Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4be9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N.A GLY 15.A O no hydrogen 2.958 N/A VAL 4.A N.B GLY 15.A O no hydrogen 2.952 N/A ASN 5.A ND2.A GLU 12.A OE2 no hydrogen 2.972 N/A ASN 5.A ND2.B GLU 12.A OE2 no hydrogen 3.026 N/A VAL 6.A N VAL 13.A O no hydrogen 2.956 N/A TYR 8.A N GLY 11.A O no hydrogen 2.947 N/A GLY 11.A N TYR 8.A O no hydrogen 3.084 N/A GLU 12.A N GLY 50.A O no hydrogen 2.830 N/A VAL 13.A N VAL 6.A O no hydrogen 3.039 N/A VAL 14.A N LYS 52.A O no hydrogen 2.876 N/A GLY 15.A N VAL 4.A O.A no hydrogen 2.763 N/A GLY 15.A N VAL 4.A O.B no hydrogen 2.713 N/A VAL 16.A N SER 23.A O no hydrogen 2.824 N/A SER 17.A N THR 2.A O no hydrogen 2.894 N/A VAL 18.A N ILE 21.A O no hydrogen 2.811 N/A ILE 21.A N VAL 18.A O no hydrogen 2.973 N/A GLU 22.A N ARG 104.A O no hydrogen 2.876 N/A SER 23.A N VAL 16.A O no hydrogen 2.781 N/A PHE 24.A N ILE 102.A O no hydrogen 2.804 N/A ARG 25.A N THR 54.A O no hydrogen 2.886 N/A ARG 25.A NH2 ASP 134.A OD2 no hydrogen 2.962 N/A GLY 26.A N ASN 101.A OD1 no hydrogen 2.981 N/A VAL 27.A N LEU 100.A O no hydrogen 2.941 N/A PHE 29.A N LEU 98.A O no hydrogen 2.962 N/A GLN 31.A N VAL 43.A O no hydrogen 2.837 N/A GLN 31.A NE2 ARG 44.A O no hydrogen 2.914 N/A VAL 34.A N PRO 32.A O no hydrogen 2.736 N/A LEU 37.A N VAL 34.A O no hydrogen 2.961 N/A ARG 38.A N GLY 35.A O no hydrogen 3.171 N/A ARG 38.A NE GLU 95.A OE2 no hydrogen 2.771 N/A ARG 38.A NH1 LEU 278.A O no hydrogen 2.992 N/A ARG 38.A NH1 VAL 281.A O no hydrogen 2.731 N/A ARG 38.A NH2 GLU 95.A OE1 no hydrogen 3.005 N/A ARG 38.A NH2 VAL 281.A O no hydrogen 3.398 N/A LYS 40.A N LEU 37.A O no hydrogen 3.304 N/A LYS 40.A NZ ASP 172.A OD1 no hydrogen 2.940 N/A LYS 40.A NZ ASP 172.A OD2 no hydrogen 2.819 N/A ARG 44.A NE GLU 10.A OE2 no hydrogen 3.295 N/A ARG 44.A NH1 ASP 191.A OD2 no hydrogen 3.097 N/A ARG 44.A NH2 GLU 10.A OE2 no hydrogen 2.503 N/A ARG 44.A NH2 ASP 191.A OD2 no hydrogen 2.984 N/A TYR 45.A OH ALA 30.A O no hydrogen 3.280 N/A ILE 49.A N GLU 10.A O no hydrogen 2.765 N/A GLY 50.A N ASN 48.A OD1 no hydrogen 2.942 N/A THR 51.A OG1 GLU 12.A OE1 no hydrogen 2.809 N/A LYS 52.A N GLU 12.A O no hydrogen 2.733 N/A THR 54.A N VAL 14.A O no hydrogen 2.801 N/A THR 54.A OG1 VAL 14.A O no hydrogen 2.621 N/A THR 55.A N ASP 53.A OD1 no hydrogen 2.935 N/A THR 55.A OG1 ASP 53.A OD1 no hydrogen 2.659 N/A SER 60.A N LEU 92.A O no hydrogen 3.008 N/A SER 60.A OG CYS 61.A O no hydrogen 3.409 N/A SER 60.A OG SER 93.A OG no hydrogen 3.036 N/A CYS 61.A SG CYS 97.A O no hydrogen 3.788 N/A GLN 63.A NE2 CYS 61.A O no hydrogen 2.840 N/A GLN 63.A NE2 GLY 128.A O no hydrogen 2.877 N/A MET 64.A N GLU 126.A O no hydrogen 2.954 N/A SER 67.A OG ASN 291.A O no hydrogen 3.272 N/A SER 67.A OG SER 292.A O no hydrogen 3.095 N/A SER 67.A OG VAL 293.A O no hydrogen 2.757 N/A THR 68.A N ASN 291.A O no hydrogen 2.791 N/A THR 68.A OG1 THR 288.A O no hydrogen 2.826 N/A GLY 69.A N SER 67.A OG no hydrogen 3.012 N/A ASN 70.A N SER 67.A OG no hydrogen 2.913 N/A ASN 70.A ND2 SER 292.A O no hydrogen 2.761 N/A GLN 76.A N GLU 72.A O no hydrogen 3.032 N/A GLN 76.A NE2 GLY 71.A O no hydrogen 2.916 N/A LEU 77.A N LEU 73.A O no hydrogen 2.854 N/A VAL 78.A N LEU 74.A O no hydrogen 2.932 N/A GLY 79.A N PHE 75.A O no hydrogen 2.692 N/A ASN 80.A N GLN 76.A O no hydrogen 2.809 N/A ASN 80.A ND2 THR 68.A O no hydrogen 3.124 N/A ASN 80.A ND2 GLN 76.A O no hydrogen 3.052 N/A LEU 81.A N LEU 77.A O no hydrogen 3.001 N/A ILE 82.A N VAL 78.A O no hydrogen 3.043 N/A ASN 83.A N ASN 80.A O no hydrogen 3.201 N/A ILE 84.A N LEU 81.A O no hydrogen 3.270 N/A PHE 87.A N.A ILE 84.A O no hydrogen 3.041 N/A PHE 87.A N.B ILE 84.A O no hydrogen 3.050 N/A GLN 88.A N ILE 84.A O no hydrogen 3.169 N/A GLN 88.A NE2 ILE 82.A O no hydrogen 2.924 N/A THR 89.A N PRO 85.A O no hydrogen 2.881 N/A THR 89.A OG1 PRO 85.A O no hydrogen 2.914 N/A ALA 90.A N LEU 86.A O no hydrogen 3.030 N/A THR 91.A N PHE 87.A O.A no hydrogen 3.070 N/A THR 91.A N PHE 87.A O.B no hydrogen 3.013 N/A THR 91.A OG1 PHE 87.A O.A no hydrogen 3.089 N/A THR 91.A OG1 PHE 87.A O.B no hydrogen 3.111 N/A THR 91.A OG1 GLN 88.A O no hydrogen 3.164 N/A LEU 92.A N THR 89.A O no hydrogen 3.069 N/A SER 93.A N GLN 88.A O no hydrogen 2.951 N/A SER 93.A OG SER 60.A OG no hydrogen 3.036 N/A SER 93.A OG CYS 61.A O no hydrogen 3.013 N/A SER 94.A N SER 60.A O no hydrogen 3.042 N/A ASP 96.A N SER 94.A OG no hydrogen 3.152 N/A CYS 97.A SG GLU 95.A O no hydrogen 3.474 N/A THR 99.A N CYS 97.A O no hydrogen 2.849 N/A LEU 100.A N VAL 27.A O no hydrogen 2.744 N/A ASN 101.A N ALA 153.A O no hydrogen 2.808 N/A ILE 102.A N PHE 24.A O no hydrogen 2.876 N/A GLN 103.A N PHE 151.A O no hydrogen 2.834 N/A GLN 103.A NE2 SER 23.A OG no hydrogen 2.877 N/A GLN 103.A NE2 ASP 134.A OD1 no hydrogen 2.965 N/A ARG 104.A N GLU 22.A O no hydrogen 2.951 N/A ARG 104.A NE GLU 22.A OE1 no hydrogen 2.749 N/A ARG 104.A NH1 PHE 196.A O no hydrogen 2.716 N/A ARG 104.A NH2 GLU 22.A OE1 no hydrogen 2.927 N/A ALA 106.A N GLY 20.A O no hydrogen 2.872 N/A GLY 107.A N GLU 22.A OE2 no hydrogen 2.975 N/A THR 108.A N PRO 105.A O no hydrogen 3.149 N/A THR 108.A OG1 PRO 105.A O no hydrogen 2.586 N/A THR 109.A N SER 112.A OG no hydrogen 2.919 N/A THR 109.A OG1 ASN 111.A OD1 no hydrogen 2.409 N/A ASN 111.A N THR 109.A OG1 no hydrogen 3.324 N/A SER 112.A N THR 109.A O no hydrogen 2.905 N/A SER 112.A OG THR 109.A O no hydrogen 3.036 N/A LEU 114.A N GLY 197.A O no hydrogen 2.809 N/A VAL 116.A N LYS 202.A O no hydrogen 2.829 N/A LEU 117.A N ILE 150.A O no hydrogen 2.882 N/A PHE 118.A N THR 204.A O no hydrogen 2.930 N/A TRP 119.A N VAL 152.A O no hydrogen 2.642 N/A ILE 120.A N TRP 206.A O no hydrogen 2.727 N/A GLU 126.A N GLY 123.A O no hydrogen 2.962 N/A LEU 127.A N GLY 123.A O no hydrogen 2.932 N/A GLY 128.A N GLN 63.A OE1 no hydrogen 2.687 N/A THR 129.A OG1 ASN 130.A OD1 no hydrogen 3.380 N/A THR 129.A OG1 ASN 155.A OD1 no hydrogen 2.848 N/A ASN 130.A N ASN 155.A OD1 no hydrogen 3.089 N/A ASN 130.A ND2 ALA 153.A O no hydrogen 2.828 N/A GLN 131.A N THR 129.A OG1 no hydrogen 3.090 N/A GLN 131.A NE2 GLY 58.A O no hydrogen 2.833 N/A GLN 131.A NE2 THR 91.A O no hydrogen 3.308 N/A TYR 133.A N ASN 130.A O no hydrogen 3.060 N/A ASP 134.A N TYR 463.A OH no hydrogen 3.049 N/A GLY 135.A N GLN 103.A OE1 no hydrogen 2.793 N/A ILE 136.A N ASP 134.A OD1 no hydrogen 2.861 N/A LEU 139.A N GLY 135.A O no hydrogen 2.815 N/A THR 140.A N ILE 136.A O no hydrogen 2.836 N/A THR 140.A OG1 ILE 136.A O no hydrogen 2.704 N/A GLU 141.A N ASP 137.A O no hydrogen 3.149 N/A GLY 142.A N LEU 138.A O no hydrogen 2.877 N/A ILE 143.A N LEU 139.A O no hydrogen 2.848 N/A SER 144.A N THR 140.A O no hydrogen 2.964 N/A SER 144.A OG GLU 141.A O no hydrogen 3.108 N/A LEU 145.A N GLU 141.A O no hydrogen 2.947 N/A LEU 145.A N GLY 142.A O no hydrogen 3.028 N/A GLY 146.A N ILE 143.A O no hydrogen 2.965 N/A GLU 147.A N GLY 142.A O no hydrogen 2.871 N/A ILE 150.A N PRO 115.A O no hydrogen 2.921 N/A PHE 151.A N GLN 103.A O no hydrogen 2.775 N/A VAL 152.A N LEU 117.A O no hydrogen 2.860 N/A ALA 153.A N ASN 101.A O no hydrogen 2.916 N/A ILE 154.A N TRP 119.A O no hydrogen 3.365 N/A ASN 155.A N THR 99.A O no hydrogen 3.140 N/A ASN 155.A ND2 PRO 59.A O no hydrogen 2.854 N/A ASN 155.A ND2 CYS 97.A O no hydrogen 3.232 N/A ASN 155.A ND2 THR 99.A OG1 no hydrogen 3.270 N/A TYR 156.A OH PHE 121.A O no hydrogen 2.695 N/A ARG 157.A N ASP 181.A OD2 no hydrogen 2.988 N/A ARG 157.A NE ASP 181.A OD1 no hydrogen 3.406 N/A ARG 157.A NE ASP 181.A OD2 no hydrogen 2.843 N/A ARG 157.A NH1 LYS 40.A O no hydrogen 3.046 N/A ARG 157.A NH2 LYS 40.A O no hydrogen 2.990 N/A ARG 157.A NH2 ASP 181.A OD1 no hydrogen 2.824 N/A GLY 159.A N PHE 125.A O no hydrogen 2.637 N/A PHE 161.A N VAL 158.A O no hydrogen 3.190 N/A GLY 162.A N GLY 159.A O no hydrogen 3.182 N/A PHE 163.A N GLY 159.A O no hydrogen 2.794 N/A GLY 166.A N VAL 250.A O no hydrogen 2.683 N/A LYS 167.A N GLN 256.A OE1 no hydrogen 2.800 N/A LYS 167.A NZ GLU 168.A OE2 no hydrogen 3.052 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.749 N/A LYS 170.A N GLY 166.A O no hydrogen 2.972 N/A ALA 171.A N LYS 167.A O no hydrogen 2.830 N/A ASP 172.A N GLU 168.A O no hydrogen 2.991 N/A GLY 173.A N LYS 170.A O no hydrogen 2.970 N/A SER 174.A N ILE 169.A O no hydrogen 3.028 N/A SER 174.A OG LEU 39.A O no hydrogen 3.201 N/A SER 174.A OG ASP 172.A OD2 no hydrogen 2.644 N/A ASN 176.A ND2 ARG 309.A O no hydrogen 2.689 N/A ASN 176.A ND2 ASP 311.A OD1 no hydrogen 2.899 N/A GLY 178.A N GLY 162.A O no hydrogen 2.919 N/A LEU 180.A N ASN 176.A O no hydrogen 3.137 N/A ASP 181.A N LEU 177.A O no hydrogen 2.878 N/A GLN 182.A N GLY 178.A O no hydrogen 3.221 N/A GLN 182.A NE2 SER 214.A OG no hydrogen 2.994 N/A ARG 183.A N LEU 179.A O no hydrogen 2.973 N/A ARG 183.A NE GLU 187.A OE2 no hydrogen 3.067 N/A ARG 183.A NH1 ASN 225.A O no hydrogen 3.168 N/A ARG 183.A NH2 ASN 225.A O no hydrogen 2.949 N/A ILE 184.A N LEU 180.A O no hydrogen 2.802 N/A ALA 185.A N ASP 181.A O no hydrogen 3.042 N/A LEU 186.A N GLN 182.A O no hydrogen 3.048 N/A GLU 187.A N ARG 183.A O no hydrogen 3.081 N/A TRP 188.A N ILE 184.A O no hydrogen 2.859 N/A VAL 189.A N ALA 185.A O no hydrogen 2.833 N/A ALA 190.A N LEU 186.A O no hydrogen 2.875 N/A ASP 191.A N GLU 187.A O no hydrogen 3.003 N/A ASN 192.A N TRP 188.A O no hydrogen 2.861 N/A ASN 192.A N VAL 189.A O no hydrogen 3.275 N/A ASN 192.A ND2 GLU 10.A OE2 no hydrogen 3.276 N/A ASN 192.A ND2 TRP 188.A O no hydrogen 3.015 N/A ILE 193.A N VAL 189.A O no hydrogen 2.918 N/A SER 195.A N ASN 192.A O no hydrogen 3.211 N/A PHE 196.A N ILE 193.A O no hydrogen 2.794 N/A GLY 197.A N ALA 194.A O no hydrogen 3.040 N/A GLY 198.A N ILE 193.A O no hydrogen 3.060 N/A ASP 199.A N LEU 114.A O no hydrogen 2.683 N/A SER 201.A N ASP 199.A OD1 no hydrogen 2.877 N/A SER 201.A OG ASP 199.A OD1 no hydrogen 2.705 N/A SER 201.A OG ASP 199.A OD2 no hydrogen 3.387 N/A LYS 202.A N ASP 199.A O no hydrogen 2.790 N/A THR 204.A N VAL 116.A O no hydrogen 2.908 N/A ILE 205.A N GLY 236.A O no hydrogen 2.963 N/A TRP 206.A N PHE 118.A O no hydrogen 2.849 N/A TRP 206.A NE1 ASN 240.A OD1 no hydrogen 2.970 N/A GLY 207.A N ILE 238.A O no hydrogen 3.241 N/A SER 209.A N ASN 240.A O no hydrogen 2.799 N/A SER 209.A OG HIS 454.A NE2 no hydrogen 2.589 N/A GLY 211.A N GLU 208.A O no hydrogen 2.955 N/A SER 212.A N SER 209.A O no hydrogen 2.858 N/A SER 212.A OG GLY 242.A O no hydrogen 2.566 N/A ILE 213.A N SER 209.A O no hydrogen 2.925 N/A SER 214.A N ALA 210.A O no hydrogen 2.905 N/A SER 214.A OG ALA 210.A O no hydrogen 2.726 N/A VAL 215.A N GLY 211.A O no hydrogen 2.933 N/A PHE 216.A N SER 212.A O no hydrogen 3.187 N/A ASP 217.A N ILE 213.A O no hydrogen 2.834 N/A GLN 218.A N SER 214.A O no hydrogen 2.775 N/A GLN 218.A NE2 LEU 179.A O no hydrogen 3.023 N/A GLN 218.A NE2 GLN 182.A OE1 no hydrogen 3.039 N/A MET 219.A N VAL 215.A O no hydrogen 3.142 N/A ALA 220.A N PHE 216.A O no hydrogen 2.866 N/A TYR 222.A N VAL 314.A O no hydrogen 2.866 N/A GLY 224.A N ALA 220.A O no hydrogen 3.121 N/A GLY 224.A N LEU 221.A O no hydrogen 2.934 N/A ASN 225.A N TYR 222.A O no hydrogen 3.220 N/A LYS 227.A N ASN 225.A OD1 no hydrogen 2.971 N/A TYR 228.A N LYS 231.A O no hydrogen 2.839 N/A TYR 228.A OH ASP 191.A OD2 no hydrogen 2.582 N/A LYS 229.A NZ ASP 191.A OD1 no hydrogen 2.932 N/A LYS 229.A NZ ASP 191.A OD2 no hydrogen 3.518 N/A LYS 229.A NZ TYR 228.A OH no hydrogen 3.470 N/A LYS 231.A N TYR 228.A O no hydrogen 3.114 N/A LEU 233.A N ASN 226.A O no hydrogen 2.796 N/A ARG 235.A N VAL 203.A O no hydrogen 2.668 N/A ARG 235.A NH2 VAL 482.A O no hydrogen 2.985 N/A ARG 235.A NH2 THR 483.A O no hydrogen 2.903 N/A GLY 237.A N PRO 332.A O no hydrogen 3.144 N/A ILE 238.A N ILE 205.A O no hydrogen 2.684 N/A MET 239.A N ILE 334.A O no hydrogen 2.757 N/A ASN 240.A N GLY 207.A O no hydrogen 2.988 N/A ASN 240.A ND2 TYR 439.A OH no hydrogen 3.069 N/A SER 241.A N GLY 336.A O no hydrogen 2.993 N/A SER 241.A OG GLU 341.A OE1 no hydrogen 3.317 N/A SER 241.A OG GLU 341.A OE2 no hydrogen 2.403 N/A ALA 247.A N SER 318.A OG no hydrogen 3.032 N/A ALA 248.A N ILE 538.A OXT no hydrogen 2.790 N/A VAL 250.A N PRO 310.A O no hydrogen 2.884 N/A GLY 252.A N PRO 249.A O no hydrogen 2.886 N/A LYS 254.A NZ LEU 365.A O no hydrogen 2.830 N/A LYS 254.A NZ TYR 366.A O no hydrogen 2.903 N/A LYS 254.A NZ ILE 538.A O no hydrogen 2.850 N/A GLN 256.A N GLY 252.A O no hydrogen 2.952 N/A GLN 256.A NE2 GLU 168.A OE1 no hydrogen 2.989 N/A GLN 256.A NE2 GLU 168.A OE2 no hydrogen 3.560 N/A GLN 256.A NE2 ASP 260.A OD1 no hydrogen 3.092 N/A ALA 257.A N VAL 253.A O no hydrogen 2.999 N/A ILE 258.A N LYS 254.A O no hydrogen 3.044 N/A TYR 259.A N ALA 255.A O no hydrogen 3.020 N/A TYR 259.A OH THR 274.A OG1 no hydrogen 2.621 N/A ASP 260.A N GLN 256.A O no hydrogen 2.837 N/A HIS 261.A N ALA 257.A O no hydrogen 3.003 N/A VAL 262.A N ILE 258.A O no hydrogen 2.989 N/A VAL 263.A N TYR 259.A O no hydrogen 2.869 N/A SER 264.A N ASP 260.A O no hydrogen 3.032 N/A SER 264.A OG ASP 260.A O no hydrogen 3.466 N/A SER 264.A OG HIS 261.A O no hydrogen 2.803 N/A GLU 265.A N HIS 261.A O no hydrogen 2.931 N/A ALA 266.A N VAL 262.A O no hydrogen 2.829 N/A GLY 267.A N SER 264.A O no hydrogen 3.270 N/A CYS 268.A N VAL 263.A O no hydrogen 2.926 N/A THR 271.A N CYS 268.A O no hydrogen 3.265 N/A THR 271.A OG1 CYS 268.A O no hydrogen 2.810 N/A THR 274.A OG1 TYR 259.A OH no hydrogen 2.621 N/A ALA 276.A N ASP 273.A OD1 no hydrogen 3.081 N/A CYS 277.A N ASP 273.A O no hydrogen 2.959 N/A LEU 278.A N THR 274.A O no hydrogen 2.854 N/A ARG 279.A N ALA 276.A O no hydrogen 3.189 N/A ARG 279.A NE ARG 38.A O no hydrogen 2.753 N/A ARG 279.A NH2 LEU 39.A O no hydrogen 2.855 N/A ARG 279.A NH2 ASP 172.A OD2 no hydrogen 2.763 N/A THR 280.A N CYS 277.A O no hydrogen 2.876 N/A THR 280.A OG1 CYS 277.A O no hydrogen 2.749 N/A VAL 281.A N LEU 278.A O no hydrogen 3.280 N/A TYR 283.A OH GLN 88.A OE1 no hydrogen 2.695 N/A THR 284.A N ASP 282.A OD2 no hydrogen 3.276 N/A PHE 286.A N ASP 282.A O no hydrogen 2.850 N/A LEU 287.A N TYR 283.A O no hydrogen 2.772 N/A THR 288.A N THR 284.A O no hydrogen 3.040 N/A THR 288.A OG1 THR 284.A O no hydrogen 2.799 N/A ALA 289.A N LYS 285.A O no hydrogen 2.931 N/A VAL 290.A N PHE 286.A O no hydrogen 2.848 N/A ASN 291.A N LEU 287.A O no hydrogen 2.962 N/A ASN 291.A ND2 GLN 63.A O no hydrogen 3.077 N/A SER 292.A N ALA 289.A O no hydrogen 3.070 N/A SER 292.A OG ALA 289.A O no hydrogen 2.652 N/A ILE 296.A N GLU 126.A OE1 no hydrogen 3.114 N/A SER 298.A N ILE 296.A O no hydrogen 2.998 N/A SER 298.A OG GLY 295.A O no hydrogen 2.612 N/A SER 300.A N.A SER 298.A OG no hydrogen 3.259 N/A SER 300.A N.B SER 298.A OG no hydrogen 3.251 N/A SER 300.A OG.B SER 298.A OG no hydrogen 2.915 N/A SER 301.A N SER 298.A O no hydrogen 2.891 N/A SER 301.A OG PHE 345.A O no hydrogen 2.733 N/A ALA 303.A N SER 300.A O.A no hydrogen 2.949 N/A ALA 303.A N SER 300.A O.B no hydrogen 2.851 N/A SER 305.A OG PRO 294.A O no hydrogen 2.737 N/A TYR 306.A OH VAL 290.A O no hydrogen 2.644 N/A ARG 309.A N ASN 176.A OD1 no hydrogen 3.069 N/A ARG 309.A NH1 ALA 248.A O no hydrogen 2.930 N/A ARG 309.A NH1 ILE 538.A OXT no hydrogen 3.004 N/A ARG 309.A NH2 ILE 538.A O no hydrogen 3.009 N/A ASP 311.A N LEU 315.A O no hydrogen 2.869 N/A GLY 312.A N LEU 315.A O no hydrogen 3.051 N/A VAL 313.A N ASP 311.A OD2 no hydrogen 2.844 N/A VAL 314.A N ASP 311.A OD2 no hydrogen 2.778 N/A LEU 315.A N ASP 311.A OD1 no hydrogen 2.813 N/A SER 318.A N ASP 317.A OD1 no hydrogen 2.644 N/A SER 318.A OG ALA 247.A O no hydrogen 3.501 N/A SER 318.A OG GLU 320.A OE1 no hydrogen 2.538 N/A SER 318.A OG GLU 320.A OE2 no hydrogen 3.384 N/A GLU 320.A N GLU 320.A OE1 no hydrogen 2.680 N/A ILE 322.A N SER 318.A O no hydrogen 3.148 N/A VAL 323.A N PRO 319.A O no hydrogen 3.124 N/A LYS 324.A N GLU 320.A O no hydrogen 3.101 N/A ASN 325.A N GLU 321.A O no hydrogen 2.882 N/A LYS 326.A N VAL 323.A O no hydrogen 2.857 N/A GLN 327.A N ILE 322.A O no hydrogen 2.915 N/A ALA 329.A N MET 219.A O no hydrogen 2.683 N/A MET 333.A N PRO 435.A O no hydrogen 3.160 N/A ILE 334.A N GLY 237.A O no hydrogen 2.980 N/A ILE 335.A N TRP 437.A O no hydrogen 2.899 N/A GLY 336.A N MET 239.A O no hydrogen 2.860 N/A ASP 337.A N TYR 439.A O no hydrogen 3.048 N/A GLN 338.A N GLU 341.A OE2 no hydrogen 2.786 N/A GLN 338.A NE2 TYR 443.A OH no hydrogen 2.878 N/A GLN 338.A NE2 THR 456.A OG1 no hydrogen 2.746 N/A GLU 339.A N ALA 441.A O no hydrogen 2.683 N/A ASP 340.A N THR 452.A O no hydrogen 2.909 N/A THR 343.A OG1 ASP 340.A O no hydrogen 3.301 N/A THR 343.A OG1 LEU 450.A O no hydrogen 2.775 N/A PHE 345.A N GLY 342.A O no hydrogen 3.042 N/A ALA 346.A N THR 343.A O no hydrogen 3.240 N/A ASN 350.A N LEU 348.A O no hydrogen 2.792 N/A ASN 350.A ND2 VAL 347.A O no hydrogen 3.048 N/A ILE 352.A N PRO 349.A O no hydrogen 3.178 N/A LYS 357.A N SER 354.A OG no hydrogen 2.995 N/A ILE 358.A N SER 354.A O no hydrogen 2.806 N/A VAL 359.A N THR 355.A O no hydrogen 3.044 N/A GLN 360.A N ALA 356.A O no hydrogen 3.051 N/A TYR 361.A N LYS 357.A O no hydrogen 2.979 N/A TYR 361.A OH TYR 299.A O no hydrogen 2.684 N/A TYR 361.A OH TYR 366.A OH no hydrogen 2.839 N/A PHE 362.A N ILE 358.A O no hydrogen 2.879 N/A GLN 363.A N VAL 359.A O no hydrogen 2.785 N/A ASP 364.A N.A GLN 360.A O no hydrogen 2.803 N/A ASP 364.A N.B GLN 360.A O no hydrogen 2.807 N/A LEU 365.A N TYR 361.A O no hydrogen 2.991 N/A TYR 366.A N PHE 362.A O no hydrogen 2.841 N/A TYR 366.A OH TYR 361.A OH no hydrogen 2.839 N/A PHE 367.A N PHE 362.A O no hydrogen 2.916 N/A THR 371.A N GLN 374.A OE1 no hydrogen 2.981 N/A GLN 374.A N THR 371.A OG1 no hydrogen 2.916 N/A LEU 375.A N THR 371.A O no hydrogen 2.990 N/A THR 376.A N LYS 372.A O no hydrogen 2.854 N/A THR 376.A OG1 LYS 372.A O no hydrogen 2.751 N/A ALA 377.A N GLU 373.A O no hydrogen 3.033 N/A PHE 378.A N GLN 374.A O no hydrogen 2.955 N/A VAL 379.A N LEU 375.A O no hydrogen 2.940 N/A ASN 380.A N THR 376.A O no hydrogen 2.835 N/A THR 381.A N PHE 378.A O no hydrogen 2.983 N/A THR 381.A OG1 PHE 378.A O no hydrogen 2.663 N/A THR 381.A OG1 SER 525.A OG no hydrogen 2.667 N/A TYR 382.A N VAL 379.A O no hydrogen 2.822 N/A TYR 382.A OH ASP 413.A OD2 no hydrogen 2.572 N/A THR 387.A N ASP 385.A OD2 no hydrogen 2.901 N/A THR 387.A OG1 ASP 385.A OD2 no hydrogen 2.196 N/A ALA 388.A N ASP 385.A O no hydrogen 2.986 N/A SER 390.A N LYS 405.A O no hydrogen 2.796 N/A SER 390.A OG ASP 340.A OD1 no hydrogen 2.814 N/A PHE 392.A N ASP 340.A OD1 no hydrogen 2.794 N/A THR 394.A OG1 PRO 391.A O no hydrogen 2.683 N/A PHE 397.A N THR 394.A O no hydrogen 3.116 N/A ASN 398.A ND2 THR 394.A OG1 no hydrogen 2.948 N/A TYR 401.A OH ALA 346.A O no hydrogen 2.605 N/A GLY 403.A N GLU 399.A OE2 no hydrogen 2.938 N/A PHE 404.A N TYR 401.A O no hydrogen 2.986 N/A LYS 405.A N GLU 399.A OE1 no hydrogen 2.918 N/A LYS 405.A NZ ILE 386.A O no hydrogen 2.920 N/A LYS 405.A NZ PHE 397.A O no hydrogen 2.936 N/A ARG 406.A NE TYR 382.A O no hydrogen 3.017 N/A ARG 406.A NH1 THR 355.A OG1 no hydrogen 2.868 N/A ARG 406.A NH2 THR 355.A OG1 no hydrogen 3.193 N/A ARG 406.A NH2 TYR 382.A O no hydrogen 2.844 N/A LEU 407.A N GLY 403.A O no hydrogen 2.859 N/A ALA 408.A N PHE 404.A O no hydrogen 2.744 N/A ALA 409.A N LYS 405.A O no hydrogen 2.912 N/A ILE 410.A N ARG 406.A O no hydrogen 2.965 N/A LEU 411.A N LEU 407.A O no hydrogen 2.857 N/A GLY 412.A N ALA 408.A O no hydrogen 2.981 N/A ASP 413.A N ALA 409.A O no hydrogen 2.976 N/A MET 414.A N ILE 410.A O no hydrogen 2.989 N/A THR 415.A OG1 LEU 411.A O no hydrogen 2.970 N/A PHE 416.A N GLY 412.A O no hydrogen 3.005 N/A THR 417.A N GLY 412.A O no hydrogen 2.943 N/A LEU 418.A N ASP 413.A O no hydrogen 2.908 N/A ALA 419.A N ASP 413.A O no hydrogen 3.277 N/A ARG 420.A N PHE 416.A O no hydrogen 2.767 N/A ARG 420.A NE THR 417.A O no hydrogen 3.316 N/A ARG 420.A NH1 SER 438.A OG no hydrogen 2.964 N/A ARG 420.A NH1 ASP 519.A OD2 no hydrogen 2.735 N/A ARG 420.A NH2 THR 417.A O no hydrogen 3.159 N/A ARG 420.A NH2 ASP 519.A OD1 no hydrogen 2.840 N/A ARG 420.A NH2 ASP 519.A OD2 no hydrogen 3.383 N/A ARG 421.A NE ASP 519.A OD1 no hydrogen 2.917 N/A ARG 421.A NH1 PHE 521.A O no hydrogen 2.950 N/A ARG 421.A NH2 ASP 519.A OD1 no hydrogen 3.034 N/A ARG 421.A NH2 PHE 521.A O no hydrogen 3.004 N/A ALA 422.A N LEU 418.A O no hydrogen 2.967 N/A PHE 423.A N ALA 419.A O no hydrogen 2.899 N/A LEU 424.A N ARG 420.A O no hydrogen 2.890 N/A GLN 425.A N ARG 421.A O no hydrogen 2.837 N/A GLN 425.A NE2 GLU 429.A OE2 no hydrogen 2.629 N/A LEU 426.A N ALA 422.A O no hydrogen 2.982 N/A CYS 427.A N PHE 423.A O no hydrogen 2.877 N/A CYS 427.A SG TYR 328.A OH no hydrogen 3.289 N/A CYS 427.A SG PHE 423.A O no hydrogen 3.358 N/A SER 428.A N LEU 424.A O no hydrogen 3.010 N/A SER 428.A OG LEU 424.A O no hydrogen 3.421 N/A SER 428.A OG GLN 425.A O no hydrogen 2.824 N/A GLU 429.A N GLN 425.A O no hydrogen 3.156 N/A GLU 429.A N LEU 426.A O no hydrogen 3.037 N/A VAL 430.A N LEU 426.A O no hydrogen 3.098 N/A ASN 431.A N CYS 427.A O no hydrogen 2.732 N/A ASN 431.A ND2 TYR 328.A OH no hydrogen 2.858 N/A VAL 434.A N ASN 431.A O no hydrogen 3.142 N/A TRP 437.A N MET 333.A O no hydrogen 2.911 N/A SER 438.A OG ILE 335.A O no hydrogen 2.613 N/A TYR 439.A N ILE 335.A O no hydrogen 3.213 N/A TYR 439.A OH TYR 478.A OH no hydrogen 2.651 N/A LEU 440.A N LEU 507.A O no hydrogen 2.834 N/A ALA 441.A N ASP 337.A O no hydrogen 2.733 N/A SER 442.A N ILE 509.A O no hydrogen 2.867 N/A SER 442.A OG GLU 339.A OE1 no hydrogen 2.568 N/A ASP 444.A N THR 452.A OG1 no hydrogen 3.062 N/A TYR 445.A N SER 442.A O no hydrogen 3.186 N/A TYR 445.A OH ASN 393.A O no hydrogen 2.538 N/A PHE 447.A N ASP 444.A O no hydrogen 2.968 N/A PHE 449.A N ASN 398.A OD1 no hydrogen 2.739 N/A LEU 450.A N PRO 448.A O no hydrogen 2.727 N/A GLY 451.A N PHE 447.A O no hydrogen 2.921 N/A THR 452.A N ASP 340.A OD2 no hydrogen 2.922 N/A HIS 454.A ND1 GLU 341.A OE1 no hydrogen 2.829 N/A HIS 454.A NE2 SER 209.A OG no hydrogen 2.589 N/A THR 456.A N PHE 453.A O no hydrogen 3.097 N/A THR 456.A OG1 PHE 453.A O no hydrogen 2.583 N/A ILE 458.A N ALA 455.A O no hydrogen 3.012 N/A LEU 459.A N THR 456.A O no hydrogen 3.207 N/A GLN 460.A N THR 456.A O no hydrogen 3.093 N/A GLN 460.A NE2 GLN 460.A O no hydrogen 2.982 N/A GLN 460.A NE2 LEU 466.A O no hydrogen 2.704 N/A VAL 461.A N ASP 457.A O no hydrogen 2.827 N/A PHE 462.A N ASP 457.A O no hydrogen 3.079 N/A TYR 463.A N ILE 458.A O no hydrogen 3.073 N/A TYR 463.A OH TYR 132.A O no hydrogen 2.521 N/A VAL 465.A N LEU 459.A O no hydrogen 2.847 N/A ASN 468.A N SER 471.A OG no hydrogen 2.944 N/A ASN 468.A ND2 GLN 460.A OE1 no hydrogen 2.997 N/A TYR 469.A OH ASP 494.A OD2 no hydrogen 2.494 N/A ALA 470.A N ALA 511.A O no hydrogen 3.399 N/A SER 471.A N ASN 468.A OD1 no hydrogen 2.809 N/A SER 471.A OG ASN 468.A O no hydrogen 3.179 N/A SER 471.A OG ASN 468.A OD1 no hydrogen 3.452 N/A GLY 472.A N ASN 468.A O no hydrogen 3.014 N/A SER 473.A N TYR 469.A O no hydrogen 2.841 N/A SER 473.A OG TYR 469.A O no hydrogen 2.999 N/A SER 473.A OG ALA 470.A O no hydrogen 3.537 N/A ILE 474.A N ALA 470.A O no hydrogen 3.069 N/A GLN 475.A N SER 471.A O no hydrogen 3.026 N/A GLN 475.A NE2 VAL 461.A O no hydrogen 2.861 N/A LYS 476.A N GLY 472.A O no hydrogen 3.167 N/A LYS 476.A NZ ALA 492.A O no hydrogen 2.855 N/A TYR 477.A N SER 473.A O no hydrogen 2.805 N/A TYR 477.A OH ILE 495.A O no hydrogen 2.493 N/A TYR 478.A N ILE 474.A O no hydrogen 2.788 N/A TYR 478.A OH ASN 240.A OD1 no hydrogen 2.668 N/A ILE 479.A N GLN 475.A O no hydrogen 2.757 N/A ASN 480.A N LYS 476.A O no hydrogen 2.800 N/A ASN 480.A ND2 PRO 487.A O no hydrogen 3.081 N/A ASN 480.A ND2 ALA 491.A O no hydrogen 2.863 N/A PHE 481.A N TYR 477.A O no hydrogen 2.927 N/A VAL 482.A N TYR 478.A O no hydrogen 2.894 N/A THR 483.A N ILE 479.A O no hydrogen 2.959 N/A THR 483.A OG1 ILE 479.A O no hydrogen 3.195 N/A THR 484.A N ASN 480.A O no hydrogen 2.710 N/A THR 484.A OG1 ASN 480.A O no hydrogen 2.930 N/A THR 484.A OG1 LYS 489.A O no hydrogen 2.862 N/A GLY 485.A N PHE 481.A O no hydrogen 2.846 N/A ASP 486.A N THR 484.A OG1 no hydrogen 3.190 N/A ASN 488.A N ASP 486.A OD1 no hydrogen 2.709 N/A ASN 488.A ND2 TRP 497.A O no hydrogen 2.833 N/A LYS 489.A N ASP 486.A O no hydrogen 2.949 N/A ALA 491.A N ASN 480.A OD1 no hydrogen 2.899 N/A TRP 497.A N ASN 488.A OD1 no hydrogen 2.732 N/A TRP 497.A NE1 SER 438.A O no hydrogen 2.995 N/A TRP 500.A N SER 436.A O no hydrogen 2.831 N/A TRP 500.A NE1 ASP 519.A OD2 no hydrogen 2.948 N/A SER 501.A OG GLN 499.A OE1 no hydrogen 3.366 N/A ALA 502.A N GLN 499.A O no hydrogen 3.338 N/A LYS 504.A N TRP 500.A O no hydrogen 2.687 N/A LYS 504.A NZ GLN 425.A OE1 no hydrogen 2.596 N/A ILE 506.A N VAL 517.A O no hydrogen 2.841 N/A LEU 507.A N SER 438.A O no hydrogen 3.198 N/A GLN 508.A N VAL 515.A O.A no hydrogen 2.767 N/A GLN 508.A N VAL 515.A O.B no hydrogen 2.757 N/A GLN 508.A NE2 SER 442.A OG no hydrogen 3.039 N/A ILE 509.A N LEU 440.A O no hydrogen 2.977 N/A TYR 510.A N LYS 513.A O no hydrogen 2.690 N/A VAL 515.A N.A GLN 508.A O no hydrogen 2.928 N/A VAL 515.A N.B GLN 508.A O no hydrogen 2.923 N/A VAL 517.A N ILE 506.A O no hydrogen 2.878 N/A ASP 519.A N LYS 504.A O no hydrogen 2.923 N/A ARG 522.A NE ASP 413.A OD1 no hydrogen 3.320 N/A ARG 522.A NE ASP 413.A OD2 no hydrogen 2.692 N/A ARG 522.A NH2 ASP 413.A OD1 no hydrogen 2.882 N/A SER 525.A OG THR 381.A OG1 no hydrogen 2.667 N/A TYR 526.A N ARG 522.A O no hydrogen 3.042 N/A GLU 527.A N ALA 523.A O no hydrogen 2.759 N/A TYR 528.A N LYS 524.A O no hydrogen 3.067 N/A LEU 529.A N SER 525.A O no hydrogen 2.985 N/A TYR 530.A N TYR 526.A O no hydrogen 2.784 N/A ASN 531.A N GLU 527.A O no hydrogen 3.068 N/A ASN 532.A N TYR 528.A O no hydrogen 3.042 N/A ASN 532.A N LEU 529.A O no hydrogen 3.253 N/A ASN 532.A ND2 TYR 528.A O no hydrogen 2.858 N/A ILE 535.A N ASN 532.A O no hydrogen 2.910 N/A PHE 536.A N ILE 533.A O no hydrogen 2.944 N/A ARG 537.A NE GLU 320.A OE2 no hydrogen 2.852 N/A ARG 537.A NH2 GLU 320.A OE2 no hydrogen 3.098 N/A ILE 538.A N PRO 246.A O no hydrogen 2.960 N/A