Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1fxh_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLN 23.A OE1 no hydrogen 3.276 N/A ASN 2.A N GLY 21.A O no hydrogen 3.024 N/A MET 3.A N ASN 239.A O no hydrogen 2.888 N/A TRP 4.A N VAL 19.A O no hydrogen 2.946 N/A TRP 4.A NE1 ALA 282.A O no hydrogen 3.018 N/A VAL 5.A N ILE 237.A O no hydrogen 2.704 N/A ILE 6.A N ILE 17.A O no hydrogen 2.672 N/A GLY 7.A N GLY 235.A O no hydrogen 2.944 N/A LYS 8.A N GLY 186.A O no hydrogen 3.336 N/A LYS 10.A N GLY 7.A O no hydrogen 2.841 N/A LYS 10.A NZ LEU 271.A O no hydrogen 2.957 N/A LYS 10.A NZ LYS 274.A O no hydrogen 2.938 N/A LYS 10.A NZ PRO 275.A O no hydrogen 2.900 N/A ALA 11.A N GLY 7.A O no hydrogen 2.955 N/A GLN 12.A N LEU 277.A O no hydrogen 2.750 N/A GLN 12.A NE2 ASP 13.A OD1 no hydrogen 3.219 N/A LYS 15.A N PHE 488.A O no hydrogen 3.062 N/A ILE 17.A N ILE 6.A O no hydrogen 2.873 N/A MET 18.A N ILE 486.A O no hydrogen 2.854 N/A VAL 19.A N TRP 4.A O no hydrogen 2.942 N/A ASN 20.A N ASP 484.A O no hydrogen 3.001 N/A ASN 20.A ND2 ASN 2.A O no hydrogen 3.072 N/A ASN 20.A ND2 SER 67.A O no hydrogen 3.294 N/A GLY 21.A N ASN 2.A O no hydrogen 2.722 N/A GLN 23.A N SER 1.A OG no hydrogen 2.611 N/A GLN 23.A NE2 ASN 478.A OD1 no hydrogen 2.992 N/A GLN 23.A NE2 ARG 479.A O no hydrogen 3.020 N/A PHE 24.A N THR 481.A OG1 no hydrogen 2.792 N/A TRP 26.A NE1 TYR 528.A OH no hydrogen 2.813 N/A TYR 27.A OH PHE 24.A O no hydrogen 3.018 N/A ALA 28.A N ARG 455.A O no hydrogen 2.794 N/A THR 32.A OG1 ASN 47.A OD1 no hydrogen 2.905 N/A TYR 33.A N THR 48.A O no hydrogen 2.761 N/A ILE 35.A N GLY 46.A O no hydrogen 3.005 N/A LEU 37.A N VAL 44.A O no hydrogen 3.000 N/A HIS 38.A ND1 ASP 43.A OD1 no hydrogen 2.672 N/A GLY 39.A N TYR 42.A O no hydrogen 2.755 N/A TYR 42.A N GLY 39.A O no hydrogen 2.907 N/A VAL 44.A N LEU 37.A O no hydrogen 2.836 N/A THR 45.A N HIS 59.A O no hydrogen 3.136 N/A THR 45.A OG1 TRP 537.A O no hydrogen 2.801 N/A ASN 47.A N PHE 57.A O no hydrogen 2.835 N/A ASN 47.A ND2 GLU 482.A OE1 no hydrogen 3.034 N/A ASN 47.A ND2 ASP 501.A OD2 no hydrogen 2.842 N/A THR 48.A N TYR 33.A O no hydrogen 2.973 N/A THR 48.A OG1 GLY 54.A O no hydrogen 2.830 N/A PHE 50.A N TYR 31.A O no hydrogen 3.164 N/A ALA 51.A N THR 48.A O no hydrogen 3.315 N/A TYR 52.A N PRO 49.A O no hydrogen 2.999 N/A VAL 56.A N THR 48.A OG1 no hydrogen 3.025 N/A PHE 57.A N ASN 47.A O no hydrogen 3.239 N/A GLY 58.A N TRP 65.A O no hydrogen 3.445 N/A HIS 59.A N THR 45.A O no hydrogen 3.093 N/A ASN 60.A N ILE 63.A O no hydrogen 3.035 N/A ASN 60.A ND2 MET 158.A O no hydrogen 2.761 N/A ASN 60.A ND2 ALA 160.A O no hydrogen 3.024 N/A VAL 62.A N ASN 60.A OD1 no hydrogen 2.964 N/A ILE 63.A N ASN 60.A OD1 no hydrogen 3.004 N/A SER 64.A N ALA 182.A O no hydrogen 2.794 N/A TRP 65.A N GLY 58.A O no hydrogen 2.906 N/A TRP 65.A NE1 LEU 55.A O no hydrogen 2.823 N/A GLY 66.A N TYR 180.A O no hydrogen 3.263 N/A SER 67.A N ASN 20.A OD1 no hydrogen 3.142 N/A SER 67.A OG ASN 178.A O no hydrogen 3.437 N/A THR 68.A N ASN 178.A O no hydrogen 3.114 N/A THR 68.A OG1 TYR 180.A OH no hydrogen 2.791 N/A THR 68.A OG1 ASN 239.A OD1 no hydrogen 3.024 N/A GLY 70.A N THR 176.A O no hydrogen 2.866 N/A GLY 72.A N THR 176.A OG1 no hydrogen 2.900 N/A VAL 75.A N ASP 73.A OD1 no hydrogen 3.276 N/A ASP 76.A N SER 140.A O no hydrogen 2.973 N/A PHE 78.A N ALA 138.A O no hydrogen 2.911 N/A ALA 79.A N VAL 209.A O no hydrogen 2.731 N/A GLU 80.A N ALA 136.A O no hydrogen 2.815 N/A LEU 82.A N GLN 134.A O no hydrogen 2.982 N/A GLU 85.A N SER 83.A OG no hydrogen 3.173 N/A LYS 86.A N SER 83.A O no hydrogen 2.940 N/A TYR 89.A N LYS 86.A O no hydrogen 3.123 N/A TYR 90.A N VAL 97.A O no hydrogen 3.010 N/A LEU 91.A N ARG 81.A O no hydrogen 3.023 N/A HIS 92.A N LYS 95.A O no hydrogen 2.805 N/A HIS 92.A NE2 ASP 216.A OD2 no hydrogen 2.564 N/A ASN 93.A N THR 212.A O no hydrogen 2.836 N/A LYS 95.A N HIS 92.A O no hydrogen 3.216 N/A VAL 97.A N TYR 90.A O no hydrogen 2.785 N/A MET 99.A N GLY 88.A O no hydrogen 2.794 N/A LEU 100.A N ARG 120.A O no hydrogen 2.823 N/A ARG 102.A N VAL 118.A O no hydrogen 3.051 N/A ARG 102.A NE GLU 104.A OE2 no hydrogen 2.679 N/A GLU 104.A N PHE 116.A O no hydrogen 2.891 N/A THR 105.A OG1 THR 115.A OG1 no hydrogen 2.959 N/A ILE 106.A N GLU 114.A O no hydrogen 2.645 N/A GLY 111.A N VAL 108.A O no hydrogen 3.018 N/A GLU 114.A N ILE 106.A O no hydrogen 2.982 N/A THR 115.A OG1 THR 105.A OG1 no hydrogen 2.959 N/A PHE 116.A N GLU 104.A O no hydrogen 2.881 N/A THR 117.A OG1 GLU 103.A OE1 no hydrogen 3.384 N/A THR 117.A OG1 GLU 103.A OE2 no hydrogen 2.475 N/A VAL 118.A N ARG 102.A O no hydrogen 2.944 N/A ARG 120.A N LEU 100.A O no hydrogen 2.845 N/A ARG 120.A NH2 ASP 144.A OD1 no hydrogen 2.876 N/A THR 121.A N GLY 124.A O no hydrogen 2.884 N/A THR 121.A OG1 GLU 80.A OE2 no hydrogen 2.580 N/A THR 121.A OG1 GLY 124.A O no hydrogen 3.483 N/A VAL 122.A N TYR 90.A OH no hydrogen 2.989 N/A HIS 123.A N THR 121.A OG1 no hydrogen 3.100 N/A HIS 123.A ND1 GLU 80.A OE1 no hydrogen 3.171 N/A HIS 123.A ND1 GLU 80.A OE2 no hydrogen 2.542 N/A HIS 123.A NE2 ASP 216.A OD1 no hydrogen 2.715 N/A GLY 124.A N THR 121.A O no hydrogen 2.991 N/A ILE 126.A N TRP 119.A O no hydrogen 2.766 N/A LEU 127.A N TYR 137.A O no hydrogen 2.689 N/A GLN 128.A NE2 LEU 127.A O no hydrogen 2.474 N/A THR 129.A OG1 GLN 128.A O no hydrogen 2.494 N/A THR 132.A OG1 THR 133.A OG1 no hydrogen 3.277 N/A THR 133.A N ASP 130.A O no hydrogen 3.132 N/A THR 133.A OG1 THR 132.A OG1 no hydrogen 3.277 N/A THR 135.A N ASP 130.A O no hydrogen 3.272 N/A ALA 136.A N GLU 80.A O no hydrogen 3.334 N/A ALA 138.A N PHE 78.A O no hydrogen 2.894 N/A LYS 139.A N ASN 125.A O no hydrogen 3.109 N/A SER 140.A N ASP 76.A O no hydrogen 2.758 N/A ALA 142.A N ASP 74.A O no hydrogen 2.861 N/A ASP 144.A N ARG 141.A O no hydrogen 3.066 N/A LYS 146.A N TRP 143.A O no hydrogen 2.780 N/A GLU 147.A N GLU 147.A OE1 no hydrogen 2.722 N/A SER 150.A N LYS 146.A O no hydrogen 3.009 N/A SER 150.A OG LYS 146.A O no hydrogen 2.780 N/A SER 150.A OG GLN 173.A OE1 no hydrogen 3.318 N/A LEU 151.A N GLU 147.A O no hydrogen 3.087 N/A LEU 152.A N LEU 148.A O no hydrogen 2.891 N/A ALA 153.A N ALA 149.A O no hydrogen 2.741 N/A TRP 154.A N SER 150.A O no hydrogen 3.086 N/A THR 155.A N LEU 152.A O no hydrogen 2.867 N/A THR 155.A OG1 LEU 151.A O no hydrogen 2.942 N/A HIS 156.A N LEU 152.A O no hydrogen 2.803 N/A GLN 157.A N ALA 153.A O no hydrogen 2.999 N/A GLN 157.A NE2 TRP 154.A O no hydrogen 3.217 N/A MET 158.A N THR 155.A O no hydrogen 3.077 N/A LYS 159.A N HIS 156.A O no hydrogen 2.953 N/A LYS 159.A NZ HIS 156.A ND1 no hydrogen 3.379 N/A ALA 160.A N GLN 157.A O no hydrogen 3.202 N/A LYS 161.A N GLU 165.A OE1 no hydrogen 2.690 N/A GLU 165.A N ASN 162.A OD1 no hydrogen 2.726 N/A TRP 166.A N ASN 162.A O no hydrogen 2.982 N/A TRP 166.A NE1 GLN 157.A OE1 no hydrogen 2.864 N/A THR 167.A N TRP 163.A O no hydrogen 2.856 N/A THR 167.A OG1 TRP 163.A O no hydrogen 3.026 N/A THR 167.A OG1 GLN 164.A O no hydrogen 3.087 N/A GLN 168.A N GLN 164.A O no hydrogen 3.108 N/A GLN 168.A NE2 GLN 164.A O no hydrogen 3.349 N/A GLN 169.A N TRP 166.A O no hydrogen 2.971 N/A ALA 170.A N TRP 166.A O no hydrogen 2.954 N/A ALA 171.A N THR 167.A O no hydrogen 2.883 N/A LYS 172.A N GLN 169.A O no hydrogen 2.833 N/A GLN 173.A N ALA 170.A O no hydrogen 3.235 N/A GLN 173.A NE2 LEU 175.A O no hydrogen 2.725 N/A GLN 173.A NE2 THR 193.A OG1 no hydrogen 2.909 N/A ALA 174.A N SER 150.A OG no hydrogen 2.904 N/A LEU 175.A N GLN 173.A OE1 no hydrogen 2.875 N/A THR 176.A OG1 TYR 196.A OH no hydrogen 2.867 N/A ILE 177.A N THR 193.A O no hydrogen 3.345 N/A ASN 178.A N THR 68.A O no hydrogen 2.807 N/A ASN 178.A ND2 THR 68.A OG1 no hydrogen 3.160 N/A TRP 179.A N VAL 191.A O no hydrogen 2.764 N/A TYR 180.A N GLY 66.A O no hydrogen 2.885 N/A TYR 180.A OH THR 68.A OG1 no hydrogen 2.791 N/A TYR 181.A N GLY 189.A O no hydrogen 2.775 N/A TYR 181.A OH ASP 183.A OD2 no hydrogen 2.543 N/A ALA 182.A N SER 64.A O no hydrogen 3.246 N/A ASP 183.A N ASN 187.A O no hydrogen 2.902 N/A VAL 184.A N VAL 62.A O no hydrogen 2.905 N/A ASN 185.A N ASP 183.A OD1 no hydrogen 2.874 N/A GLY 186.A N ASP 183.A O no hydrogen 2.803 N/A ASN 187.A N ASP 183.A OD1 no hydrogen 2.985 N/A ASN 187.A ND2 ASP 183.A OD2 no hydrogen 3.050 N/A ILE 188.A N ASN 231.A OD1 no hydrogen 2.977 N/A GLY 189.A N TYR 181.A O no hydrogen 2.798 N/A TYR 190.A N VAL 229.A O no hydrogen 2.819 N/A TYR 190.A OH ASN 178.A OD1 no hydrogen 2.839 N/A VAL 191.A N TRP 179.A O no hydrogen 2.967 N/A HIS 192.A N PRO 227.A O no hydrogen 2.815 N/A HIS 192.A ND1 ASN 178.A OD1 no hydrogen 2.753 N/A THR 193.A N ILE 177.A O no hydrogen 2.854 N/A THR 193.A OG1 ILE 177.A O no hydrogen 2.655 N/A ALA 195.A N ALA 174.A O no hydrogen 2.777 N/A TYR 196.A OH THR 176.A OG1 no hydrogen 2.867 N/A TYR 196.A OH THR 193.A O no hydrogen 2.795 N/A ASP 198.A N GLY 219.A O no hydrogen 2.756 N/A ARG 199.A NE ASP 76.A OD2 no hydrogen 2.629 N/A ARG 199.A NH2 ASP 73.A O no hydrogen 3.091 N/A ARG 199.A NH2 ASP 76.A OD1 no hydrogen 2.993 N/A ARG 199.A NH2 ASP 76.A OD2 no hydrogen 3.278 N/A GLN 200.A NE2 ASP 216.A O no hydrogen 2.907 N/A HIS 203.A N GLN 200.A O no hydrogen 3.035 N/A ARG 206.A N ASP 204.A OD1 no hydrogen 2.990 N/A ARG 206.A NE ASP 204.A OD1 no hydrogen 2.912 N/A ARG 206.A NH2 ASP 204.A OD2 no hydrogen 2.809 N/A LEU 207.A N ASP 204.A O no hydrogen 3.189 N/A VAL 209.A N ILE 77.A O no hydrogen 2.975 N/A GLY 211.A N ALA 79.A O no hydrogen 2.824 N/A ASP 216.A N GLY 213.A O no hydrogen 3.127 N/A TRP 217.A NE1 ASP 76.A OD2 no hydrogen 2.881 N/A LYS 218.A N ASP 198.A O no hydrogen 2.846 N/A LEU 221.A N TYR 196.A O no hydrogen 2.819 N/A MET 225.A N PRO 222.A O no hydrogen 3.087 N/A ASN 226.A N PHE 223.A O no hydrogen 3.007 N/A ASN 226.A ND2 HIS 192.A O no hydrogen 3.029 N/A ASN 226.A ND2 GLY 194.A O no hydrogen 3.012 N/A LYS 228.A NZ PHE 223.A O no hydrogen 2.944 N/A LYS 228.A NZ ASN 226.A O no hydrogen 2.627 N/A VAL 229.A N TYR 190.A O no hydrogen 2.857 N/A ASN 231.A N ILE 188.A O no hydrogen 2.733 N/A ASN 231.A ND2 ASN 187.A OD1 no hydrogen 2.984 N/A SER 234.A OG TYR 236.A O no hydrogen 2.876 N/A GLY 235.A N PRO 232.A O no hydrogen 2.933 N/A TYR 236.A N SER 234.A OG no hydrogen 3.139 N/A TYR 236.A OH GLU 272.A OE2 no hydrogen 2.636 N/A ILE 237.A N VAL 5.A O no hydrogen 2.878 N/A ASN 239.A N MET 3.A O no hydrogen 2.858 N/A ASN 239.A ND2 ASN 242.A O no hydrogen 3.342 N/A TRP 240.A N ASN 242.A OD1 no hydrogen 2.794 N/A TRP 240.A NE1 GLN 23.A OE1 no hydrogen 2.892 N/A ALA 241.A N ASN 239.A OD1 no hydrogen 2.805 N/A GLN 245.A N SER 243.A OG no hydrogen 3.288 N/A TYR 248.A N GLN 245.A O no hydrogen 2.943 N/A TYR 248.A OH HIS 192.A NE2 no hydrogen 2.903 N/A SER 251.A N PHE 71.A O no hydrogen 2.860 N/A LEU 253.A N SER 251.A OG no hydrogen 3.265 N/A PHE 256.A N LEU 253.A O no hydrogen 2.911 N/A TRP 258.A NE1 ALA 241.A O no hydrogen 2.793 N/A GLY 260.A N GLU 398.A OE2 no hydrogen 2.989 N/A ARG 263.A NE TRP 240.A O no hydrogen 2.896 N/A ARG 263.A NH1 SER 386.A OG no hydrogen 2.966 N/A ARG 263.A NH1 LEU 387.A O no hydrogen 2.841 N/A ARG 263.A NH2 TRP 240.A O no hydrogen 3.317 N/A VAL 264.A N ASP 262.A OD1 no hydrogen 2.975 N/A THR 265.A N ASP 262.A O no hydrogen 3.167 N/A THR 265.A OG1 ASP 262.A O no hydrogen 3.147 N/A GLU 266.A N ARG 263.A O no hydrogen 3.083 N/A ILE 267.A N VAL 264.A O no hydrogen 2.865 N/A ASP 268.A N VAL 264.A O no hydrogen 3.008 N/A ARG 269.A N THR 265.A O no hydrogen 2.930 N/A LEU 271.A N ILE 267.A O no hydrogen 2.998 N/A GLU 272.A N ASP 268.A O no hydrogen 2.809 N/A ARG 276.A NH1 LYS 8.A O no hydrogen 2.992 N/A ARG 276.A NH1 ALA 11.A O no hydrogen 3.273 N/A LEU 277.A N LYS 10.A O no hydrogen 2.767 N/A THR 278.A N GLN 281.A OE1 no hydrogen 2.985 N/A GLN 281.A N THR 278.A OG1 no hydrogen 3.134 N/A ALA 282.A N THR 278.A O no hydrogen 2.842 N/A TRP 283.A N ALA 279.A O no hydrogen 2.874 N/A TRP 283.A NE1 PHE 531.A O no hydrogen 2.852 N/A ASP 284.A N ASP 280.A O no hydrogen 2.927 N/A VAL 285.A N ALA 282.A O no hydrogen 3.265 N/A ILE 286.A N TRP 283.A O no hydrogen 2.889 N/A ARG 287.A NE GLN 288.A OE1 no hydrogen 2.971 N/A GLN 288.A N ASP 284.A O no hydrogen 3.083 N/A THR 289.A N VAL 285.A O no hydrogen 2.936 N/A THR 289.A OG1 VAL 285.A O no hydrogen 2.767 N/A THR 289.A OG1 ILE 286.A O no hydrogen 3.267 N/A SER 290.A N ILE 286.A O no hydrogen 2.888 N/A SER 290.A OG ILE 286.A O no hydrogen 3.129 N/A SER 290.A OG ARG 287.A O no hydrogen 2.819 N/A ARG 291.A N GLN 288.A O no hydrogen 3.203 N/A ARG 291.A NE GLU 475.A OE2 no hydrogen 2.812 N/A ARG 291.A NH2 GLU 475.A OE1 no hydrogen 3.111 N/A GLN 292.A N THR 289.A O no hydrogen 3.272 N/A ASP 293.A N GLY 328.A O no hydrogen 2.752 N/A ASN 295.A N ASP 293.A OD1 no hydrogen 2.785 N/A ASN 295.A ND2 TYR 376.A OH no hydrogen 3.081 N/A LEU 296.A N ASP 293.A OD1 no hydrogen 2.884 N/A ARG 297.A NE GLU 266.A OE2 no hydrogen 2.771 N/A PHE 299.A N ASN 295.A O no hydrogen 3.099 N/A LEU 300.A N LEU 296.A O no hydrogen 2.982 N/A LEU 303.A N PHE 299.A O no hydrogen 2.892 N/A GLN 304.A N LEU 300.A O no hydrogen 2.758 N/A ALA 305.A N PRO 301.A O no hydrogen 2.881 N/A ALA 306.A N THR 302.A O no hydrogen 3.033 N/A THR 307.A N LEU 303.A O no hydrogen 3.154 N/A THR 307.A OG1 LEU 303.A O no hydrogen 2.834 N/A THR 307.A OG1 GLN 304.A O no hydrogen 3.554 N/A SER 308.A N ALA 305.A O no hydrogen 3.446 N/A SER 308.A OG ALA 305.A O no hydrogen 2.953 N/A LEU 310.A N THR 307.A O no hydrogen 3.071 N/A GLN 312.A NE2 GLU 321.A OE1 no hydrogen 3.562 N/A GLN 312.A NE2 GLU 321.A OE2 no hydrogen 2.637 N/A ASP 314.A N THR 311.A O no hydrogen 2.916 N/A ARG 316.A N ASP 314.A OD1 no hydrogen 3.115 N/A ARG 316.A NE ASP 314.A OD1 no hydrogen 3.140 N/A ARG 316.A NH2 ASP 314.A OD2 no hydrogen 2.906 N/A ARG 317.A NE GLU 321.A OE2 no hydrogen 2.590 N/A ARG 317.A NH1 THR 307.A O no hydrogen 2.920 N/A GLN 318.A N ASP 314.A O no hydrogen 3.140 N/A LEU 319.A N PRO 315.A O no hydrogen 2.916 N/A VAL 320.A N ARG 316.A O no hydrogen 3.334 N/A GLU 321.A N ARG 317.A O no hydrogen 3.025 N/A THR 322.A N GLN 318.A O no hydrogen 2.968 N/A THR 322.A OG1 GLN 318.A O no hydrogen 2.671 N/A LEU 323.A N LEU 319.A O no hydrogen 3.202 N/A THR 324.A N VAL 320.A O no hydrogen 2.799 N/A THR 324.A OG1 GLN 304.A OE1 no hydrogen 2.961 N/A THR 324.A OG1 VAL 320.A O no hydrogen 3.011 N/A ARG 325.A N GLU 321.A O no hydrogen 3.052 N/A TRP 326.A N LEU 323.A O no hydrogen 3.034 N/A ILE 329.A N ASP 327.A OD1 no hydrogen 2.962 N/A ASN 330.A N ARG 291.A O no hydrogen 2.880 N/A ASN 330.A ND2 SER 344.A OG no hydrogen 2.837 N/A ASN 333.A N THR 338.A O no hydrogen 2.677 N/A GLY 336.A N ASN 333.A O no hydrogen 3.001 N/A LYS 337.A N ASP 335.A OD1 no hydrogen 2.828 N/A THR 338.A N ASP 335.A OD1 no hydrogen 3.111 N/A THR 338.A OG1 ASN 333.A OD1 no hydrogen 2.923 N/A THR 338.A OG1 ASP 335.A OD1 no hydrogen 3.308 N/A THR 338.A OG1 ASP 335.A OD2 no hydrogen 2.561 N/A TRP 339.A N THR 447.A O no hydrogen 2.818 N/A GLN 340.A N LEU 331.A O no hydrogen 2.762 N/A GLN 340.A NE2 LEU 332.A O no hydrogen 3.203 N/A SER 344.A OG ASP 293.A OD2 no hydrogen 2.863 N/A ILE 346.A N PRO 342.A O no hydrogen 3.020 N/A LEU 347.A N GLY 343.A O no hydrogen 2.912 N/A ASN 348.A N SER 344.A O no hydrogen 2.787 N/A VAL 349.A N ALA 345.A O no hydrogen 3.057 N/A TRP 350.A N ILE 346.A O no hydrogen 2.918 N/A TRP 350.A NE1 VAL 423.A O no hydrogen 3.260 N/A LEU 351.A N LEU 347.A O no hydrogen 2.794 N/A THR 352.A N ASN 348.A O no hydrogen 2.861 N/A THR 352.A OG1 ASN 348.A O no hydrogen 2.734 N/A SER 353.A N VAL 349.A O no hydrogen 3.064 N/A SER 353.A OG ASP 429.A OD2 no hydrogen 2.691 N/A MET 354.A N TRP 350.A O no hydrogen 2.809 N/A LEU 355.A N LEU 351.A O no hydrogen 2.908 N/A LYS 356.A N THR 352.A O no hydrogen 3.078 N/A ARG 357.A N SER 353.A O no hydrogen 2.960 N/A ARG 357.A NE SER 353.A OG no hydrogen 2.987 N/A ARG 357.A NH2 ASP 429.A OD1 no hydrogen 3.255 N/A ARG 357.A NH2 ASP 429.A OD2 no hydrogen 2.677 N/A THR 358.A N LEU 355.A O no hydrogen 3.133 N/A THR 358.A OG1 MET 354.A O no hydrogen 2.688 N/A VAL 360.A N LEU 355.A O no hydrogen 2.923 N/A ALA 362.A N THR 358.A O no hydrogen 3.070 N/A ALA 362.A N VAL 359.A O no hydrogen 2.937 N/A VAL 363.A N VAL 360.A O no hydrogen 3.347 N/A ASP 368.A N PRO 364.A O no hydrogen 3.123 N/A LYS 369.A N PRO 366.A O no hydrogen 3.154 N/A TRP 370.A N PHE 367.A O no hydrogen 2.877 N/A TYR 371.A N ASP 368.A O no hydrogen 3.048 N/A SER 372.A N LYS 369.A O no hydrogen 3.358 N/A SER 372.A OG LYS 369.A O no hydrogen 2.874 N/A SER 374.A N GLU 377.A OE2 no hydrogen 2.855 N/A SER 374.A OG GLU 377.A OE2 no hydrogen 3.263 N/A GLY 375.A N GLU 377.A OE1 no hydrogen 2.890 N/A TYR 376.A N SER 374.A OG no hydrogen 3.303 N/A TYR 376.A OH ASP 293.A OD1 no hydrogen 3.058 N/A TYR 376.A OH ASP 293.A OD2 no hydrogen 2.456 N/A GLU 377.A N GLU 377.A OE1 no hydrogen 2.723 N/A THR 378.A OG1 THR 379.A O no hydrogen 3.379 N/A GLY 382.A N THR 379.A O no hydrogen 2.773 N/A LEU 387.A N ASN 478.A OD1 no hydrogen 2.906 N/A ILE 389.A N ASN 388.A OD1 no hydrogen 2.615 N/A SER 390.A OG ALA 373.A O no hydrogen 2.787 N/A ALA 393.A N SER 390.A OG no hydrogen 3.072 N/A LYS 394.A N SER 390.A O no hydrogen 2.953 N/A LYS 394.A NZ LEU 257.A O no hydrogen 2.823 N/A ILE 395.A N VAL 391.A O no hydrogen 3.165 N/A LEU 396.A N GLY 392.A O no hydrogen 2.897 N/A TYR 397.A N ALA 393.A O no hydrogen 2.757 N/A GLU 398.A N LYS 394.A O no hydrogen 3.278 N/A ALA 399.A N ILE 395.A O no hydrogen 3.167 N/A VAL 400.A N LEU 396.A O no hydrogen 2.868 N/A GLN 401.A N TYR 397.A O no hydrogen 2.970 N/A GLN 401.A N GLU 398.A O no hydrogen 3.237 N/A GLY 402.A N ALA 399.A O no hydrogen 3.185 N/A LYS 404.A N GLN 401.A O no hydrogen 3.070 N/A SER 405.A N GLY 402.A O no hydrogen 3.011 N/A SER 405.A OG GLU 398.A OE1 no hydrogen 2.666 N/A ILE 407.A N SER 405.A OG no hydrogen 3.082 N/A GLN 409.A NE2 ILE 407.A O no hydrogen 2.838 N/A PHE 414.A N ASP 412.A OD1 no hydrogen 2.940 N/A ALA 415.A N ASP 412.A O no hydrogen 2.634 N/A GLY 416.A N ASP 412.A OD2 no hydrogen 2.652 N/A LYS 417.A N PHE 414.A O no hydrogen 3.062 N/A VAL 422.A N PRO 418.A O no hydrogen 3.349 N/A VAL 423.A N GLN 419.A O no hydrogen 2.832 N/A LEU 424.A N GLN 420.A O no hydrogen 2.774 N/A ALA 425.A N GLU 421.A O no hydrogen 2.811 N/A ALA 426.A N VAL 422.A O no hydrogen 2.912 N/A LEU 427.A N VAL 423.A O no hydrogen 3.015 N/A GLU 428.A N LEU 424.A O no hydrogen 2.925 N/A ASP 429.A N ALA 425.A O no hydrogen 3.090 N/A THR 430.A N ALA 426.A O no hydrogen 2.881 N/A THR 430.A OG1 ALA 426.A O no hydrogen 2.821 N/A TRP 431.A N LEU 427.A O no hydrogen 2.838 N/A GLU 432.A N GLU 428.A O no hydrogen 2.977 N/A THR 433.A N ASP 429.A O no hydrogen 2.956 N/A THR 433.A OG1 ASP 429.A O no hydrogen 3.049 N/A LEU 434.A N THR 430.A O no hydrogen 2.926 N/A SER 435.A N TRP 431.A O no hydrogen 2.839 N/A SER 435.A OG TRP 431.A O no hydrogen 2.578 N/A SER 435.A OG GLU 432.A O no hydrogen 3.383 N/A LYS 436.A N GLU 432.A O no hydrogen 3.012 N/A ARG 437.A N THR 433.A O no hydrogen 3.326 N/A TYR 438.A N LEU 434.A O no hydrogen 2.774 N/A GLY 439.A N SER 435.A O no hydrogen 2.832 N/A SER 443.A N ASN 441.A OD1 no hydrogen 3.179 N/A SER 443.A OG ASN 441.A OD1 no hydrogen 2.557 N/A ASN 444.A N ASN 441.A O no hydrogen 3.012 N/A TRP 445.A N VAL 442.A O no hydrogen 2.917 N/A TRP 445.A NE1 GLY 439.A O no hydrogen 2.960 N/A ALA 449.A N LYS 337.A O no hydrogen 2.869 N/A LEU 452.A N GLN 473.A O no hydrogen 2.953 N/A THR 453.A OG1 ASP 381.A O no hydrogen 2.734 N/A THR 453.A OG1 HIS 472.A ND1 no hydrogen 3.046 N/A PHE 454.A N ARG 471.A O no hydrogen 2.775 N/A ARG 455.A N TRP 26.A O no hydrogen 2.844 N/A ARG 455.A NH2 GLY 382.A O no hydrogen 2.888 N/A ASN 458.A N VAL 462.A O no hydrogen 2.758 N/A PHE 460.A N ASN 458.A OD1 no hydrogen 2.855 N/A GLY 461.A N ASN 458.A O no hydrogen 2.776 N/A VAL 462.A N ASN 458.A OD1 no hydrogen 3.260 N/A GLN 464.A N ALA 456.A O no hydrogen 2.856 N/A GLN 464.A NE2 PRO 29.A O no hydrogen 2.989 N/A ALA 466.A N GLU 469.A OE2 no hydrogen 2.863 N/A GLU 469.A N ALA 466.A O no hydrogen 2.795 N/A THR 470.A N ALA 467.A O no hydrogen 3.058 N/A THR 470.A OG1 ALA 467.A O no hydrogen 3.036 N/A ARG 471.A N PHE 454.A O no hydrogen 3.012 N/A GLN 473.A N LEU 452.A O no hydrogen 2.829 N/A GLN 473.A NE2 GLU 475.A O no hydrogen 2.865 N/A TYR 476.A N MET 450.A O no hydrogen 2.764 N/A TYR 476.A OH GLY 385.A O no hydrogen 2.803 N/A ASN 478.A N SER 290.A O no hydrogen 2.945 N/A ASN 478.A ND2 LEU 387.A O no hydrogen 2.995 N/A ARG 479.A N GLN 477.A O no hydrogen 2.763 N/A ARG 479.A NH1 TYR 528.A O no hydrogen 2.644 N/A THR 481.A N PRO 22.A O no hydrogen 2.690 N/A THR 481.A OG1 GLY 25.A O no hydrogen 2.492 N/A ASP 484.A N ASN 20.A O no hydrogen 3.244 N/A MET 485.A N TRP 500.A O no hydrogen 2.847 N/A ILE 486.A N MET 18.A O no hydrogen 2.862 N/A VAL 487.A N LEU 498.A O no hydrogen 2.702 N/A PHE 488.A N ALA 16.A O no hydrogen 2.860 N/A SER 489.A N PRO 496.A O no hydrogen 2.645 N/A SER 489.A OG VAL 184.A O no hydrogen 2.686 N/A THR 491.A N ASP 13.A O no hydrogen 2.983 N/A THR 491.A OG1 ASP 13.A O no hydrogen 3.386 N/A SER 493.A N PRO 490.A O no hydrogen 3.486 N/A ARG 495.A N SER 493.A OG no hydrogen 2.918 N/A LEU 498.A N VAL 487.A O no hydrogen 2.844 N/A TRP 500.A N MET 485.A O no hydrogen 2.891 N/A ASP 501.A N LYS 534.A O no hydrogen 3.035 N/A VAL 502.A N ASN 483.A O no hydrogen 3.079 N/A VAL 503.A N GLN 524.A OE1 no hydrogen 2.703 N/A SER 508.A N HIS 520.A O no hydrogen 3.068 N/A PHE 510.A N SER 508.A OG no hydrogen 2.977 N/A ALA 512.A N THR 516.A O no hydrogen 2.958 N/A GLY 515.A N ALA 512.A O no hydrogen 2.869 N/A THR 516.A N ASP 514.A OD1 no hydrogen 2.810 N/A THR 516.A OG1 ASP 514.A OD1 no hydrogen 2.627 N/A THR 516.A OG1 ASP 514.A OD2 no hydrogen 3.533 N/A ASP 518.A N PHE 510.A O no hydrogen 3.026 N/A HIS 520.A N ASP 518.A OD2 no hydrogen 2.824 N/A HIS 520.A ND1 ASP 523.A OD2 no hydrogen 2.693 N/A HIS 520.A NE2 GLU 548.A OE1 no hydrogen 2.987 N/A HIS 520.A NE2 GLU 548.A OE2 no hydrogen 2.630 N/A TYR 521.A N ASP 518.A O no hydrogen 2.886 N/A TYR 521.A OH GLU 469.A OE1 no hydrogen 2.521 N/A GLN 524.A N PRO 505.A O no hydrogen 2.880 N/A LEU 525.A N GLU 522.A O no hydrogen 3.429 N/A LYS 526.A NZ GLU 529.A OE1 no hydrogen 2.862 N/A TYR 528.A N GLN 524.A O no hydrogen 2.956 N/A TYR 528.A OH GLY 480.A O no hydrogen 2.703 N/A GLU 529.A N LEU 525.A O no hydrogen 3.232 N/A ASN 530.A N LYS 526.A O no hydrogen 3.143 N/A PHE 531.A N TYR 528.A O no hydrogen 3.065 N/A GLY 532.A N MET 527.A O no hydrogen 2.746 N/A ARG 533.A NH2 ASP 280.A OD1 no hydrogen 2.775 N/A LYS 534.A N ASP 501.A O no hydrogen 3.096 N/A LYS 534.A NZ ASP 501.A OD1 no hydrogen 2.783 N/A LEU 536.A N ALA 499.A O no hydrogen 2.919 N/A ASP 542.A N THR 539.A OG1 no hydrogen 3.000 N/A VAL 543.A N THR 539.A O no hydrogen 2.931 N/A GLU 544.A N LYS 540.A O no hydrogen 2.928 N/A ALA 545.A N GLN 541.A O no hydrogen 3.018 N/A HIS 546.A N VAL 543.A O no hydrogen 3.270 N/A LYS 547.A N GLU 544.A O no hydrogen 3.157 N/A LYS 547.A NZ GLU 544.A OE2 no hydrogen 3.145 N/A LYS 547.A NZ GLN 550.A OE1 no hydrogen 3.131 N/A