2.636 N/A ALA 349.A N PRO 345.A O no hydrogen 3.014 N/A ARG 350.A N PHE 448.A O no hydrogen 3.055 N/A ARG 350.A NE SER 180.A O no hydrogen 3.228 N/A ARG 350.A NE SER 180.A OG no hydrogen 3.173 N/A ARG 350.A NH1 SER 180.A O no hydrogen 2.712 N/A ARG 350.A NH2 MET 446.A O no hydrogen 2.826 N/A LEU 352.A N ARG 441.A O no hydrogen 2.933 N/A TYR 353.A N LYS 341.A O no hydrogen 2.863 N/A ILE 354.A N ILE 439.A O no hydrogen 2.848 N/A LYS 357.A N ASP 355.A OD2 no hydrogen 2.966 N/A LYS 357.A NZ ASN 375.A OD1 no hydrogen 3.568 N/A LYS 357.A NZ ASP 376.A O no hydrogen 3.096 N/A GLU 358.A N ASP 376.A OD1 no hydrogen 2.773 N/A TYR 359.A OH VAL 336.A O no hydrogen 2.686 N/A ASN 361.A ND2 SER 333.A O no hydrogen 2.861 N/A ASN 361.A ND2 VAL 336.A O no hydrogen 3.345 N/A ASN 361.A ND2 TYR 359.A OH no hydrogen 3.056 N/A GLN 363.A N ASP 367.A OD1 no hydrogen 2.965 N/A GLN 363.A NE2 SER 333.A OG no hydrogen 3.027 N/A GLN 363.A NE2 ASN 361.A OD1 no hydrogen 2.659 N/A THR 364.A N ASP 367.A OD1 no hydrogen 2.967 N/A ASP 367.A N THR 364.A OG1 no hydrogen 3.168 N/A ILE 368.A N THR 364.A O no hydrogen 3.421 N/A LEU 369.A N GLU 365.A O no hydrogen 2.980 N/A GLU 370.A N ALA 366.A O no hydrogen 2.954 N/A ALA 371.A N ASP 367.A O no hydrogen 3.333 N/A LEU 372.A N ILE 368.A O no hydrogen 2.955 N/A ASN 373.A N LEU 369.A O no hydrogen 2.977 N/A ASN 374.A N ALA 371.A O no hydrogen 3.257 N/A ASN 379.A N GLY 356.A O no hydrogen 2.801 N/A PHE 382.A N ASN 379.A OD1 no hydrogen 3.021 N/A THR 383.A N ASN 379.A O no hydrogen 3.130 N/A THR 383.A OG1 ASN 379.A O no hydrogen 2.990 N/A LYS 384.A N PHE 380.A O no hydrogen 2.942 N/A LYS 384.A NZ ASP 410.A OD2 no hydrogen 2.678 N/A ASP 385.A N GLN 381.A O no hydrogen 2.924 N/A ALA 386.A N PHE 382.A O no hydrogen 2.951 N/A ILE 387.A N THR 383.A O no hydrogen 2.989 N/A LYS 388.A N LYS 384.A O no hydrogen 3.109 N/A ILE 389.A N ASP 385.A O no hydrogen 3.380 N/A ILE 390.A N ALA 386.A O no hydrogen 3.151 N/A SER 391.A N ILE 387.A O no hydrogen 2.714 N/A ASP 392.A N LYS 388.A O no hydrogen 2.837 N/A ALA 393.A N ILE 389.A O no hydrogen 3.311 N/A SER 394.A N ILE 390.A O no hydrogen 3.336 N/A SER 394.A OG SER 391.A O no hydrogen 3.225 N/A GLY 395.A N SER 391.A O no hydrogen 2.998 N/A SER 397.A OG GLU 399.A OE1 no hydrogen 3.348 N/A GLU 399.A N SER 397.A OG no hydrogen 3.301 N/A ASN 400.A N SER 397.A O no hydrogen 3.258 N/A ASN 401.A N SER 397.A O no hydrogen 3.035 N/A ASN 401.A ND2 GLN 322.A OE1 no hydrogen 3.269 N/A ASN 401.A ND2 SER 397.A O no hydrogen 3.176 N/A ASP 403.A N ASN 401.A OD1 no hydrogen 2.791 N/A GLU 405.A N GLU 405.A OE2 no hydrogen 2.835 N/A LEU 406.A N PHE 402.A O no hydrogen 2.917 N/A ALA 407.A N ASP 403.A O no hydrogen 3.065 N/A LEU 408.A N ALA 404.A O no hydrogen 2.896 N/A ILE 409.A N GLU 405.A O no hydrogen 2.838 N/A ASP 410.A N LEU 406.A O no hydrogen 2.974 N/A LEU 411.A N ALA 407.A O no hydrogen 3.049 N/A ALA 412.A N LEU 408.A O no hydrogen 2.947 N/A VAL 413.A N ILE 409.A O no hydrogen 2.872 N/A PHE 414.A N ASP 410.A O no hydrogen 3.028 N/A HIS 415.A N LEU 411.A O no hydrogen 3.147 N/A LYS 416.A N ALA 412.A O no hydrogen 2.901 N/A SER 417.A N PHE 414.A O no hydrogen 2.976 N/A SER 417.A OG PHE 414.A O no hydrogen 2.632 N/A PHE 420.A N SER 417.A OG no hydrogen 3.031 N/A LYS 421.A N SER 417.A O no hydrogen 3.235 N/A LYS 421.A NZ GLU 255.A OE1 no hydrogen 2.509 N/A LYS 421.A NZ LYS 416.A O no hydrogen 2.907 N/A LYS 421.A NZ GLU 435.A OE2 no hydrogen 2.700 N/A LYS 422.A N THR 418.A O no hydrogen 2.936 N/A LYS 422.A NZ HIS 258.A ND1 no hydrogen 3.493 N/A LYS 422.A NZ GLU 271.A OE1 no hydrogen 3.133 N/A LYS 422.A NZ GLU 271.A OE2 no hydrogen 2.521 N/A TYR 423.A N ILE 419.A O no hydrogen 2.985 N/A TYR 423.A OH HIS 283.A O no hydrogen 2.704 N/A LEU 424.A N PHE 420.A O no hydrogen 2.892 N/A ALA 425.A N LYS 421.A O no hydrogen 2.968 N/A LEU 426.A N LYS 422.A O no hydrogen 2.956 N/A LEU 427.A N TYR 423.A O no hydrogen 2.916 N/A THR 428.A N LEU 424.A O no hydrogen 3.067 N/A THR 428.A OG1 LEU 424.A O no hydrogen 2.804 N/A LEU 430.A N THR 428.A OG1 no hydrogen 3.096 N/A CYS 431.A N LYS 544.A O no hydrogen 2.895 N/A CYS 431.A SG VAL 256.A O no hydrogen 4.012 N/A CYS 431.A SG PRO 432.A O no hydrogen 3.778 N/A VAL 433.A N ASP 542.A O no hydrogen 2.871 N/A SER 434.A OG ASP 542.A OD1 no hydrogen 2.479 N/A GLU 435.A N ASN 249.A O no hydrogen 2.855 N/A GLN 436.A N LYS 540.A O no hydrogen 2.881 N/A GLN 436.A NE2 LYS 245.A O no hydrogen 2.925 N/A LEU 438.A N LYS 538.A O no hydrogen 2.905 N/A ILE 439.A N ILE 354.A O no hydrogen 3.029 N/A ARG 440.A N ASP 536.A O no hydrogen 2.845 N/A ARG 440.A NE ASP 536.A OD1 no hydrogen 2.766 N/A ARG 440.A NH2 ASP 536.A OD1 no hydrogen 3.485 N/A ARG 440.A NH2 ASP 536.A OD2 no hydrogen 2.745 N/A ARG 441.A N LEU 352.A O no hydrogen 2.838 N/A ARG 441.A NE SER 533.A OG no hydrogen 2.945 N/A PHE 442.A N ARG 534.A O no hydrogen 2.790 N/A ARG 443.A N ASP 447.A OD1 no hydrogen 2.692 N/A ARG 443.A NE ASP 447.A OD1 no hydrogen 2.759 N/A ARG 443.A NH1 PRO 330.A O no hydrogen 2.925 N/A ARG 443.A NH2 ASP 447.A OD1 no hydrogen 3.441 N/A ARG 443.A NH2 ASP 447.A OD2 no hydrogen 2.943 N/A GLY 445.A N VAL 526.A O no hydrogen 2.724 N/A MET 446.A N ARG 443.A O no hydrogen 3.143 N/A ASP 447.A N ARG 443.A O no hydrogen 3.177 N/A PHE 448.A N ARG 350.A O no hydrogen 2.849 N/A THR 449.A N VAL 523.A O no hydrogen 2.903 N/A ALA 451.A N ASP 64.A OD1 no hydrogen 2.858 N/A THR 452.A N GLU 521.A O no hydrogen 3.174 N/A LYS 453.A NZ ASP 497.A OD2 no hydrogen 2.907 N/A LYS 453.A NZ SER 518.A O no hydrogen 3.211 N/A CYS 454.A SG ASP 516.A O no hydrogen 3.841 N/A ARG 455.A NH2 GLU 239.A OE1 no hydrogen 3.250 N/A ASN 457.A ND2 ASP 542.A OD1 no hydrogen 3.563 N/A LEU 460.A N ASN 457.A O no hydrogen 2.966 N/A LYS 461.A N GLU 458.A O no hydrogen 3.159 N/A ASN 463.A N LEU 460.A O no hydrogen 2.989 N/A ASP 465.A N ASN 463.A OD1 no hydrogen 2.950 N/A ILE 466.A N ASN 463.A O no hydrogen 3.231 N/A ILE 467.A N VAL 543.A O no hydrogen 2.901 N/A ALA 469.A N ILE 467.A O no hydrogen 2.781 N/A VAL 470.A N ARG 515.A O no hydrogen 2.957 N/A LEU 471.A N TRP 541.A O no hydrogen 2.943 N/A GLU 472.A N VAL 513.A O no hydrogen 2.864 N/A GLY 473.A N MET 539.A O no hydrogen 2.716 N/A THR 474.A N ASN 511.A O no hydrogen 2.827 N/A THR 474.A OG1 GLU 492.A OE2 no hydrogen 2.623 N/A LEU 475.A N VAL 537.A O no hydrogen 2.810 N/A CYS 476.A N THR 509.A O no hydrogen 2.907 N/A CYS 476.A SG THR 478.A OG1 no hydrogen 3.327 N/A CYS 476.A SG ALA 506.A O no hydrogen 3.294 N/A CYS 476.A SG TRP 535.A O no hydrogen 3.928 N/A LEU 477.A N TRP 535.A O no hydrogen 2.762 N/A THR 478.A N ALA 506.A O no hydrogen 3.207 N/A THR 478.A OG1 TRP 535.A O no hydrogen 3.445 N/A SER 480.A OG SER 532.A OG no hydrogen 2.733 N/A TRP 483.A NE1 SER 480.A OG no hydrogen 2.783 N/A GLU 484.A N GLU 484.A OE1 no hydrogen 2.822 N/A GLY 486.A N TRP 483.A O no hydrogen 3.003 N/A GLU 487.A N SER 485.A OG no hydrogen 3.154 N/A GLY 489.A N GLY 486.A O no hydrogen 2.972 N/A GLY 490.A N LYS 524.A O no hydrogen 2.874 N/A TYR 491.A OH GLU 62.A OE1 no hydrogen 2.602 N/A GLU 492.A N ASP 503.A O no hydrogen 2.946 N/A LEU 493.A N PHE 522.A O no hydrogen 2.867 N/A TYR 494.A N ILE 501.A O no hydrogen 2.893 N/A MET 495.A N LEU 520.A O no hydrogen 2.900 N/A MET 496.A N SER 498.A O no hydrogen 2.977 N/A LEU 500.A N TYR 494.A O no hydrogen 2.745 N/A ILE 501.A N TYR 494.A O no hydrogen 3.141 N/A ASP 503.A N GLU 492.A O no hydrogen 2.981 N/A TRP 507.A NE1 SER 313.A OG no hydrogen 2.793 N/A ASN 508.A N CYS 476.A O no hydrogen 2.781 N/A ASN 508.A ND2 LEU 308.A O no hydrogen 2.955 N/A THR 509.A N CYS 476.A O no hydrogen 3.379 N/A PHE 510.A N ILE 304.A O no hydrogen 2.851 N/A ASN 511.A N THR 474.A O no hydrogen 2.885 N/A ASN 511.A ND2 GLU 492.A OE1 no hydrogen 3.058 N/A ASN 511.A ND2 ASP 503.A OD2 no hydrogen 2.824 N/A LEU 512.A N LEU 302.A O no hydrogen 2.836 N/A VAL 513.A N GLU 472.A O no hydrogen 2.854 N/A LEU 514.A N SER 300.A O no hydrogen 2.967 N/A ARG 515.A N VAL 470.A O no hydrogen 2.835 N/A ARG 515.A NH1 GLU 472.A OE2 no hydrogen 2.895 N/A ARG 515.A NH2 THR 452.A O no hydrogen 2.850 N/A ARG 515.A NH2 VAL 519.A O no hydrogen 2.847 N/A SER 518.A N ASP 516.A OD1 no hydrogen 2.972 N/A SER 518.A OG ASP 516.A OD1 no hydrogen 2.909 N/A VAL 519.A N ASP 516.A O no hydrogen 3.398 N/A LEU 520.A N MET 495.A O no hydrogen 2.781 N/A GLU 521.A N THR 452.A O no hydrogen 3.029 N/A PHE 522.A N LEU 493.A O no hydrogen 3.024 N/A VAL 523.A N THR 449.A OG1 no hydrogen 2.853 N/A LYS 524.A N TYR 491.A O no hydrogen 2.955 N/A LYS 524.A NZ THR 63.A O no hydrogen 2.647 N/A LYS 524.A NZ ASP 64.A O no hydrogen 3.075 N/A LYS 524.A NZ TYR 66.A O no hydrogen 3.385 N/A LYS 524.A NZ HIS 133.A NE2 no hydrogen 2.926 N/A TYR 525.A OH GLU 209.A OE1 no hydrogen 2.663 N/A VAL 526.A N ASP 447.A O no hydrogen 3.029 N/A SER 527.A N LEU 488.A O no hydrogen 2.889 N/A SER 527.A OG GLU 209.A OE2 no hydrogen 2.694 N/A TRP 528.A N GLU 209.A OE1 no hydrogen 2.851 N/A SER 529.A N SER 527.A OG no hydrogen 2.909 N/A ALA 530.A N SER 527.A O no hydrogen 2.962 N/A SER 532.A OG SER 480.A OG no hydrogen 2.733 N/A SER 532.A OG SER 533.A O no hydrogen 2.909 N/A SER 533.A N GLU 324.A OE2 no hydrogen 2.911 N/A SER 533.A OG GLU 324.A OE2 no hydrogen 3.512 N/A ARG 534.A N PHE 442.A O no hydrogen 2.994 N/A ARG 534.A NE ASP 536.A OD2 no hydrogen 2.900 N/A ARG 534.A NH1 ASP 536.A OD2 no hydrogen 2.943 N/A ARG 534.A NH2 GLY 490.A O no hydrogen 2.917 N/A TRP 535.A N THR 478.A OG1 no hydrogen 3.207 N/A TRP 535.A NE1 GLU 324.A OE2 no hydrogen 2.793 N/A ASP 536.A N ARG 440.A O no hydrogen 2.948 N/A VAL 537.A N LEU 475.A O no hydrogen 2.864 N/A LYS 538.A N LEU 438.A O no hydrogen 2.828 N/A LYS 538.A NZ GLU 472.A OE1 no hydrogen 2.579 N/A LYS 538.A NZ THR 474.A OG1 no hydrogen 2.977 N/A LYS 538.A NZ GLU 492.A OE2 no hydrogen 3.409 N/A MET 539.A N GLY 473.A O no hydrogen 2.871 N/A LYS 540.A N GLN 436.A O no hydrogen 2.879 N/A LYS 540.A NZ ASP 246.A OD2 no hydrogen 3.110 N/A TRP 541.A N LEU 471.A O no hydrogen 2.810 N/A ASP 542.A N SER 434.A OG no hydrogen 2.963 N/A LYS 544.A N CYS 431.A O no hydrogen 2.882 N/A LYS 544.A NZ GLU 260.A OE2 no hydrogen 2.546 N/A SER 545.A N ASP 465.A O no hydrogen 3.248 N/A