Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7kj3_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLN 4.A OE1 no hydrogen 2.852 N/A GLU 3.A N GLU 3.A OE2 no hydrogen 2.821 N/A GLN 4.A N ILE 1.A O no hydrogen 3.052 N/A LYS 6.A N GLU 2.A O no hydrogen 2.949 N/A THR 7.A N GLU 3.A O no hydrogen 3.283 N/A THR 7.A OG1 GLU 3.A O no hydrogen 3.081 N/A THR 7.A OG1 GLN 4.A O no hydrogen 3.455 N/A PHE 8.A N GLN 4.A O no hydrogen 2.932 N/A LEU 9.A N ALA 5.A O no hydrogen 2.941 N/A ASP 10.A N LYS 6.A O no hydrogen 2.845 N/A LYS 11.A N THR 7.A O no hydrogen 3.110 N/A LYS 11.A NZ GLU 15.A OE2 no hydrogen 2.825 N/A PHE 12.A N PHE 8.A O no hydrogen 2.935 N/A ASN 13.A N LEU 9.A O no hydrogen 2.835 N/A ASN 13.A ND2 LEU 9.A O no hydrogen 2.774 N/A ASN 13.A ND2 GLN 76.A OE1 no hydrogen 2.957 N/A HIS 14.A N ASP 10.A O no hydrogen 3.252 N/A GLU 15.A N LYS 11.A O no hydrogen 2.860 N/A ALA 16.A N PHE 12.A O no hydrogen 2.863 N/A GLU 17.A N ASN 13.A O no hydrogen 3.024 N/A ASP 18.A N GLU 15.A O no hydrogen 3.184 N/A LEU 19.A N GLU 15.A O no hydrogen 3.482 N/A PHE 20.A N ALA 16.A O no hydrogen 3.018 N/A TYR 21.A OH ASP 335.A OD2 no hydrogen 3.261 N/A GLN 22.A N ASP 18.A O no hydrogen 2.934 N/A SER 23.A N LEU 19.A O no hydrogen 3.107 N/A SER 24.A N PHE 20.A O no hydrogen 2.978 N/A SER 24.A OG PHE 20.A O no hydrogen 2.737 N/A SER 24.A OG TYR 21.A O no hydrogen 3.151 N/A SER 24.A OG LEU 331.A O no hydrogen 3.401 N/A LEU 25.A N TYR 21.A O no hydrogen 2.752 N/A ALA 26.A N GLN 22.A O no hydrogen 3.002 N/A SER 27.A N SER 23.A O no hydrogen 2.956 N/A TRP 28.A N SER 24.A O no hydrogen 2.951 N/A ASN 29.A N LEU 25.A O no hydrogen 2.821 N/A TYR 30.A N ALA 26.A O no hydrogen 2.956 N/A ASN 31.A N SER 27.A O no hydrogen 2.939 N/A THR 32.A N TRP 28.A O no hydrogen 2.969 N/A ASN 33.A N TYR 30.A O no hydrogen 2.954 N/A ILE 34.A N LYS 321.A O no hydrogen 2.921 N/A ASN 38.A N THR 35.A OG1 no hydrogen 3.244 N/A VAL 39.A N THR 35.A O no hydrogen 2.874 N/A GLN 40.A N GLU 36.A O no hydrogen 2.832 N/A ASN 41.A N GLU 37.A O no hydrogen 2.959 N/A MET 42.A N ASN 38.A O no hydrogen 2.893 N/A ASN 43.A N VAL 39.A O no hydrogen 2.919 N/A ASN 44.A N GLN 40.A O no hydrogen 2.899 N/A ASN 44.A ND2 GLN 40.A OE1 no hydrogen 2.915 N/A ALA 45.A N ASN 41.A O no hydrogen 2.853 N/A GLY 46.A N MET 42.A O no hydrogen 3.088 N/A ASP 47.A N ASN 43.A O no hydrogen 2.837 N/A LYS 48.A N ASN 44.A O no hydrogen 3.450 N/A LYS 48.A NZ ASN 44.A O no hydrogen 2.847 N/A TRP 49.A N ALA 45.A O no hydrogen 3.270 N/A SER 50.A N GLY 46.A O no hydrogen 2.880 N/A ALA 51.A N ASP 47.A O no hydrogen 2.932 N/A PHE 52.A N LYS 48.A O no hydrogen 3.127 N/A LEU 53.A N TRP 49.A O no hydrogen 3.164 N/A LYS 54.A N SER 50.A O no hydrogen 3.300 N/A GLN 56.A N PHE 52.A O no hydrogen 3.115 N/A SER 57.A N LEU 53.A O no hydrogen 2.888 N/A SER 57.A OG LYS 54.A O no hydrogen 2.599 N/A THR 58.A N LYS 54.A O no hydrogen 3.239 N/A LEU 59.A N GLU 55.A O no hydrogen 3.163 N/A ALA 60.A N GLN 56.A O no hydrogen 2.819 N/A MET 62.A N LEU 59.A O no hydrogen 3.176 N/A GLU 67.A N PRO 64.A O no hydrogen 3.184 N/A ILE 68.A N LEU 65.A O no hydrogen 3.353 N/A ASN 70.A N GLU 2.A OE2 no hydrogen 3.036 N/A LYS 74.A N ASN 70.A O no hydrogen 3.416 N/A LEU 75.A N LEU 71.A O no hydrogen 3.014 N/A GLN 76.A N THR 72.A O no hydrogen 3.200 N/A LEU 77.A N VAL 73.A O no hydrogen 2.889 N/A GLN 78.A N LYS 74.A O no hydrogen 2.940 N/A GLN 78.A NE2 GLN 82.A OE1 no hydrogen 2.889 N/A ALA 79.A N GLN 76.A O no hydrogen 3.045 N/A LEU 80.A N GLN 76.A O no hydrogen 3.280 N/A LEU 80.A N LEU 77.A O no hydrogen 3.120 N/A GLN 81.A N LEU 77.A O no hydrogen 2.750 N/A GLN 82.A NE2 TYR 176.A OH no hydrogen 3.271 N/A GLN 82.A NE2 TYR 182.A OH no hydrogen 3.562 N/A GLY 84.A N ASN 174.A OD1 no hydrogen 2.966 N/A SER 86.A OG SER 85.A O no hydrogen 2.636 N/A SER 89.A OG ASP 91.A OD1 no hydrogen 2.591 N/A LYS 92.A N ASP 91.A OD1 no hydrogen 3.009 N/A LYS 92.A NZ GLU 169.A OE1 no hydrogen 2.870 N/A LYS 92.A NZ GLU 169.A OE2 no hydrogen 2.778 N/A SER 93.A N SER 89.A O no hydrogen 2.889 N/A LYS 94.A N GLU 90.A O no hydrogen 3.052 N/A LYS 94.A NZ GLU 90.A OE2 no hydrogen 2.773 N/A ARG 95.A N ASP 91.A O no hydrogen 2.838 N/A ARG 95.A NE GLU 162.A OE1 no hydrogen 3.449 N/A ARG 95.A NE GLU 162.A OE2 no hydrogen 2.830 N/A ARG 95.A NH1 GLU 162.A OE1 no hydrogen 2.801 N/A LEU 96.A N LYS 92.A O no hydrogen 2.971 N/A ASN 97.A N SER 93.A O no hydrogen 3.099 N/A THR 98.A N LYS 94.A O no hydrogen 2.849 N/A THR 98.A OG1 LYS 94.A O no hydrogen 2.732 N/A ILE 99.A N ARG 95.A O no hydrogen 2.913 N/A LEU 100.A N LEU 96.A O no hydrogen 2.931 N/A ASN 101.A N ASN 97.A O no hydrogen 2.992 N/A THR 102.A N THR 98.A O no hydrogen 2.902 N/A THR 102.A OG1 THR 98.A O no hydrogen 2.687 N/A MET 103.A N ILE 99.A O no hydrogen 2.808 N/A SER 104.A N LEU 100.A O no hydrogen 3.036 N/A THR 105.A N ASN 101.A O no hydrogen 2.890 N/A ILE 106.A N THR 102.A O no hydrogen 2.980 N/A TYR 107.A N MET 103.A O no hydrogen 2.945 N/A SER 108.A N SER 104.A O no hydrogen 2.998 N/A SER 108.A OG SER 104.A O no hydrogen 2.695 N/A SER 108.A OG THR 105.A O no hydrogen 3.299 N/A THR 109.A N THR 105.A O no hydrogen 2.863 N/A THR 109.A OG1 THR 105.A O no hydrogen 2.638 N/A VAL 112.A N LEU 122.A O no hydrogen 2.865 N/A CYS 113.A N GLU 151.A OE1 no hydrogen 2.846 N/A ASN 114.A N GLU 120.A O no hydrogen 3.001 N/A ASN 114.A ND2 GLU 120.A OE2 no hydrogen 2.766 N/A ASP 116.A N ASN 114.A OD1 no hydrogen 2.923 N/A ASN 117.A N ASN 114.A O no hydrogen 3.009 N/A GLN 119.A N ASN 117.A OD1 no hydrogen 3.228 N/A GLU 120.A N ASN 117.A O no hydrogen 3.039 N/A LEU 122.A N VAL 112.A O no hydrogen 2.818 N/A LEU 128.A N LEU 123.A O no hydrogen 2.951 N/A ASN 129.A N LEU 124.A O no hydrogen 2.870 N/A ALA 133.A N ASN 129.A O no hydrogen 2.828 N/A ASN 134.A N GLU 130.A O no hydrogen 2.849 N/A SER 135.A N ILE 131.A O no hydrogen 2.884 N/A SER 135.A OG GLU 140.A OE1 no hydrogen 2.668 N/A ASN 139.A N ASP 137.A OD1 no hydrogen 3.051 N/A ARG 141.A N ASP 137.A O no hydrogen 2.953 N/A ARG 141.A NE HIS 245.A O no hydrogen 2.927 N/A ARG 141.A NH1 SER 135.A O no hydrogen 2.861 N/A ARG 141.A NH2 HIS 245.A O no hydrogen 2.931 N/A LEU 142.A N TYR 138.A O no hydrogen 2.824 N/A TRP 143.A N ASN 139.A O no hydrogen 3.078 N/A ALA 144.A N GLU 140.A O no hydrogen 3.138 N/A TRP 145.A N ARG 141.A O no hydrogen 2.816 N/A GLU 146.A N LEU 142.A O no hydrogen 2.977 N/A SER 147.A N TRP 143.A O no hydrogen 2.942 N/A SER 147.A OG TRP 143.A O no hydrogen 2.648 N/A TRP 148.A N ALA 144.A O no hydrogen 2.972 N/A TRP 148.A NE1 SER 482.A O no hydrogen 2.874 N/A ARG 149.A NH1 MET 250.A O no hydrogen 2.926 N/A ARG 149.A NH2 TRP 145.A O no hydrogen 2.786 N/A ARG 149.A NH2 MET 250.A O no hydrogen 3.411 N/A SER 150.A N GLU 146.A O no hydrogen 2.861 N/A SER 150.A OG GLU 146.A O no hydrogen 2.777 N/A SER 150.A OG GLU 146.A OE1 no hydrogen 3.107 N/A SER 150.A OG GLU 146.A OE2 no hydrogen 3.446 N/A GLU 151.A N SER 147.A O no hydrogen 2.857 N/A VAL 152.A N TRP 148.A O no hydrogen 3.012 N/A GLY 153.A N TRP 148.A O no hydrogen 2.859 N/A LYS 154.A N ARG 149.A O no hydrogen 2.840 N/A LYS 154.A NZ THR 476.A OG1 no hydrogen 3.196 N/A GLN 155.A N VAL 152.A O no hydrogen 2.892 N/A LEU 156.A N GLY 153.A O no hydrogen 2.971 N/A ARG 157.A N GLY 153.A O no hydrogen 3.291 N/A ARG 157.A NE GLU 161.A OE2 no hydrogen 2.817 N/A ARG 157.A NH1 GLU 161.A OE2 no hydrogen 2.933 N/A ARG 157.A NH1 LYS 450.A O no hydrogen 2.782 N/A ARG 157.A NH1 GLU 475.A OE1 no hydrogen 3.179 N/A ARG 157.A NH2 GLU 475.A OE1 no hydrogen 2.926 N/A ARG 157.A NH2 TYR 477.A O no hydrogen 2.832 N/A TYR 160.A N LEU 156.A O no hydrogen 2.925 N/A GLU 161.A N ARG 157.A O no hydrogen 3.085 N/A GLU 162.A N LEU 159.A O no hydrogen 3.120 N/A TYR 163.A N LEU 159.A O no hydrogen 2.973 N/A TYR 163.A OH ASP 489.A OD1 no hydrogen 2.610 N/A VAL 164.A N TYR 160.A O no hydrogen 3.007 N/A LEU 166.A N GLU 162.A O no hydrogen 3.150 N/A LYS 167.A N TYR 163.A O no hydrogen 2.908 N/A LYS 167.A NZ TYR 179.A OH no hydrogen 3.336 N/A LYS 167.A NZ ASP 489.A OD2 no hydrogen 2.744 N/A ASN 168.A N VAL 164.A O no hydrogen 2.950 N/A ASN 168.A ND2 PHE 444.A O no hydrogen 2.900 N/A GLU 169.A N VAL 165.A O no hydrogen 2.912 N/A MET 170.A N LEU 166.A O no hydrogen 3.102 N/A ALA 171.A N LYS 167.A O no hydrogen 2.844 N/A ARG 172.A N ASN 168.A O no hydrogen 2.924 N/A ALA 173.A N GLU 169.A O no hydrogen 2.933 N/A ASN 174.A N MET 170.A O no hydrogen 3.036 N/A ASN 174.A ND2 GLY 84.A O no hydrogen 2.644 N/A ASN 174.A ND2 MET 170.A O no hydrogen 2.841 N/A HIS 175.A N ARG 172.A O no hydrogen 2.447 N/A TYR 176.A N ALA 171.A O no hydrogen 2.909 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.828 N/A TYR 179.A N ASN 168.A OD1 no hydrogen 2.941 N/A TYR 179.A OH ASP 489.A OD1 no hydrogen 2.661 N/A ASP 181.A N ASP 178.A O no hydrogen 2.965 N/A ASP 181.A N ASP 178.A OD2 no hydrogen 3.053 N/A ARG 184.A N GLY 180.A O no hydrogen 2.923 N/A ARG 184.A NE ASP 181.A OD1 no hydrogen 2.854 N/A ARG 184.A NH2 ASP 178.A OD2 no hydrogen 2.605 N/A ARG 184.A NH2 ASP 181.A OD1 no hydrogen 2.847 N/A GLY 185.A N ASP 181.A O no hydrogen 2.631 N/A ASP 186.A N TRP 183.A O no hydrogen 3.168 N/A TYR 187.A N ARG 184.A O no hydrogen 3.011 N/A TYR 187.A OH THR 497.A OG1 no hydrogen 2.728 N/A GLU 188.A N GLY 185.A O no hydrogen 3.262 N/A VAL 189.A N TYR 197.A O no hydrogen 3.027 N/A ASN 190.A ND2 GLU 188.A OE1 no hydrogen 2.783 N/A GLY 191.A N ASP 196.A OD2 no hydrogen 2.932 N/A VAL 192.A N ASP 196.A OD1 no hydrogen 3.011 N/A TYR 195.A OH GLU 551.A OE1 no hydrogen 2.621 N/A TYR 197.A N VAL 189.A O no hydrogen 2.867 N/A TYR 197.A OH ASP 205.A OD2 no hydrogen 2.645 N/A SER 198.A N GLN 201.A OE1 no hydrogen 3.132 N/A ARG 199.A NE ASP 181.A OD2 no hydrogen 2.676 N/A ARG 199.A NH1 GLU 188.A OE2 no hydrogen 2.727 N/A ARG 199.A NH2 ASP 181.A OD2 no hydrogen 3.471 N/A GLY 200.A N SER 198.A OG no hydrogen 3.251 N/A GLN 201.A N SER 198.A O no hydrogen 3.061 N/A ILE 203.A N GLY 200.A O no hydrogen 2.893 N/A GLU 204.A N GLY 200.A O no hydrogen 3.454 N/A ASP 205.A N GLN 201.A O no hydrogen 2.945 N/A VAL 206.A N LEU 202.A O no hydrogen 2.909 N/A GLU 207.A N ILE 203.A O no hydrogen 3.076 N/A HIS 208.A N GLU 204.A O no hydrogen 2.956 N/A THR 209.A N ASP 205.A O no hydrogen 3.104 N/A THR 209.A OG1 ASP 205.A O no hydrogen 2.707 N/A THR 209.A OG1 VAL 206.A O no hydrogen 3.134 N/A THR 209.A OG1 TYR 496.A OH no hydrogen 2.798 N/A PHE 210.A N VAL 206.A O no hydrogen 2.916 N/A GLU 212.A N THR 209.A O no hydrogen 3.018 N/A ILE 213.A N PHE 210.A O no hydrogen 2.901 N/A LYS 214.A N PHE 210.A O no hydrogen 3.372 N/A TYR 217.A N ILE 213.A O no hydrogen 2.927 N/A TYR 217.A OH VAL 465.A O no hydrogen 2.671 N/A GLU 218.A N LYS 214.A O no hydrogen 2.866 N/A HIS 219.A N LEU 216.A O no hydrogen 3.253 N/A LEU 220.A N LEU 216.A O no hydrogen 2.924 N/A HIS 221.A N TYR 217.A O no hydrogen 2.758 N/A HIS 221.A NE2 GLY 466.A O no hydrogen 2.791 N/A ALA 222.A N GLU 218.A O no hydrogen 3.209 N/A TYR 223.A N HIS 219.A O no hydrogen 2.875 N/A TYR 223.A OH THR 262.A O no hydrogen 2.728 N/A VAL 224.A N LEU 220.A O no hydrogen 2.876 N/A ARG 225.A N HIS 221.A O no hydrogen 2.809 N/A ARG 225.A NE PRO 238.A O no hydrogen 3.012 N/A ARG 225.A NH1 PRO 238.A O no hydrogen 2.912 N/A ARG 225.A NH1 GLY 585.A O no hydrogen 2.877 N/A ARG 225.A NH2 GLY 240.A O no hydrogen 2.786 N/A ARG 225.A NH2 GLY 585.A O no hydrogen 2.778 N/A ALA 226.A N ALA 222.A O no hydrogen 2.955 N/A LYS 227.A N TYR 223.A O no hydrogen 2.945 N/A LYS 227.A NZ VAL 263.A O no hydrogen 2.889 N/A LEU 228.A N VAL 224.A O no hydrogen 2.809 N/A MET 229.A N ARG 225.A O no hydrogen 3.011 N/A ASN 230.A N LYS 227.A O no hydrogen 3.008 N/A ALA 231.A N LEU 228.A O no hydrogen 2.913 N/A TYR 232.A N LEU 228.A O no hydrogen 2.696 N/A TYR 232.A OH LEU 136.A O no hydrogen 2.988 N/A ILE 236.A N TYR 232.A O no hydrogen 3.277 N/A ILE 239.A N SER 237.A OG no hydrogen 3.142 N/A CYS 241.A N SER 587.A O no hydrogen 3.233 N/A CYS 241.A SG ARG 462.A O no hydrogen 3.708 N/A CYS 241.A SG SER 587.A O no hydrogen 3.197 N/A LEU 242.A N GLY 466.A O no hydrogen 2.824 N/A ALA 244.A N VAL 468.A O no hydrogen 3.113 N/A LEU 246.A N PRO 243.A O no hydrogen 2.959 N/A LEU 247.A N ALA 244.A O no hydrogen 3.341 N/A TRP 251.A N ASP 249.A OD1 no hydrogen 2.816 N/A TRP 251.A NE1 SER 482.A O no hydrogen 2.882 N/A GLY 252.A N ASP 249.A OD1 no hydrogen 2.790 N/A TRP 255.A N LEU 424.A O no hydrogen 3.010 N/A THR 256.A OG1 THR 425.A OG1 no hydrogen 2.821 N/A LEU 258.A N TRP 255.A O no hydrogen 2.851 N/A TYR 259.A OH ASN 417.A O no hydrogen 2.799 N/A LEU 261.A N LEU 258.A O no hydrogen 3.057 N/A THR 262.A N LEU 258.A O no hydrogen 2.922 N/A THR 262.A N TYR 259.A O no hydrogen 3.149 N/A THR 262.A OG1 LEU 258.A O no hydrogen 2.768 N/A PHE 265.A N ASN 417.A OD1 no hydrogen 2.800 N/A GLN 267.A N GLN 267.A OE1 no hydrogen 2.850 N/A LYS 268.A N PHE 265.A O no hydrogen 2.977 N/A LYS 268.A NZ GLU 413.A OE1 no hydrogen 2.797 N/A ASN 270.A ND2 TYR 259.A OH no hydrogen 2.955 N/A THR 274.A N ASP 272.A OD1 no hydrogen 2.901 N/A THR 274.A OG1 ASP 272.A OD1 no hydrogen 2.620 N/A ALA 276.A N ASP 275.A OD1 no hydrogen 2.891 N/A MET 277.A N VAL 273.A O no hydrogen 3.209 N/A VAL 278.A N THR 274.A O no hydrogen 3.252 N/A ASP 279.A N ASP 275.A O no hydrogen 2.816 N/A GLN 280.A N ALA 276.A O no hydrogen 3.414 N/A GLN 280.A NE2 GLY 402.A O no hydrogen 3.492 N/A ALA 281.A N VAL 278.A O no hydrogen 3.017 N/A TRP 282.A N MET 277.A O no hydrogen 2.956 N/A ARG 286.A N ASP 283.A OD1 no hydrogen 2.882 N/A ARG 286.A NE GLU 290.A OE2 no hydrogen 2.793 N/A ARG 286.A NH1 GLU 290.A OE2 no hydrogen 2.820 N/A ILE 287.A N ASP 283.A O no hydrogen 3.467 N/A LYS 289.A N GLN 285.A O no hydrogen 2.919 N/A LYS 289.A NZ GLU 292.A OE1 no hydrogen 2.847 N/A GLU 290.A N ARG 286.A O no hydrogen 2.903 N/A ALA 291.A N ILE 287.A O no hydrogen 3.184 N/A GLU 292.A N PHE 288.A O no hydrogen 2.865 N/A LYS 293.A N LYS 289.A O no hydrogen 3.084 N/A LYS 293.A NZ GLU 290.A OE1 no hydrogen 2.793 N/A PHE 294.A N GLU 290.A O no hydrogen 3.052 N/A PHE 295.A N ALA 291.A O no hydrogen 3.129 N/A VAL 296.A N GLU 292.A O no hydrogen 3.166 N/A SER 297.A N LYS 293.A O no hydrogen 3.088 N/A SER 297.A OG ASN 526.A OD1 no hydrogen 2.841 N/A VAL 298.A N PHE 294.A O no hydrogen 3.113 N/A GLY 299.A N PHE 295.A O no hydrogen 2.976 N/A LEU 300.A N PHE 295.A O no hydrogen 2.896 N/A ASN 302.A N ASN 302.A OD1 no hydrogen 2.471 N/A MET 303.A N GLU 292.A OE2 no hydrogen 2.726 N/A GLY 306.A N THR 304.A O no hydrogen 2.777 N/A TRP 308.A N GLN 305.A O no hydrogen 3.186 N/A GLU 309.A N GLY 306.A O no hydrogen 3.101 N/A ASN 310.A N GLY 306.A O no hydrogen 2.780 N/A SER 311.A N PHE 307.A O no hydrogen 3.003 N/A SER 311.A OG ILE 338.A O no hydrogen 2.740 N/A MET 312.A N ILE 338.A O no hydrogen 2.861 N/A ASP 315.A N ASP 315.A OD1 no hydrogen 2.260 N/A LYS 321.A N GLN 320.A OE1 no hydrogen 2.859 N/A VAL 323.A N ASN 31.A O no hydrogen 3.053 N/A THR 327.A N LEU 339.A O no hydrogen 2.847 N/A THR 327.A OG1 HIS 325.A O no hydrogen 2.745 N/A TRP 329.A N ARG 337.A O no hydrogen 2.744 N/A LEU 331.A N ASP 335.A O no hydrogen 3.066 N/A GLY 332.A N ASP 330.A OD1 no hydrogen 3.096 N/A LYS 333.A NZ ASP 18.A OD2 no hydrogen 2.733 N/A ASP 335.A N GLY 332.A O no hydrogen 2.818 N/A ARG 337.A N TRP 329.A O no hydrogen 2.958 N/A ARG 337.A NE ASP 335.A OD1 no hydrogen 2.737 N/A ARG 337.A NH1 ASP 335.A OD2 no hydrogen 2.786 N/A ARG 337.A NH2 ASN 310.A O no hydrogen 3.493 N/A ILE 338.A N SER 311.A OG no hydrogen 2.799 N/A LEU 339.A N THR 327.A O no hydrogen 2.917 N/A MET 340.A N MET 312.A O no hydrogen 2.882 N/A THR 342.A N LEU 313.A O no hydrogen 2.916 N/A THR 342.A OG1 ASP 348.A OD2 no hydrogen 2.614 N/A LYS 343.A N ASP 348.A OD2 no hydrogen 2.892 N/A THR 345.A OG1 LYS 343.A O no hydrogen 3.004 N/A MET 346.A N THR 274.A OG1 no hydrogen 2.911 N/A PHE 349.A N THR 345.A O no hydrogen 2.984 N/A LEU 350.A N MET 346.A O no hydrogen 2.945 N/A THR 351.A N ASP 347.A O no hydrogen 2.848 N/A ALA 352.A N ASP 348.A O no hydrogen 2.871 N/A HIS 353.A N PHE 349.A O no hydrogen 3.120 N/A HIS 353.A ND1 PHE 349.A O no hydrogen 2.769 N/A HIS 354.A N LEU 350.A O no hydrogen 2.961 N/A HIS 354.A NE2 GLU 382.A OE1 no hydrogen 2.827 N/A GLU 355.A N THR 351.A O no hydrogen 2.945 N/A MET 356.A N ALA 352.A O no hydrogen 2.985 N/A GLY 357.A N HIS 353.A O no hydrogen 3.133 N/A HIS 358.A N GLU 355.A O no hydrogen 3.017 N/A HIS 358.A ND1 GLU 355.A OE1 no hydrogen 2.849 N/A ILE 359.A N GLU 355.A O no hydrogen 3.181 N/A GLN 360.A N MET 356.A O no hydrogen 2.894 N/A GLN 360.A NE2 PRO 301.A O no hydrogen 2.879 N/A TYR 361.A N GLY 357.A O no hydrogen 3.023 N/A ASP 362.A N HIS 358.A O no hydrogen 2.994 N/A MET 363.A N ILE 359.A O no hydrogen 3.053 N/A ALA 364.A N GLN 360.A O no hydrogen 3.253 N/A ALA 364.A N TYR 361.A O no hydrogen 3.175 N/A GLN 368.A N TYR 365.A O no hydrogen 2.946 N/A GLN 368.A NE2 ARG 539.A O no hydrogen 2.775 N/A LEU 372.A N PRO 369.A O no hydrogen 2.864 N/A ARG 373.A NE GLN 368.A O no hydrogen 2.788 N/A ARG 373.A NH1 GLU 17.A OE1 no hydrogen 2.806 N/A ARG 373.A NH1 GLU 17.A OE2 no hydrogen 3.229 N/A ARG 373.A NH2 GLU 17.A OE2 no hydrogen 2.779 N/A ARG 373.A NH2 GLN 368.A O no hydrogen 3.479 N/A ASN 374.A N LEU 372.A O no hydrogen 3.004 N/A GLU 378.A N ASP 186.A OD2 no hydrogen 2.976 N/A GLY 379.A N ASN 377.A OD1 no hydrogen 3.114 N/A PHE 380.A N ASN 377.A OD1 no hydrogen 3.010 N/A VAL 384.A N PHE 380.A O no hydrogen 3.048 N/A GLY 385.A N GLU 382.A O no hydrogen 2.997 N/A GLU 386.A N GLU 382.A O no hydrogen 2.943 N/A MET 388.A N GLY 385.A O no hydrogen 2.997 N/A LEU 390.A N GLU 386.A O no hydrogen 2.852 N/A SER 391.A N ILE 387.A O no hydrogen 3.162 N/A SER 391.A OG ASP 523.A OD1 no hydrogen 3.027 N/A ALA 392.A N MET 388.A O no hydrogen 2.929 N/A ALA 393.A N SER 389.A O no hydrogen 3.038 N/A THR 394.A N SER 391.A O no hydrogen 3.064 N/A THR 394.A OG1 SER 391.A O no hydrogen 2.787 N/A LYS 396.A NZ GLU 516.A OE2 no hydrogen 2.789 N/A HIS 397.A N THR 394.A OG1 no hydrogen 3.109 N/A LEU 398.A N THR 394.A O no hydrogen 2.955 N/A LYS 399.A N PRO 395.A O no hydrogen 2.903 N/A LYS 399.A NZ GLU 410.A OE2 no hydrogen 2.646 N/A SER 400.A N LYS 396.A O no hydrogen 2.993 N/A SER 400.A OG LYS 396.A O no hydrogen 3.430 N/A SER 400.A OG HIS 397.A O no hydrogen 2.721 N/A ILE 401.A N HIS 397.A O no hydrogen 2.853 N/A GLY 402.A N LYS 399.A O no hydrogen 3.114 N/A LEU 404.A N LEU 398.A O no hydrogen 2.855 N/A PHE 408.A N SER 405.A O no hydrogen 2.960 N/A GLU 410.A N GLU 410.A OE1 no hydrogen 2.719 N/A ASP 411.A N ASP 411.A OD1 no hydrogen 2.391 N/A THR 414.A OG1 ASP 411.A OD1 no hydrogen 3.210 N/A ASN 417.A ND2 PHE 265.A O no hydrogen 2.874 N/A PHE 418.A N THR 414.A O no hydrogen 2.958 N/A LEU 419.A N GLU 415.A O no hydrogen 2.914 N/A LEU 420.A N ILE 416.A O no hydrogen 2.984 N/A LYS 421.A N ASN 417.A O no hydrogen 3.437 N/A GLN 422.A N PHE 418.A O no hydrogen 2.969 N/A GLN 422.A NE2 TYR 567.A OH no hydrogen 2.915 N/A ALA 423.A N LEU 419.A O no hydrogen 2.806 N/A LEU 424.A N LEU 420.A O no hydrogen 3.128 N/A THR 425.A N GLN 422.A O no hydrogen 2.971 N/A THR 425.A OG1 THR 256.A OG1 no hydrogen 2.821 N/A THR 425.A OG1 LYS 421.A O no hydrogen 2.927 N/A ILE 426.A N GLN 422.A O no hydrogen 2.761 N/A VAL 427.A N ALA 423.A O no hydrogen 2.874 N/A GLY 428.A N ALA 423.A O no hydrogen 3.001 N/A THR 429.A OG1 ARG 253.A O no hydrogen 2.695 N/A LEU 430.A N VAL 427.A O no hydrogen 3.015 N/A THR 433.A N THR 429.A O no hydrogen 2.911 N/A THR 433.A OG1 THR 429.A O no hydrogen 2.807 N/A TYR 434.A N LEU 430.A O no hydrogen 2.873 N/A TYR 434.A OH GLU 207.A OE1 no hydrogen 2.642 N/A MET 435.A N PRO 431.A O no hydrogen 2.838 N/A LEU 436.A N PHE 432.A O no hydrogen 2.966 N/A LYS 438.A N TYR 434.A O no hydrogen 2.796 N/A LYS 438.A NZ TYR 434.A OH no hydrogen 3.488 N/A TRP 439.A N MET 435.A O no hydrogen 2.880 N/A TRP 439.A NE1 TRP 453.A O no hydrogen 2.906 N/A ARG 440.A N LEU 436.A O no hydrogen 2.849 N/A ARG 440.A NE GLU 437.A OE1 no hydrogen 2.603 N/A ARG 440.A NH1 HIS 485.A O no hydrogen 2.866 N/A ARG 440.A NH2 GLU 437.A OE1 no hydrogen 2.962 N/A ARG 440.A NH2 HIS 485.A O no hydrogen 3.524 N/A ARG 440.A NH2 TYR 490.A O no hydrogen 2.621 N/A TRP 441.A N GLU 437.A O no hydrogen 2.804 N/A TRP 441.A NE1 GLU 437.A OE2 no hydrogen 2.801 N/A MET 442.A N LYS 438.A O no hydrogen 3.122 N/A VAL 443.A N TRP 439.A O no hydrogen 2.824 N/A PHE 444.A N ARG 440.A O no hydrogen 2.824 N/A GLY 446.A N VAL 443.A O no hydrogen 2.942 N/A ILE 448.A N MET 442.A O no hydrogen 3.004 N/A LYS 450.A NZ GLU 161.A O no hydrogen 3.256 N/A GLN 452.A N PRO 449.A O no hydrogen 2.836 N/A MET 454.A N GLU 475.A OE1 no hydrogen 2.861 N/A LYS 455.A N GLU 475.A OE2 no hydrogen 2.926 N/A LYS 455.A NZ GLN 452.A OE1 no hydrogen 2.917 N/A LYS 455.A NZ GLU 459.A OE2 no hydrogen 2.825 N/A LYS 456.A N GLN 452.A O no hydrogen 2.843 N/A LYS 456.A NZ GLU 459.A OE1 no hydrogen 2.769 N/A TRP 457.A N TRP 453.A O no hydrogen 3.178 N/A TRP 458.A N MET 454.A O no hydrogen 3.429 N/A TRP 458.A NE1 ASP 479.A OD2 no hydrogen 2.817 N/A GLU 459.A N LYS 455.A O no hydrogen 3.379 N/A MET 460.A N LYS 456.A O no hydrogen 2.949 N/A LYS 461.A N TRP 457.A O no hydrogen 2.874 N/A ARG 462.A NH2 SER 591.A OG no hydrogen 2.830 N/A GLU 463.A N GLU 459.A O no hydrogen 2.893 N/A ILE 464.A N MET 460.A O no hydrogen 2.902 N/A VAL 465.A N LYS 461.A O no hydrogen 3.233 N/A VAL 467.A N LYS 461.A O no hydrogen 2.954 N/A VAL 468.A N LEU 242.A O no hydrogen 2.917 N/A GLU 469.A N GLU 469.A OE1 no hydrogen 2.846 N/A THR 476.A N ASP 474.A OD1 no hydrogen 3.090 N/A THR 476.A OG1 ASP 474.A OD1 no hydrogen 2.595 N/A TYR 477.A N ASP 474.A O no hydrogen 2.953 N/A TYR 477.A OH GLU 146.A OE2 no hydrogen 2.756 N/A SER 482.A N CYS 478.A O no hydrogen 3.214 N/A SER 482.A N ASP 479.A O no hydrogen 3.206 N/A SER 482.A OG ASP 479.A O no hydrogen 2.627 N/A LEU 483.A N PRO 480.A O no hydrogen 3.146 N/A VAL 486.A N LEU 483.A O no hydrogen 3.247 N/A SER 487.A N LEU 483.A O no hydrogen 2.996 N/A SER 487.A OG LEU 483.A O no hydrogen 2.788 N/A ASN 488.A N PHE 484.A O no hydrogen 2.896 N/A ASN 488.A ND2 SER 104.A OG no hydrogen 2.977 N/A ASP 489.A N VAL 486.A O no hydrogen 3.351 N/A TYR 490.A N HIS 485.A O no hydrogen 2.988 N/A SER 491.A OG GLU 378.A OE1 no hydrogen 3.038 N/A SER 491.A OG GLU 378.A OE2 no hydrogen 2.808 N/A ARG 494.A NE GLU 378.A OE1 no hydrogen 2.774 N/A ARG 494.A NH2 GLU 378.A OE1 no hydrogen 2.785 N/A TYR 495.A N PHE 492.A O no hydrogen 3.207 N/A TYR 496.A OH THR 209.A OG1 no hydrogen 2.798 N/A THR 497.A N ILE 493.A O no hydrogen 3.363 N/A THR 497.A OG1 TYR 187.A OH no hydrogen 2.728 N/A THR 497.A OG1 ARG 494.A O no hydrogen 3.313 N/A ARG 498.A N ARG 494.A O no hydrogen 2.873 N/A ARG 498.A NH2 GLU 386.A OE1 no hydrogen 2.997 N/A THR 499.A N TYR 495.A O no hydrogen 2.956 N/A THR 499.A OG1 TYR 495.A O no hydrogen 2.605 N/A LEU 500.A N TYR 496.A O no hydrogen 3.238 N/A LEU 500.A N THR 497.A O no hydrogen 3.113 N/A TYR 501.A N THR 497.A O no hydrogen 2.967 N/A GLN 502.A N ARG 498.A O no hydrogen 2.956 N/A PHE 503.A N LEU 500.A O no hydrogen 3.147 N/A GLN 504.A N LEU 500.A O no hydrogen 3.214 N/A GLN 504.A NE2 ASN 558.A O no hydrogen 3.372 N/A PHE 505.A N TYR 501.A O no hydrogen 2.809 N/A GLN 506.A N GLN 502.A O no hydrogen 2.895 N/A GLU 507.A N PHE 503.A O no hydrogen 2.947 N/A ALA 508.A N GLN 504.A O no hydrogen 3.173 N/A LEU 509.A N PHE 505.A O no hydrogen 2.999 N/A CYS 510.A N GLN 506.A O no hydrogen 2.946 N/A CYS 510.A SG GLN 506.A O no hydrogen 3.005 N/A GLN 511.A N GLU 507.A O no hydrogen 3.051 N/A GLN 511.A NE2 GLU 507.A O no hydrogen 2.936 N/A ALA 512.A N ALA 508.A O no hydrogen 2.894 N/A ALA 513.A N LEU 509.A O no hydrogen 2.945 N/A LYS 514.A N GLN 511.A O no hydrogen 2.982 N/A HIS 515.A N CYS 510.A O no hydrogen 2.846 N/A HIS 515.A NE2 PRO 518.A O no hydrogen 2.846 N/A GLU 516.A N GLU 516.A OE1 no hydrogen 2.785 N/A HIS 520.A NE2 GLU 415.A OE2 no hydrogen 2.828 N/A LYS 521.A N PRO 518.A O no hydrogen 3.082 N/A CYS 522.A N LEU 519.A O no hydrogen 3.198 N/A ILE 524.A N SER 391.A OG no hydrogen 2.993 N/A SER 525.A N ASP 523.A OD1 no hydrogen 2.926 N/A SER 525.A OG HIS 397.A ND1 no hydrogen 3.342 N/A SER 525.A OG ASP 523.A OD1 no hydrogen 2.654 N/A SER 525.A OG ASP 523.A OD2 no hydrogen 3.221 N/A ASN 526.A N SER 297.A OG no hydrogen 2.854 N/A THR 528.A OG1 SER 527.A O no hydrogen 2.789 N/A ALA 530.A N SER 527.A OG no hydrogen 3.204 N/A GLN 532.A N THR 528.A O no hydrogen 2.858 N/A LYS 533.A N GLU 529.A O no hydrogen 2.859 N/A LYS 533.A NZ ASN 552.A O no hydrogen 2.999 N/A LEU 534.A N ALA 530.A O no hydrogen 2.943 N/A PHE 535.A N GLY 531.A O no hydrogen 2.834 N/A ASN 536.A N GLN 532.A O no hydrogen 3.008 N/A MET 537.A N LEU 534.A O no hydrogen 2.955 N/A LEU 538.A N LEU 534.A O no hydrogen 2.904 N/A ARG 539.A N PHE 535.A O no hydrogen 2.988 N/A LEU 540.A N MET 537.A O no hydrogen 3.253 N/A LYS 542.A N LEU 372.A O no hydrogen 2.902 N/A SER 543.A N LEU 540.A O no hydrogen 2.933 N/A SER 543.A OG LEU 540.A O no hydrogen 2.618 N/A TRP 546.A NE1 TYR 187.A O no hydrogen 2.937 N/A THR 547.A OG1 TYR 195.A O no hydrogen 2.710 N/A LEU 548.A N PRO 545.A O no hydrogen 2.902 N/A ALA 549.A N PRO 545.A O no hydrogen 2.968 N/A LEU 550.A N TRP 546.A O no hydrogen 2.925 N/A ASN 552.A N ALA 549.A O no hydrogen 3.162 N/A VAL 553.A N ALA 549.A O no hydrogen 3.428 N/A VAL 554.A N LEU 550.A O no hydrogen 2.781 N/A ARG 562.A N ASN 560.A OD1 no hydrogen 2.957 N/A LEU 565.A N VAL 561.A O no hydrogen 2.881 N/A ASN 566.A N ARG 562.A O no hydrogen 2.677 N/A TYR 567.A N PRO 563.A O no hydrogen 3.193 N/A TYR 567.A N LEU 564.A O no hydrogen 3.124 N/A PHE 568.A N LEU 565.A O no hydrogen 2.880 N/A GLU 569.A N LEU 565.A O no hydrogen 2.802 N/A LEU 571.A N PHE 568.A O no hydrogen 2.894 N/A PHE 572.A N PHE 568.A O no hydrogen 2.773 N/A THR 573.A N GLU 569.A O no hydrogen 2.981 N/A THR 573.A OG1 GLU 569.A O no hydrogen 2.736 N/A TRP 574.A N LEU 571.A O no hydrogen 2.943 N/A LEU 575.A N LEU 571.A O no hydrogen 2.810 N/A LYS 576.A N PHE 572.A O no hydrogen 3.084 N/A GLN 578.A N TRP 574.A O no hydrogen 2.902 N/A ASN 579.A N LYS 576.A O no hydrogen 3.012 N/A ASN 579.A ND2 GLN 578.A O no hydrogen 2.940 N/A LYS 580.A NZ ASP 577.A OD1 no hydrogen 2.758 N/A SER 582.A N ASN 579.A O no hydrogen 2.966 N/A GLY 585.A N GLU 218.A O no hydrogen 3.122 N/A TRP 586.A NE1 ARG 462.A O no hydrogen 2.828 N/A SER 587.A N ILE 239.A O no hydrogen 2.804 N/A THR 588.A OG1 ASP 589.A OD1 no hydrogen 2.777 N/A ASP 589.A N SER 587.A OG no hydrogen 3.097 N/A TYR 593.A OH GLU 469.A OE2 no hydrogen 2.596 N/A