Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mrx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N ASN 95.A OD1 no hydrogen 3.422 N/A SER 3.A N GLU 476.A OE2 no hydrogen 3.041 N/A VAL 4.A N GLU 476.A OE1 no hydrogen 3.040 N/A ARG 5.A N ILE 2.A O no hydrogen 3.274 N/A GLY 6.A N SER 3.A O no hydrogen 3.075 N/A VAL 13.A N GLY 9.A O no hydrogen 2.913 N/A THR 14.A N VAL 10.A O no hydrogen 3.081 N/A THR 14.A OG1 VAL 10.A O no hydrogen 2.715 N/A GLU 15.A N GLU 11.A O no hydrogen 3.023 N/A LEU 16.A N ASN 12.A O no hydrogen 2.850 N/A LYS 17.A N VAL 13.A O no hydrogen 3.005 N/A LYS 17.A NZ GLN 103.A OE1 no hydrogen 2.808 N/A LYS 18.A N THR 14.A O no hydrogen 3.126 N/A ASN 19.A N GLU 15.A O no hydrogen 2.971 N/A ASN 19.A ND2 GLU 15.A O no hydrogen 3.011 N/A PHE 20.A N LEU 16.A O no hydrogen 2.901 N/A ASN 21.A N LYS 17.A O no hydrogen 3.102 N/A ARG 22.A N LYS 18.A O no hydrogen 2.929 N/A ARG 22.A NE ASN 19.A OD1 no hydrogen 3.080 N/A ARG 22.A NH2 ASN 19.A OD1 no hydrogen 2.927 N/A ARG 22.A NH2 ASP 50.A OD1 no hydrogen 3.034 N/A HIS 23.A N ASN 19.A O no hydrogen 2.993 N/A LEU 24.A N PHE 20.A O no hydrogen 2.995 N/A HIS 25.A N ASN 21.A O no hydrogen 3.171 N/A PHE 26.A N ARG 22.A O no hydrogen 2.782 N/A THR 27.A N HIS 23.A O no hydrogen 2.868 N/A LEU 28.A N HIS 23.A O no hydrogen 2.904 N/A LYS 30.A N LEU 24.A O no hydrogen 3.010 N/A LYS 30.A NZ VAL 34.A O no hydrogen 3.461 N/A LYS 30.A NZ ASP 39.A OD1 no hydrogen 3.096 N/A ARG 32.A NE TYR 40.A OH no hydrogen 2.714 N/A ARG 32.A NH1 LEU 104.A O no hydrogen 3.120 N/A ARG 32.A NH2 LEU 104.A O no hydrogen 3.217 N/A ASN 33.A N ASP 31.A OD1 no hydrogen 3.148 N/A VAL 34.A N ASP 31.A O no hydrogen 3.275 N/A THR 36.A N ASP 39.A OD1 no hydrogen 2.562 N/A THR 36.A OG1 ASP 39.A OD1 no hydrogen 2.714 N/A ASP 39.A N THR 36.A OG1 no hydrogen 3.251 N/A TYR 40.A N THR 36.A O no hydrogen 3.189 N/A TYR 41.A N PRO 37.A O no hydrogen 3.011 N/A PHE 42.A N ARG 38.A O no hydrogen 2.993 N/A ALA 43.A N ASP 39.A O no hydrogen 2.944 N/A LEU 44.A N TYR 40.A O no hydrogen 3.057 N/A ALA 45.A N TYR 41.A O no hydrogen 2.857 N/A HIS 46.A N PHE 42.A O no hydrogen 2.921 N/A HIS 46.A ND1 PHE 42.A O no hydrogen 3.011 N/A THR 47.A N ALA 43.A O no hydrogen 2.978 N/A THR 47.A OG1 ALA 43.A O no hydrogen 2.815 N/A VAL 48.A N LEU 44.A O no hydrogen 2.898 N/A ARG 49.A N ALA 45.A O no hydrogen 2.853 N/A ARG 49.A NH1 PRO 177.A O no hydrogen 2.827 N/A ASP 50.A N HIS 46.A O no hydrogen 3.065 N/A HIS 51.A N VAL 48.A O no hydrogen 2.913 N/A LEU 52.A N ARG 49.A O no hydrogen 2.958 N/A VAL 53.A N ASP 50.A O no hydrogen 3.371 N/A ARG 55.A NE ASN 225.A OD1 no hydrogen 2.837 N/A ARG 55.A NH1 HIS 51.A O no hydrogen 2.972 N/A ARG 55.A NH2 ASN 225.A OD1 no hydrogen 3.438 N/A TRP 56.A N LEU 52.A O no hydrogen 2.856 N/A TRP 56.A NE1 THR 229.A OG1 no hydrogen 2.961 N/A ILE 57.A N VAL 53.A O no hydrogen 2.956 N/A ARG 58.A N GLY 54.A O no hydrogen 2.932 N/A THR 59.A N ARG 55.A O no hydrogen 2.827 N/A THR 59.A OG1 ARG 55.A O no hydrogen 2.670 N/A GLN 60.A N TRP 56.A O no hydrogen 3.189 N/A GLN 60.A NE2 VAL 227.A O no hydrogen 3.196 N/A GLN 61.A N ILE 57.A O no hydrogen 2.951 N/A HIS 62.A N ARG 58.A O no hydrogen 2.818 N/A TYR 63.A N THR 59.A O no hydrogen 2.988 N/A TYR 63.A OH ASN 228.A OD1 no hydrogen 2.712 N/A TYR 64.A N GLN 60.A O no hydrogen 3.156 N/A GLU 65.A N GLN 61.A O no hydrogen 3.035 N/A LYS 66.A N HIS 62.A O no hydrogen 2.905 N/A ASP 67.A N TYR 63.A O no hydrogen 2.862 N/A LYS 69.A NZ PRO 305.A O no hydrogen 2.912 N/A LYS 69.A NZ TRP 799.A O no hydrogen 2.746 N/A ARG 70.A N LYS 307.A O no hydrogen 2.871 N/A ILE 71.A N ALA 142.A O no hydrogen 2.978 N/A TYR 72.A N ALA 309.A O no hydrogen 2.704 N/A TYR 73.A N TYR 144.A O no hydrogen 2.913 N/A LEU 74.A N GLN 311.A O no hydrogen 2.922 N/A SER 75.A N TYR 146.A O no hydrogen 3.183 N/A SER 75.A OG GLU 77.A O no hydrogen 2.740 N/A GLU 77.A N SER 75.A OG no hydrogen 3.111 N/A PHE 78.A N LEU 120.A O no hydrogen 2.873 N/A TYR 79.A N GLY 126.A O no hydrogen 2.930 N/A MET 80.A N ALA 118.A O no hydrogen 3.179 N/A GLY 81.A N ALA 118.A O no hydrogen 3.127 N/A ARG 82.A NE GLU 115.A O no hydrogen 2.939 N/A ARG 82.A NH1 GLU 113.A OE1 no hydrogen 3.464 N/A ARG 82.A NH1 GLU 113.A OE2 no hydrogen 3.408 N/A ARG 82.A NH2 GLU 113.A OE2 no hydrogen 3.421 N/A THR 83.A N GLU 115.A OE1 no hydrogen 3.267 N/A THR 83.A N GLU 115.A OE2 no hydrogen 2.716 N/A LEU 84.A N GLU 115.A OE1 no hydrogen 2.974 N/A GLN 85.A NE2 GLU 94.A OE1 no hydrogen 2.733 N/A GLN 85.A NE2 LEU 469.A O no hydrogen 3.212 N/A THR 87.A N THR 83.A O no hydrogen 2.919 N/A THR 87.A OG1 THR 83.A O no hydrogen 2.748 N/A MET 88.A N LEU 84.A O no hydrogen 3.118 N/A VAL 89.A N GLN 85.A O no hydrogen 2.848 N/A ASN 90.A N ASN 86.A O no hydrogen 3.122 N/A ASN 90.A ND2 ASP 134.A OD1 no hydrogen 3.297 N/A ASN 90.A ND2 PRO 220.A O no hydrogen 2.713 N/A LEU 91.A N THR 87.A O no hydrogen 3.100 N/A LEU 91.A N MET 88.A O no hydrogen 3.259 N/A ALA 92.A N VAL 89.A O no hydrogen 3.264 N/A LEU 93.A N MET 88.A O no hydrogen 2.834 N/A ASN 95.A N ARG 5.A O no hydrogen 3.052 N/A ASN 95.A ND2 ILE 2.A O no hydrogen 2.726 N/A ASN 95.A ND2 GLY 6.A O no hydrogen 2.898 N/A CYS 97.A N LEU 93.A O no hydrogen 2.878 N/A CYS 97.A SG LEU 93.A O no hydrogen 3.413 N/A ASP 98.A N GLU 94.A O no hydrogen 2.879 N/A GLU 99.A N ASN 95.A O no hydrogen 2.848 N/A ALA 100.A N ALA 96.A O no hydrogen 2.806 N/A THR 101.A N CYS 97.A O no hydrogen 2.928 N/A THR 101.A OG1 CYS 97.A O no hydrogen 2.809 N/A THR 101.A OG1 ASP 98.A O no hydrogen 2.990 N/A TYR 102.A N ASP 98.A O no hydrogen 2.924 N/A GLN 103.A N GLU 99.A O no hydrogen 2.955 N/A GLN 103.A NE2 GLU 99.A OE1 no hydrogen 2.698 N/A LEU 104.A N ALA 100.A O no hydrogen 3.258 N/A LEU 104.A N THR 101.A O no hydrogen 3.000 N/A GLY 105.A N TYR 102.A O no hydrogen 2.906 N/A LEU 106.A N THR 101.A O no hydrogen 2.828 N/A GLU 109.A N ASP 107.A OD2 no hydrogen 3.159 N/A LEU 111.A N ASP 107.A O no hydrogen 3.178 N/A GLU 112.A N MET 108.A O no hydrogen 2.874 N/A GLU 113.A N GLU 109.A O no hydrogen 3.310 N/A ILE 114.A N LEU 111.A O no hydrogen 3.126 N/A GLU 115.A N GLU 112.A O no hydrogen 3.377 N/A ALA 118.A N GLY 81.A O no hydrogen 2.949 N/A ASN 122.A N GLU 77.A OE2 no hydrogen 2.809 N/A ASN 122.A ND2 GLU 77.A OE1 no hydrogen 2.908 N/A ASN 122.A ND2 TYR 264.A O no hydrogen 2.997 N/A ARG 127.A N GLY 123.A O no hydrogen 2.950 N/A ARG 127.A NE TYR 79.A O no hydrogen 3.342 N/A ARG 127.A NH1 TYR 79.A O no hydrogen 3.237 N/A LEU 128.A N GLY 124.A O no hydrogen 2.894 N/A ALA 129.A N LEU 125.A O no hydrogen 3.234 N/A ALA 130.A N GLY 126.A O no hydrogen 3.345 N/A CYS 131.A N ARG 127.A O no hydrogen 2.905 N/A CYS 131.A SG ARG 127.A O no hydrogen 3.645 N/A PHE 132.A N LEU 128.A O no hydrogen 2.812 N/A LEU 133.A N ALA 129.A O no hydrogen 2.987 N/A ASP 134.A N ALA 130.A O no hydrogen 3.221 N/A SER 135.A N CYS 131.A O no hydrogen 3.018 N/A SER 135.A OG SER 787.A OG no hydrogen 2.652 N/A SER 135.A OG ASP 788.A OD1 no hydrogen 2.698 N/A MET 136.A N PHE 132.A O no hydrogen 2.818 N/A ALA 137.A N LEU 133.A O no hydrogen 3.154 N/A THR 138.A N ASP 134.A O no hydrogen 2.969 N/A THR 138.A OG1 ASP 134.A O no hydrogen 3.079 N/A LEU 139.A N SER 135.A O no hydrogen 2.835 N/A GLY 140.A N ALA 137.A O no hydrogen 3.238 N/A LEU 141.A N MET 136.A O no hydrogen 2.959 N/A TYR 144.A N ILE 71.A O no hydrogen 2.850 N/A TYR 144.A OH GLN 60.A OE1 no hydrogen 3.370 N/A GLY 145.A N THR 229.A O no hydrogen 3.214 N/A TYR 146.A N TYR 73.A O no hydrogen 3.032 N/A TYR 146.A OH ASP 290.A OD1 no hydrogen 2.581 N/A GLY 147.A N ARG 231.A O no hydrogen 3.194 N/A ARG 149.A N TRP 233.A O no hydrogen 2.861 N/A ARG 149.A NE GLU 179.A OE2 no hydrogen 2.851 N/A ARG 149.A NH1 GLU 179.A OE1 no hydrogen 2.765 N/A ARG 149.A NH1 GLU 179.A OE2 no hydrogen 3.540 N/A TYR 150.A OH LEU 76.A O no hydrogen 2.623 N/A GLU 151.A N SER 260.A O no hydrogen 3.029 N/A PHE 152.A N ARG 261.A O no hydrogen 2.785 N/A ILE 154.A N GLY 119.A O no hydrogen 2.884 N/A ASN 156.A N GLU 167.A O no hydrogen 2.877 N/A GLN 157.A N ASN 622.A OD1 no hydrogen 2.948 N/A GLN 157.A NE2 GLN 164.A OE1 no hydrogen 2.719 N/A GLN 157.A NE2 GLY 582.A O no hydrogen 3.145 N/A LYS 158.A N MET 165.A O no hydrogen 2.938 N/A LYS 158.A NZ GLU 167.A OE2 no hydrogen 2.765 N/A ILE 159.A N GLU 621.A OE1 no hydrogen 2.902 N/A CYS 160.A N TRP 163.A O no hydrogen 2.749 N/A TRP 163.A N CYS 160.A O no hydrogen 3.063 N/A GLN 164.A NE2 GLU 166.A OE2 no hydrogen 2.874 N/A GLN 164.A NE2 ALA 584.A O no hydrogen 2.764 N/A MET 165.A N LYS 158.A O no hydrogen 2.684 N/A GLU 167.A N ASN 156.A O no hydrogen 2.931 N/A TRP 171.A NE1 TYR 150.A O no hydrogen 2.925 N/A ARG 173.A N ASP 170.A O no hydrogen 3.212 N/A GLY 175.A N LEU 172.A O no hydrogen 2.882 N/A ASN 176.A ND2 GLU 179.A OE2 no hydrogen 3.135 N/A TRP 178.A N ASN 176.A OD1 no hydrogen 3.054 N/A LYS 180.A N ASP 216.A O no hydrogen 2.782 N/A LYS 180.A NZ ALA 181.A O no hydrogen 2.670 N/A ARG 182.A N PRO 214.A O no hydrogen 2.791 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.713 N/A PHE 185.A N ARG 182.A O no hydrogen 2.870 N/A THR 186.A N PRO 183.A O no hydrogen 3.194 N/A THR 186.A OG1 PRO 183.A O no hydrogen 2.710 N/A LEU 187.A N ALA 212.A O no hydrogen 2.996 N/A VAL 189.A N VAL 210.A O no hydrogen 2.742 N/A HIS 190.A ND1 THR 207.A OG1 no hydrogen 2.592 N/A PHE 191.A N GLN 208.A O no hydrogen 2.807 N/A TYR 192.A N LEU 370.A O no hydrogen 2.793 N/A TYR 192.A OH GLU 274.A OE1 no hydrogen 2.920 N/A ARG 194.A N VAL 205.A O no hydrogen 2.928 N/A ARG 194.A NE ASP 206.A OD2 no hydrogen 2.954 N/A ARG 194.A NH1 GLU 196.A OE2 no hydrogen 3.326 N/A ARG 194.A NH1 ASP 206.A OD2 no hydrogen 2.881 N/A ARG 194.A NH2 GLU 196.A OE2 no hydrogen 2.735 N/A GLU 196.A N LYS 203.A O no hydrogen 2.838 N/A THR 198.A N GLY 201.A O no hydrogen 3.003 N/A THR 198.A OG1 GLY 201.A O no hydrogen 2.888 N/A GLN 200.A N THR 198.A OG1 no hydrogen 3.190 N/A LYS 203.A N GLU 196.A O no hydrogen 2.728 N/A TRP 204.A NE1 TYR 192.A O no hydrogen 2.691 N/A VAL 205.A N ARG 194.A O no hydrogen 2.947 N/A THR 207.A OG1 HIS 190.A ND1 no hydrogen 2.592 N/A GLN 208.A N PHE 191.A O no hydrogen 2.863 N/A VAL 210.A N VAL 189.A O no hydrogen 2.868 N/A LEU 211.A N LYS 236.A O no hydrogen 2.757 N/A ALA 212.A N LEU 187.A O no hydrogen 2.703 N/A MET 213.A N SER 234.A O no hydrogen 2.775 N/A TYR 215.A N LEU 232.A O no hydrogen 2.821 N/A ASP 216.A N LYS 180.A O no hydrogen 2.823 N/A THR 217.A N MET 230.A O no hydrogen 2.833 N/A THR 217.A OG1 TRP 178.A O no hydrogen 3.198 N/A VAL 219.A N ASN 228.A O no hydrogen 2.664 N/A GLY 221.A N VAL 226.A O no hydrogen 2.750 N/A TYR 222.A N THR 138.A OG1 no hydrogen 2.945 N/A ARG 223.A N ASN 90.A O no hydrogen 2.878 N/A ARG 223.A NH1 VAL 4.A O no hydrogen 3.564 N/A ARG 223.A NH2 VAL 89.A O no hydrogen 2.787 N/A ASN 225.A ND2 LEU 808.A O no hydrogen 2.811 N/A VAL 227.A N THR 59.A OG1 no hydrogen 3.067 N/A ASN 228.A N VAL 219.A O no hydrogen 2.846 N/A ASN 228.A ND2 LEU 141.A O no hydrogen 2.938 N/A MET 230.A N THR 217.A O no hydrogen 2.815 N/A ARG 231.A N GLY 145.A O no hydrogen 2.754 N/A ARG 231.A NE ASP 216.A OD2 no hydrogen 2.681 N/A ARG 231.A NH1 ASP 216.A OD1 no hydrogen 2.787 N/A ARG 231.A NH1 ASP 216.A OD2 no hydrogen 3.408 N/A ARG 231.A NH2 ASP 290.A OD1 no hydrogen 2.718 N/A LEU 232.A N TYR 215.A O no hydrogen 2.951 N/A TRP 233.A N GLY 147.A O no hydrogen 2.962 N/A TRP 233.A NE1 THR 287.A OG1 no hydrogen 3.201 N/A SER 234.A N MET 213.A O no hydrogen 2.808 N/A ALA 235.A N SER 260.A OG no hydrogen 2.931 N/A LYS 236.A N LEU 211.A O no hydrogen 2.879 N/A ALA 237.A N GLU 257.A OE2 no hydrogen 3.014 N/A PHE 241.A N PRO 238.A O no hydrogen 3.050 N/A LEU 243.A N ASP 240.A O no hydrogen 2.879 N/A GLN 248.A N GLY 244.A O no hydrogen 3.096 N/A ALA 249.A N GLY 245.A O no hydrogen 2.947 N/A VAL 250.A N TYR 246.A O no hydrogen 3.191 N/A LEU 251.A N ILE 247.A O no hydrogen 2.899 N/A ASP 252.A N GLN 248.A O no hydrogen 2.754 N/A ARG 253.A N VAL 250.A O no hydrogen 3.216 N/A ARG 253.A NH1 ALA 237.A O no hydrogen 3.361 N/A ASN 254.A N LEU 251.A O no hydrogen 3.365 N/A LEU 255.A N ASP 252.A O no hydrogen 3.017 N/A GLU 257.A N ARG 253.A O no hydrogen 3.283 N/A ASN 258.A N ASN 254.A O no hydrogen 2.831 N/A ILE 259.A N ALA 256.A O no hydrogen 3.493 N/A ARG 261.A N ASN 258.A O no hydrogen 3.087 N/A ARG 261.A NE ASN 258.A OD1 no hydrogen 3.140 N/A ARG 261.A NH1 ASN 254.A O no hydrogen 3.522 N/A ARG 261.A NH1 ASN 258.A OD1 no hydrogen 3.052 N/A ARG 261.A NH2 GLU 151.A OE2 no hydrogen 2.872 N/A LEU 263.A N PHE 152.A O no hydrogen 3.065 N/A ASN 266.A ND2 PHE 269.A O no hydrogen 3.038 N/A ASP 267.A N PRO 265.A O no hydrogen 2.988 N/A PHE 270.A N GLU 357.A O no hydrogen 2.833 N/A LYS 273.A N GLU 271.A O no hydrogen 2.795 N/A ARG 276.A NE GLU 280.A OE1 no hydrogen 3.138 N/A LEU 277.A N LYS 273.A O no hydrogen 3.180 N/A LYS 278.A N GLU 274.A O no hydrogen 2.909 N/A LYS 278.A NZ TYR 192.A OH no hydrogen 3.067 N/A GLN 279.A N LEU 275.A O no hydrogen 2.968 N/A GLN 279.A NE2 ILE 259.A O no hydrogen 2.875 N/A GLN 279.A NE2 VAL 262.A O no hydrogen 2.921 N/A GLU 280.A N ARG 276.A O no hydrogen 3.034 N/A TYR 281.A N LEU 277.A O no hydrogen 2.997 N/A TYR 281.A OH GLU 323.A OE2 no hydrogen 2.824 N/A PHE 282.A N LYS 278.A O no hydrogen 2.870 N/A VAL 283.A N GLN 279.A O no hydrogen 3.116 N/A VAL 284.A N GLU 280.A O no hydrogen 3.411 N/A ALA 285.A N TYR 281.A O no hydrogen 2.729 N/A ALA 286.A N PHE 282.A O no hydrogen 3.219 N/A THR 287.A N VAL 283.A O no hydrogen 3.023 N/A THR 287.A OG1 VAL 283.A O no hydrogen 2.593 N/A LEU 288.A N VAL 284.A O no hydrogen 2.920 N/A GLN 289.A N ALA 285.A O no hydrogen 3.245 N/A GLN 289.A NE2 PRO 188.A O no hydrogen 2.900 N/A GLN 289.A NE2 ALA 285.A O no hydrogen 3.242 N/A ASP 290.A N ALA 286.A O no hydrogen 3.149 N/A ILE 291.A N THR 287.A O no hydrogen 2.839 N/A ILE 292.A N LEU 288.A O no hydrogen 2.937 N/A ARG 293.A N GLN 289.A O no hydrogen 2.930 N/A ARG 293.A NH1 PHE 185.A O no hydrogen 3.431 N/A ARG 293.A NH1 ASP 290.A OD2 no hydrogen 2.732 N/A ARG 294.A N ASP 290.A O no hydrogen 3.030 N/A ARG 294.A NH1 TYR 146.A OH no hydrogen 3.445 N/A ARG 294.A NH2 TYR 72.A OH no hydrogen 3.296 N/A ARG 294.A NH2 TYR 146.A OH no hydrogen 3.054 N/A PHE 295.A N ILE 291.A O no hydrogen 2.912 N/A LYS 296.A N ILE 292.A O no hydrogen 2.924 N/A LYS 296.A NZ GLU 332.A OE2 no hydrogen 2.698 N/A SER 297.A N ARG 293.A O no hydrogen 3.089 N/A SER 297.A OG ARG 293.A O no hydrogen 2.909 N/A SER 298.A OG PHE 295.A O no hydrogen 2.630 N/A PHE 304.A N PHE 301.A O no hydrogen 3.042 N/A ASP 306.A N ALA 303.A O no hydrogen 2.948 N/A LYS 307.A N PHE 304.A O no hydrogen 3.056 N/A LYS 307.A NZ ASP 67.A O no hydrogen 2.789 N/A ALA 309.A N ARG 70.A O no hydrogen 2.888 N/A ILE 310.A N THR 346.A O no hydrogen 2.965 N/A GLN 311.A N TYR 72.A O no hydrogen 2.797 N/A GLN 311.A NE2 THR 350.A OG1 no hydrogen 3.010 N/A LEU 312.A N ALA 348.A O no hydrogen 2.851 N/A ASN 313.A N LEU 74.A O no hydrogen 3.098 N/A ASN 313.A ND2 SER 75.A OG no hydrogen 2.919 N/A ASN 313.A ND2 LEU 125.A O no hydrogen 3.615 N/A ASP 314.A N THR 350.A O no hydrogen 2.906 N/A THR 315.A N ASP 314.A OD2 no hydrogen 2.796 N/A THR 315.A OG1 ASP 314.A OD2 no hydrogen 3.460 N/A THR 315.A OG1 GLU 360.A OE1 no hydrogen 2.635 N/A SER 318.A N THR 315.A O no hydrogen 2.756 N/A SER 318.A OG THR 315.A O no hydrogen 2.852 N/A ALA 320.A N PRO 317.A O no hydrogen 3.062 N/A ILE 321.A N SER 318.A O no hydrogen 3.135 N/A GLU 323.A N LEU 319.A O no hydrogen 2.888 N/A LEU 324.A N ALA 320.A O no hydrogen 2.837 N/A MET 325.A N ILE 321.A O no hydrogen 3.188 N/A ARG 326.A N PRO 322.A O no hydrogen 2.811 N/A ARG 326.A NE GLU 323.A OE2 no hydrogen 2.876 N/A ARG 326.A NH1 GLU 323.A OE1 no hydrogen 2.799 N/A ARG 326.A NH1 GLU 323.A OE2 no hydrogen 3.538 N/A VAL 327.A N GLU 323.A O no hydrogen 2.985 N/A LEU 328.A N LEU 324.A O no hydrogen 2.941 N/A VAL 329.A N MET 325.A O no hydrogen 2.813 N/A ASP 330.A N ARG 326.A O no hydrogen 2.792 N/A LEU 331.A N VAL 327.A O no hydrogen 3.083 N/A GLU 332.A N VAL 327.A O no hydrogen 2.951 N/A LEU 334.A N LEU 328.A O no hydrogen 2.934 N/A LYS 338.A N ASP 335.A OD2 no hydrogen 3.198 N/A LYS 338.A NZ ASP 302.A OD2 no hydrogen 2.690 N/A LYS 338.A NZ GLU 341.A OE2 no hydrogen 3.529 N/A ALA 339.A N ASP 335.A O no hydrogen 3.042 N/A TRP 340.A N TRP 336.A O no hydrogen 2.849 N/A GLU 341.A N ASP 337.A O no hydrogen 3.129 N/A VAL 342.A N LYS 338.A O no hydrogen 3.019 N/A THR 343.A N ALA 339.A O no hydrogen 2.926 N/A THR 343.A OG1 ALA 339.A O no hydrogen 2.880 N/A VAL 344.A N TRP 340.A O no hydrogen 2.934 N/A LYS 345.A N GLU 341.A O no hydrogen 3.160 N/A THR 346.A N VAL 342.A O no hydrogen 3.030 N/A THR 346.A N THR 343.A O no hydrogen 3.093 N/A THR 346.A OG1 VAL 342.A O no hydrogen 2.735 N/A CYS 347.A N THR 343.A O no hydrogen 2.979 N/A CYS 347.A SG THR 343.A O no hydrogen 3.567 N/A ALA 348.A N ILE 310.A O no hydrogen 3.031 N/A TYR 349.A N ALA 426.A O no hydrogen 2.901 N/A THR 350.A N LEU 312.A O no hydrogen 3.061 N/A THR 350.A OG1 ASN 428.A OD1 no hydrogen 2.735 N/A ASN 351.A N ASN 428.A O no hydrogen 2.983 N/A ASN 351.A ND2 TYR 349.A OH no hydrogen 3.146 N/A ASN 351.A ND2 THR 353.A O no hydrogen 3.264 N/A HIS 352.A N ASP 314.A OD1 no hydrogen 3.144 N/A LEU 355.A N THR 353.A OG1 no hydrogen 3.158 N/A GLU 357.A N GLU 357.A OE1 no hydrogen 2.820 N/A ALA 358.A N LEU 355.A O no hydrogen 3.128 N/A LEU 359.A N PRO 356.A O no hydrogen 3.212 N/A ARG 361.A NE GLU 407.A OE2 no hydrogen 2.947 N/A ARG 361.A NH1 GLU 407.A OE2 no hydrogen 3.482 N/A TRP 362.A N ILE 414.A O no hydrogen 3.020 N/A VAL 364.A N LYS 412.A O no hydrogen 2.885 N/A LEU 366.A N PRO 363.A O no hydrogen 3.256 N/A LEU 367.A N PRO 363.A O no hydrogen 3.492 N/A GLU 368.A N VAL 364.A O no hydrogen 2.866 N/A THR 369.A N HIS 365.A O no hydrogen 3.315 N/A THR 369.A OG1 HIS 365.A O no hydrogen 3.007 N/A LEU 370.A N LEU 366.A O no hydrogen 2.917 N/A LEU 371.A N LEU 367.A O no hydrogen 2.786 N/A ARG 373.A NE GLN 376.A OE1 no hydrogen 3.423 N/A ARG 373.A NH1 GLN 376.A OE1 no hydrogen 3.220 N/A ARG 373.A NH2 ASP 330.A OD1 no hydrogen 2.979 N/A HIS 374.A NE2 GLU 323.A OE2 no hydrogen 2.569 N/A LEU 375.A N LEU 371.A O no hydrogen 3.119 N/A GLN 376.A N PRO 372.A O no hydrogen 3.371 N/A ILE 377.A N ARG 373.A O no hydrogen 3.038 N/A ILE 378.A N HIS 374.A O no hydrogen 2.848 N/A TYR 379.A N LEU 375.A O no hydrogen 2.896 N/A GLU 380.A N GLN 376.A O no hydrogen 3.056 N/A ILE 381.A N ILE 377.A O no hydrogen 2.856 N/A ASN 382.A N ILE 378.A O no hydrogen 2.926 N/A ASN 382.A ND2 SER 404.A OG no hydrogen 3.323 N/A GLN 383.A N TYR 379.A O no hydrogen 2.978 N/A ARG 384.A N GLU 380.A O no hydrogen 3.146 N/A ARG 384.A NE GLU 380.A OE1 no hydrogen 2.954 N/A PHE 385.A N ILE 381.A O no hydrogen 2.883 N/A LEU 386.A N ASN 382.A O no hydrogen 2.810 N/A ASN 387.A N GLN 383.A O no hydrogen 2.949 N/A ARG 388.A N ARG 384.A O no hydrogen 3.259 N/A VAL 389.A N PHE 385.A O no hydrogen 3.045 N/A ALA 390.A N LEU 386.A O no hydrogen 2.916 N/A ALA 391.A N ASN 387.A O no hydrogen 3.108 N/A ALA 392.A N ARG 388.A O no hydrogen 3.022 N/A PHE 393.A N VAL 389.A O no hydrogen 2.849 N/A ASP 396.A N PHE 393.A O no hydrogen 3.117 N/A VAL 397.A N GLY 395.A O no hydrogen 2.915 N/A ARG 399.A N ASP 396.A OD2 no hydrogen 3.339 N/A ARG 399.A NE ASP 396.A OD1 no hydrogen 2.908 N/A ARG 399.A NH1 GLU 448.A OE1 no hydrogen 2.739 N/A ARG 399.A NH2 GLU 448.A OE1 no hydrogen 2.863 N/A LEU 400.A N ASP 396.A O no hydrogen 3.386 N/A ARG 401.A N VAL 397.A O no hydrogen 3.379 N/A ARG 401.A NE ASP 398.A OD1 no hydrogen 2.953 N/A ARG 401.A NH1 ASP 398.A OD2 no hydrogen 3.536 N/A ARG 402.A N ASP 398.A O no hydrogen 2.999 N/A ARG 402.A NE ASP 445.A OD2 no hydrogen 2.671 N/A ARG 402.A NH1 ASP 445.A OD1 no hydrogen 2.833 N/A ARG 402.A NH1 ASP 445.A OD2 no hydrogen 3.471 N/A ARG 402.A NH2 ASP 398.A OD2 no hydrogen 2.924 N/A MET 403.A N ARG 399.A O no hydrogen 2.840 N/A SER 404.A OG VAL 406.A O no hydrogen 2.751 N/A LEU 405.A N ASN 382.A OD1 no hydrogen 2.751 N/A VAL 406.A N SER 404.A OG no hydrogen 2.914 N/A GLU 407.A N ARG 413.A O no hydrogen 2.698 N/A ARG 413.A N GLU 407.A O no hydrogen 3.041 N/A ARG 413.A NH2 ARG 361.A O no hydrogen 2.966 N/A ILE 414.A N TRP 362.A O no hydrogen 2.776 N/A ASN 415.A N LEU 405.A O no hydrogen 2.819 N/A ASN 415.A ND2 GLU 407.A OE1 no hydrogen 2.984 N/A MET 416.A N GLU 360.A O no hydrogen 3.156 N/A HIS 418.A N ASN 415.A OD1 no hydrogen 3.134 N/A HIS 418.A ND1 SER 404.A O no hydrogen 2.979 N/A LEU 419.A N ASN 415.A O no hydrogen 3.178 N/A CYS 420.A N MET 416.A O no hydrogen 2.961 N/A CYS 420.A SG MET 416.A O no hydrogen 3.368 N/A ILE 421.A N ALA 417.A O no hydrogen 3.010 N/A ALA 422.A N HIS 418.A O no hydrogen 3.085 N/A GLY 423.A N LEU 419.A O no hydrogen 3.029 N/A SER 424.A N ILE 421.A O no hydrogen 3.387 N/A SER 424.A OG CYS 420.A O no hydrogen 2.736 N/A HIS 425.A N CYS 347.A O no hydrogen 3.024 N/A HIS 425.A ND1 VAL 344.A O no hydrogen 3.207 N/A HIS 425.A NE2 ILE 798.A O no hydrogen 3.143 N/A VAL 427.A N LYS 453.A O no hydrogen 2.765 N/A ASN 428.A N TYR 349.A O no hydrogen 3.028 N/A ASN 428.A ND2 GLY 429.A O no hydrogen 2.907 N/A ASN 428.A ND2 TYR 794.A OH no hydrogen 3.079 N/A GLY 429.A N GLN 455.A O no hydrogen 3.298 N/A ARG 432.A N GLU 672.A OE2 no hydrogen 2.786 N/A ARG 432.A NH1 GLU 675.A OE1 no hydrogen 2.818 N/A ARG 432.A NH1 GLU 675.A OE2 no hydrogen 2.846 N/A ARG 432.A NH2 GLU 675.A OE1 no hydrogen 2.739 N/A SER 435.A N ALA 431.A O no hydrogen 2.896 N/A SER 435.A OG ALA 431.A O no hydrogen 3.304 N/A SER 435.A OG GLN 455.A O no hydrogen 3.521 N/A GLU 436.A N ARG 432.A O no hydrogen 3.032 N/A ILE 437.A N ILE 433.A O no hydrogen 2.936 N/A LEU 438.A N HIS 434.A O no hydrogen 2.997 N/A LYS 439.A N SER 435.A O no hydrogen 3.256 N/A LYS 439.A NZ GLU 436.A OE2 no hydrogen 3.016 N/A LYS 440.A N GLU 436.A O no hydrogen 2.989 N/A THR 441.A N ILE 437.A O no hydrogen 2.822 N/A THR 441.A OG1 ILE 437.A O no hydrogen 2.657 N/A PHE 443.A N LEU 438.A O no hydrogen 3.006 N/A LYS 444.A N THR 441.A O no hydrogen 3.168 N/A LYS 444.A NZ GLU 448.A OE2 no hydrogen 2.787 N/A TYR 447.A N PHE 443.A O no hydrogen 2.947 N/A GLU 448.A N LYS 444.A O no hydrogen 3.042 N/A LEU 449.A N ASP 445.A O no hydrogen 3.184 N/A GLU 450.A N PHE 446.A O no hydrogen 2.835 N/A LYS 453.A N GLU 450.A O no hydrogen 3.204 N/A LYS 453.A NZ ILE 421.A O no hydrogen 2.771 N/A LYS 453.A NZ ALA 422.A O no hydrogen 3.321 N/A LYS 453.A NZ GLU 450.A OE1 no hydrogen 2.726 N/A LYS 453.A NZ GLU 450.A OE2 no hydrogen 3.342 N/A PHE 454.A N PRO 451.A O no hydrogen 3.315 N/A GLN 455.A N VAL 427.A O no hydrogen 2.794 N/A GLN 455.A NE2 GLU 797.A O no hydrogen 3.301 N/A ASN 456.A ND2 GLY 429.A O no hydrogen 3.632 N/A ASN 456.A ND2 SER 435.A OG no hydrogen 2.713 N/A LYS 457.A N GLY 429.A O no hydrogen 3.090 N/A LYS 457.A NZ GLN 455.A OE1 no hydrogen 2.704 N/A LYS 457.A NZ ASN 456.A O no hydrogen 2.851 N/A LYS 457.A NZ GLU 797.A OE2 no hydrogen 2.707 N/A THR 458.A OG1 ASN 456.A OD1 no hydrogen 3.002 N/A THR 458.A OG1 GLU 672.A OE1 no hydrogen 2.659 N/A THR 458.A OG1 GLU 672.A OE2 no hydrogen 3.279 N/A ASN 459.A N VAL 430.A O no hydrogen 2.782 N/A ILE 461.A N PHE 785.A O no hydrogen 2.800 N/A THR 462.A OG1 ASP 134.A OD2 no hydrogen 2.576 N/A ARG 464.A N THR 462.A OG1 no hydrogen 3.194 N/A ARG 464.A NE ASP 134.A OD2 no hydrogen 3.120 N/A ARG 464.A NH1 ASP 134.A OD2 no hydrogen 2.865 N/A ARG 464.A NH1 ASP 788.A OD1 no hydrogen 2.797 N/A ARG 464.A NH1 ASP 788.A OD2 no hydrogen 3.562 N/A ARG 464.A NH2 ILE 487.A O no hydrogen 2.966 N/A ARG 464.A NH2 ASP 788.A OD2 no hydrogen 2.766 N/A ARG 465.A NH1 ARG 82.A O no hydrogen 2.918 N/A ARG 465.A NH2 ARG 82.A O no hydrogen 3.104 N/A ARG 465.A NH2 GLU 629.A OE1 no hydrogen 2.759 N/A TRP 466.A N THR 462.A O no hydrogen 3.051 N/A VAL 468.A N PRO 463.A O no hydrogen 3.261 N/A LEU 469.A N ARG 464.A O no hydrogen 2.910 N/A CYS 470.A N ARG 465.A O no hydrogen 3.340 N/A CYS 470.A SG ARG 465.A O no hydrogen 3.455 N/A CYS 470.A SG ASN 658.A OD1 no hydrogen 3.963 N/A ASN 471.A N LEU 467.A O no hydrogen 2.714 N/A ASN 471.A ND2 ASN 658.A OD1 no hydrogen 2.884 N/A ALA 475.A N ASN 471.A O no hydrogen 3.088 N/A GLU 476.A N PRO 472.A O no hydrogen 2.893 N/A ILE 477.A N GLY 473.A O no hydrogen 3.248 N/A ILE 478.A N LEU 474.A O no hydrogen 3.156 N/A ALA 479.A N ALA 475.A O no hydrogen 2.931 N/A GLU 480.A N GLU 476.A O no hydrogen 2.903 N/A ARG 481.A N ILE 478.A O no hydrogen 3.151 N/A ILE 482.A N ILE 478.A O no hydrogen 2.997 N/A GLY 483.A N ALA 479.A O no hydrogen 2.841 N/A TYR 486.A OH ALA 475.A O no hydrogen 2.789 N/A ILE 487.A N GLU 484.A O no hydrogen 3.205 N/A SER 488.A N GLU 485.A O no hydrogen 3.319 N/A ASP 489.A N TYR 486.A O no hydrogen 3.112 N/A GLN 492.A N ASP 489.A O no hydrogen 3.050 N/A GLN 492.A NE2 GLU 485.A OE1 no hydrogen 3.065 N/A GLN 492.A NE2 ASP 489.A OD1 no hydrogen 3.178 N/A LEU 493.A N LEU 490.A O no hydrogen 3.019 N/A ARG 494.A N ASP 491.A O no hydrogen 3.055 N/A ARG 494.A NH2 GLU 676.A OE1 no hydrogen 3.271 N/A LYS 495.A N GLN 492.A O no hydrogen 2.996 N/A LYS 495.A NZ GLN 492.A OE1 no hydrogen 2.828 N/A LEU 496.A N LEU 493.A O no hydrogen 2.881 N/A LEU 497.A N ARG 494.A O no hydrogen 2.910 N/A SER 498.A N LYS 495.A O no hydrogen 3.414 N/A SER 498.A OG LYS 495.A O no hydrogen 2.955 N/A TYR 499.A N LEU 496.A O no hydrogen 2.929 N/A VAL 500.A N LEU 497.A O no hydrogen 3.363 N/A ASP 502.A N TYR 499.A O no hydrogen 3.017 N/A PHE 505.A N ASP 502.A OD2 no hydrogen 2.997 N/A ILE 506.A N ASP 502.A O no hydrogen 2.915 N/A ARG 507.A N GLU 503.A O no hydrogen 3.131 N/A ASP 508.A N ALA 504.A O no hydrogen 2.958 N/A VAL 509.A N PHE 505.A O no hydrogen 2.825 N/A ALA 510.A N ILE 506.A O no hydrogen 3.131 N/A LYS 511.A N ARG 507.A O no hydrogen 2.925 N/A LYS 511.A NZ ASP 508.A O no hydrogen 3.549 N/A VAL 512.A N ASP 508.A O no hydrogen 2.922 N/A LYS 513.A N VAL 509.A O no hydrogen 3.207 N/A LYS 513.A NZ PRO 633.A O no hydrogen 2.646 N/A LYS 513.A NZ ALA 635.A O no hydrogen 2.753 N/A LYS 513.A NZ ASN 658.A O no hydrogen 2.794 N/A GLN 514.A N ALA 510.A O no hydrogen 3.047 N/A GLN 514.A NE2 PRO 534.A O no hydrogen 3.218 N/A GLU 515.A N LYS 511.A O no hydrogen 2.949 N/A ASN 516.A N VAL 512.A O no hydrogen 2.971 N/A ASN 516.A ND2 ASN 471.A OD1 no hydrogen 2.933 N/A ASN 516.A ND2 PRO 633.A O no hydrogen 3.253 N/A LYS 517.A N LYS 513.A O no hydrogen 2.869 N/A LYS 517.A NZ SER 536.A O no hydrogen 2.779 N/A LYS 517.A NZ ASP 636.A OD2 no hydrogen 2.806 N/A LEU 518.A N GLN 514.A O no hydrogen 2.839 N/A LYS 519.A N GLU 515.A O no hydrogen 2.871 N/A PHE 520.A N ASN 516.A O no hydrogen 2.932 N/A ALA 521.A N LYS 517.A O no hydrogen 2.815 N/A ALA 522.A N LEU 518.A O no hydrogen 2.975 N/A TYR 523.A N LYS 519.A O no hydrogen 2.973 N/A LEU 524.A N PHE 520.A O no hydrogen 3.044 N/A GLU 525.A N ALA 521.A O no hydrogen 3.408 N/A ARG 526.A N ALA 522.A O no hydrogen 3.056 N/A GLU 527.A N TYR 523.A O no hydrogen 3.062 N/A TYR 528.A N LEU 524.A O no hydrogen 2.917 N/A LYS 529.A N GLU 525.A O no hydrogen 3.022 N/A LYS 529.A NZ ARG 526.A O no hydrogen 3.492 N/A ASN 535.A N ASN 533.A OD1 no hydrogen 3.284 N/A SER 536.A N ASN 533.A O no hydrogen 3.177 N/A SER 536.A OG ASN 533.A O no hydrogen 2.510 N/A SER 536.A OG THR 577.A OG1 no hydrogen 2.639 N/A LEU 537.A N PRO 575.A O no hydrogen 2.866 N/A PHE 538.A N ASP 636.A OD2 no hydrogen 2.921 N/A ASP 539.A N THR 577.A O no hydrogen 2.811 N/A VAL 540.A N LEU 637.A O no hydrogen 2.933 N/A GLN 541.A N MET 579.A O no hydrogen 2.814 N/A LYS 543.A N GLY 581.A O no hydrogen 3.164 N/A LYS 543.A NZ GLN 640.A OE1 no hydrogen 2.858 N/A ARG 544.A NE LYS 583.A O no hydrogen 2.967 N/A ARG 544.A NH1 PRO 265.A O no hydrogen 2.846 N/A ARG 544.A NH2 ASN 122.A O no hydrogen 3.226 N/A ARG 544.A NH2 ASN 122.A OD1 no hydrogen 2.744 N/A ILE 545.A N LYS 583.A O no hydrogen 2.993 N/A HIS 546.A N GLN 551.A OE1 no hydrogen 3.454 N/A GLU 547.A N TYR 588.A OH no hydrogen 3.053 N/A TYR 548.A N HIS 546.A ND1.A no hydrogen 3.058 N/A TYR 548.A OH GLU 647.A OE1 no hydrogen 2.534 N/A LYS 549.A N HIS 546.A O no hydrogen 3.147 N/A LYS 549.A NZ GLU 647.A OE1 no hydrogen 3.333 N/A LYS 549.A NZ GLU 647.A OE2 no hydrogen 2.757 N/A ARG 550.A N GLU 547.A O no hydrogen 3.078 N/A ARG 550.A NE ILE 641.A O no hydrogen 2.851 N/A ARG 550.A NH1 PHE 745.A O no hydrogen 3.392 N/A ARG 550.A NH1 ASP 750.A OD2 no hydrogen 2.747 N/A ARG 550.A NH2 ILE 641.A O no hydrogen 3.116 N/A ARG 550.A NH2 ASP 750.A OD2 no hydrogen 2.774 N/A GLN 551.A N GLN 551.A OE1 no hydrogen 2.972 N/A GLN 551.A NE2 ARG 544.A O no hydrogen 3.087 N/A LEU 553.A N ARG 550.A O no hydrogen 2.973 N/A ASN 554.A N ARG 550.A O no hydrogen 3.456 N/A CYS 555.A N GLN 551.A O no hydrogen 2.935 N/A CYS 555.A SG GLN 551.A O no hydrogen 3.472 N/A LEU 556.A N LEU 552.A O no hydrogen 3.028 N/A HIS 557.A N LEU 553.A O no hydrogen 3.099 N/A VAL 558.A N ASN 554.A O no hydrogen 2.987 N/A ILE 559.A N CYS 555.A O no hydrogen 3.031 N/A THR 560.A N LEU 556.A O no hydrogen 2.981 N/A THR 560.A OG1 LEU 556.A O no hydrogen 2.673 N/A THR 560.A OG1 TYR 751.A OH no hydrogen 2.614 N/A LEU 561.A N HIS 557.A O no hydrogen 2.916 N/A TYR 562.A N VAL 558.A O no hydrogen 3.019 N/A TYR 562.A OH ASP 608.A OD2 no hydrogen 2.714 N/A ASN 563.A N ILE 559.A O no hydrogen 2.834 N/A ASN 563.A ND2 GLN 718.A OE1 no hydrogen 2.848 N/A ARG 564.A N THR 560.A O no hydrogen 2.950 N/A ARG 564.A NE GLU 711.A OE2 no hydrogen 2.774 N/A ARG 564.A NH1 GLU 711.A OE1 no hydrogen 2.791 N/A ARG 564.A NH1 GLU 711.A OE2 no hydrogen 3.483 N/A ARG 564.A NH2 GLU 759.A OE2 no hydrogen 2.706 N/A ILE 565.A N LEU 561.A O no hydrogen 3.014 N/A LYS 566.A N TYR 562.A O no hydrogen 2.908 N/A LYS 566.A NZ ASP 608.A OD2 no hydrogen 2.772 N/A LYS 567.A N ASN 563.A O no hydrogen 2.915 N/A GLU 568.A N ARG 564.A O no hydrogen 3.052 N/A LYS 571.A N GLU 568.A O no hydrogen 3.279 N/A LYS 571.A NZ GLU 568.A OE1 no hydrogen 3.011 N/A ARG 576.A N ARG 614.A O no hydrogen 2.939 N/A ARG 576.A NH1 ASP 539.A OD1 no hydrogen 2.818 N/A ARG 576.A NH1 GLN 758.A OE1 no hydrogen 2.836 N/A ARG 576.A NH2 GLN 758.A OE1 no hydrogen 3.166 N/A ARG 576.A NH2 SER 762.A OG no hydrogen 2.836 N/A THR 577.A N LEU 537.A O no hydrogen 2.827 N/A THR 577.A OG1 SER 536.A OG no hydrogen 2.639 N/A VAL 578.A N ARG 616.A O no hydrogen 2.792 N/A MET 579.A N ASP 539.A O no hydrogen 2.689 N/A ILE 580.A N ILE 618.A O no hydrogen 3.042 N/A GLY 581.A N GLN 541.A O no hydrogen 2.960 N/A LYS 583.A NZ PHE 155.A O no hydrogen 2.644 N/A LYS 583.A NZ ASN 622.A OD1 no hydrogen 2.986 N/A ALA 584.A N GLN 164.A OE1 no hydrogen 3.132 N/A TYR 588.A N ALA 585.A O no hydrogen 2.969 N/A TYR 588.A OH GLU 547.A OE2 no hydrogen 2.734 N/A LYS 592.A N TYR 588.A O no hydrogen 3.138 N/A LYS 592.A NZ GLU 166.A OE1 no hydrogen 3.561 N/A LYS 592.A NZ GLU 166.A OE2 no hydrogen 2.492 N/A LYS 592.A NZ PRO 586.A O no hydrogen 3.356 N/A MET 593.A N HIS 589.A O no hydrogen 2.936 N/A ILE 594.A N MET 590.A O no hydrogen 2.946 N/A ILE 595.A N ALA 591.A O no hydrogen 3.188 N/A LYS 596.A N LYS 592.A O no hydrogen 3.193 N/A LYS 596.A NZ GLY 161.A O no hydrogen 2.777 N/A LEU 597.A N MET 593.A O no hydrogen 2.844 N/A ILE 598.A N ILE 594.A O no hydrogen 2.955 N/A THR 599.A N ILE 595.A O no hydrogen 3.084 N/A THR 599.A OG1 GLY 162.A O no hydrogen 3.259 N/A THR 599.A OG1 LYS 596.A O no hydrogen 2.931 N/A ALA 600.A N LYS 596.A O no hydrogen 2.919 N/A ILE 601.A N LEU 597.A O no hydrogen 2.869 N/A GLY 602.A N ILE 598.A O no hydrogen 3.042 N/A ASP 603.A N THR 599.A O no hydrogen 2.831 N/A VAL 604.A N ALA 600.A O no hydrogen 3.317 N/A VAL 605.A N ILE 601.A O no hydrogen 2.802 N/A ASN 606.A N GLY 602.A O no hydrogen 2.815 N/A ASN 606.A ND2 VAL 617.A O no hydrogen 2.782 N/A HIS 607.A ND1 ASP 603.A O no hydrogen 2.918 N/A ASP 608.A N VAL 605.A O no hydrogen 3.429 N/A VAL 610.A N ASP 608.A OD1 no hydrogen 2.950 N/A VAL 611.A N ASP 608.A O no hydrogen 3.107 N/A GLY 612.A N ASP 608.A O no hydrogen 3.463 N/A ARG 614.A N VAL 611.A O no hydrogen 3.383 N/A ARG 614.A NE VAL 611.A O no hydrogen 3.045 N/A ARG 614.A NH1 PRO 569.A O no hydrogen 2.987 N/A ARG 614.A NH2 PRO 569.A O no hydrogen 2.950 N/A ARG 614.A NH2 VAL 610.A O no hydrogen 2.831 N/A ARG 616.A N ARG 576.A O no hydrogen 3.172 N/A ARG 616.A NH1 LEU 615.A O no hydrogen 3.403 N/A VAL 617.A N ASN 606.A OD1 no hydrogen 2.851 N/A ILE 618.A N VAL 578.A O no hydrogen 2.901 N/A LEU 620.A N ILE 580.A O no hydrogen 2.756 N/A ASN 622.A N GLN 157.A OE1 no hydrogen 2.824 N/A ASN 622.A ND2 ASN 156.A OD1 no hydrogen 3.178 N/A ARG 624.A NH2 ASN 622.A O no hydrogen 2.868 N/A SER 626.A N ASP 117.A OD2 no hydrogen 2.885 N/A SER 626.A OG ASP 117.A OD1 no hydrogen 3.211 N/A SER 626.A OG ASP 117.A OD2 no hydrogen 3.515 N/A ALA 628.A N ARG 624.A O no hydrogen 2.920 N/A GLU 629.A N VAL 625.A O no hydrogen 3.034 N/A LYS 630.A N LEU 627.A O no hydrogen 2.936 N/A LYS 630.A NZ GLU 113.A OE1 no hydrogen 2.829 N/A LYS 630.A NZ GLU 113.A OE2 no hydrogen 3.197 N/A VAL 631.A N LEU 627.A O no hydrogen 2.932 N/A ILE 632.A N ALA 628.A O no hydrogen 3.011 N/A ALA 634.A N VAL 631.A O no hydrogen 2.969 N/A ALA 635.A N ILE 632.A O no hydrogen 3.174 N/A ASP 636.A N PHE 538.A O no hydrogen 2.963 N/A LEU 637.A N PHE 538.A O no hydrogen 2.970 N/A SER 638.A N LEU 661.A O no hydrogen 2.795 N/A GLU 639.A N VAL 540.A O no hydrogen 3.071 N/A GLN 640.A N ILE 663.A O no hydrogen 2.931 N/A GLN 640.A NE2 SER 638.A OG no hydrogen 2.777 N/A SER 642.A OG ASP 667.A OD1 no hydrogen 2.533 N/A THR 643.A N TYR 548.A O no hydrogen 3.408 N/A THR 643.A OG1 PHE 745.A O no hydrogen 2.674 N/A GLY 645.A N ASP 667.A OD2 no hydrogen 2.673 N/A THR 646.A N THR 643.A O no hydrogen 3.141 N/A THR 646.A N ASP 667.A OD1 no hydrogen 3.381 N/A THR 646.A OG1 THR 643.A O no hydrogen 2.683 N/A GLU 647.A N ASP 667.A OD1 no hydrogen 2.849 N/A SER 649.A OG VAL 430.A O no hydrogen 3.353 N/A SER 649.A OG ASN 459.A OD1 no hydrogen 3.512 N/A SER 649.A OG GLY 650.A O no hydrogen 2.784 N/A MET 656.A N ASN 653.A O no hydrogen 3.156 N/A LEU 657.A N MET 654.A O no hydrogen 3.051 N/A ASN 658.A N PHE 655.A O no hydrogen 3.274 N/A ASN 658.A ND2 TRP 466.A O no hydrogen 2.739 N/A ALA 660.A N PHE 655.A O no hydrogen 3.079 N/A LEU 661.A N ASP 636.A O no hydrogen 2.765 N/A ILE 663.A N SER 638.A O no hydrogen 2.983 N/A GLY 664.A N PHE 683.A O no hydrogen 2.975 N/A THR 665.A N GLN 640.A O no hydrogen 3.207 N/A THR 665.A OG1 SER 642.A O no hydrogen 2.624 N/A ASP 667.A N THR 665.A O no hydrogen 2.862 N/A ALA 669.A N SER 649.A O no hydrogen 2.837 N/A ASN 670.A N ASP 667.A O no hydrogen 3.053 N/A ASN 670.A ND2 GLN 640.A O no hydrogen 3.193 N/A ASN 670.A ND2 THR 665.A O no hydrogen 2.948 N/A MET 673.A N ALA 669.A O no hydrogen 2.856 N/A ALA 674.A N ASN 670.A O no hydrogen 2.890 N/A GLU 675.A N VAL 671.A O no hydrogen 3.055 N/A GLU 676.A N GLU 672.A O no hydrogen 2.835 N/A ALA 677.A N MET 673.A O no hydrogen 2.930 N/A GLY 678.A N ALA 674.A O no hydrogen 2.764 N/A ASN 681.A N GLY 678.A O no hydrogen 2.898 N/A ASN 681.A ND2 ALA 677.A O no hydrogen 2.953 N/A PHE 682.A N GLU 679.A O no hydrogen 3.260 N/A PHE 683.A N THR 662.A O no hydrogen 2.966 N/A PHE 685.A N GLY 664.A O no hydrogen 3.206 N/A GLY 686.A N GLU 753.A OE2 no hydrogen 2.854 N/A MET 687.A N ASP 750.A OD1 no hydrogen 2.865 N/A ARG 688.A N ASP 691.A OD1 no hydrogen 2.786 N/A ARG 688.A NH2 GLY 686.A O no hydrogen 2.789 N/A VAL 692.A N ARG 688.A O no hydrogen 3.109 N/A ASP 693.A N VAL 689.A O no hydrogen 3.041 N/A ARG 694.A N GLU 690.A O no hydrogen 2.940 N/A LEU 695.A N ASP 691.A O no hydrogen 3.031 N/A ASP 696.A N VAL 692.A O no hydrogen 2.968 N/A GLN 697.A N ASP 693.A O no hydrogen 3.146 N/A ARG 698.A N ARG 694.A O no hydrogen 3.297 N/A GLY 699.A N LEU 695.A O no hydrogen 2.763 N/A GLN 703.A NE2 ASP 707.A OD1 no hydrogen 2.961 N/A GLU 704.A N ASN 701.A O no hydrogen 3.282 N/A TYR 705.A N ALA 702.A O no hydrogen 2.973 N/A TYR 706.A N ALA 702.A O no hydrogen 3.171 N/A ASP 707.A N GLN 703.A O no hydrogen 2.765 N/A ARG 708.A N GLU 704.A O no hydrogen 3.211 N/A ARG 708.A N TYR 705.A O no hydrogen 3.177 N/A ILE 709.A N TYR 705.A O no hydrogen 2.963 N/A ARG 713.A N ILE 709.A O no hydrogen 3.022 N/A ARG 713.A NE TYR 706.A O no hydrogen 3.138 N/A ARG 713.A NH1 TYR 706.A O no hydrogen 3.546 N/A ARG 713.A NH1 ASP 707.A O no hydrogen 2.710 N/A GLN 714.A N PRO 710.A O no hydrogen 3.063 N/A ILE 715.A N GLU 711.A O no hydrogen 3.357 N/A ILE 716.A N LEU 712.A O no hydrogen 3.080 N/A GLU 717.A N ARG 713.A O no hydrogen 2.897 N/A GLN 718.A N GLN 714.A O no hydrogen 2.889 N/A GLN 718.A NE2 ASN 563.A OD1 no hydrogen 2.971 N/A LEU 719.A N ILE 715.A O no hydrogen 2.905 N/A SER 720.A N ILE 716.A O no hydrogen 2.903 N/A SER 720.A OG ILE 716.A O no hydrogen 3.049 N/A SER 721.A N GLU 717.A O no hydrogen 2.913 N/A SER 721.A OG GLU 717.A O no hydrogen 2.967 N/A SER 721.A OG GLN 718.A O no hydrogen 3.432 N/A PHE 723.A N GLN 718.A O no hydrogen 3.039 N/A SER 725.A N GLY 722.A O no hydrogen 3.209 N/A SER 725.A OG GLN 728.A O no hydrogen 2.961 N/A GLN 728.A N SER 725.A O no hydrogen 3.168 N/A LEU 731.A N GLN 728.A O no hydrogen 2.963 N/A LYS 733.A N ASP 730.A O no hydrogen 3.051 N/A VAL 736.A N PHE 732.A O no hydrogen 3.073 N/A ASN 737.A N LYS 733.A O no hydrogen 2.899 N/A MET 738.A N ASP 734.A O no hydrogen 3.014 N/A LEU 739.A N ILE 735.A O no hydrogen 2.978 N/A MET 740.A N VAL 736.A O no hydrogen 2.900 N/A HIS 741.A N ASN 737.A O no hydrogen 2.847 N/A HIS 742.A N MET 738.A O no hydrogen 2.971 N/A ARG 744.A NH1 GLU 357.A OE1 no hydrogen 3.528 N/A ARG 744.A NH1 GLU 357.A OE2 no hydrogen 2.646 N/A ARG 744.A NH2 GLU 357.A OE1 no hydrogen 3.056 N/A ARG 744.A NH2 GLU 357.A OE2 no hydrogen 3.520 N/A PHE 745.A N ASP 743.A OD1 no hydrogen 2.921 N/A LYS 746.A NZ ASP 696.A OD1 no hydrogen 2.666 N/A VAL 747.A N ASP 743.A OD2 no hydrogen 2.835 N/A TYR 751.A N PHE 748.A O no hydrogen 3.024 N/A TYR 751.A OH THR 560.A OG1 no hydrogen 2.614 N/A TYR 754.A N ASP 750.A O no hydrogen 2.998 N/A TYR 754.A OH GLU 639.A OE1 no hydrogen 3.389 N/A TYR 754.A OH GLU 639.A OE2 no hydrogen 2.754 N/A VAL 755.A N TYR 751.A O no hydrogen 2.992 N/A LYS 756.A N GLU 752.A O no hydrogen 3.089 N/A CYS 757.A N GLU 753.A O no hydrogen 2.924 N/A CYS 757.A SG ILE 684.A O no hydrogen 4.024 N/A GLN 758.A N TYR 754.A O no hydrogen 2.892 N/A GLN 758.A NE2 GLU 639.A OE1 no hydrogen 2.988 N/A GLN 758.A NE2 TYR 754.A OH no hydrogen 3.216 N/A GLU 759.A N VAL 755.A O no hydrogen 3.107 N/A ARG 760.A N LYS 756.A O no hydrogen 3.260 N/A VAL 761.A N CYS 757.A O no hydrogen 3.089 N/A SER 762.A N GLN 758.A O no hydrogen 3.087 N/A SER 762.A OG GLN 758.A O no hydrogen 3.393 N/A ALA 763.A N GLU 759.A O no hydrogen 2.942 N/A LEU 764.A N ARG 760.A O no hydrogen 3.090 N/A TYR 765.A N VAL 761.A O no hydrogen 3.039 N/A LYS 766.A N SER 762.A O no hydrogen 3.289 N/A ASN 767.A N LEU 764.A O no hydrogen 2.986 N/A ARG 769.A NH2 GLU 503.A OE1 no hydrogen 2.737 N/A GLU 770.A N ASN 767.A OD1 no hydrogen 3.366 N/A TRP 771.A N ASN 767.A O no hydrogen 2.914 N/A THR 772.A N PRO 768.A O no hydrogen 2.927 N/A THR 772.A OG1 PRO 768.A O no hydrogen 2.853 N/A ARG 773.A N ARG 769.A O no hydrogen 3.030 N/A ARG 773.A NE VAL 500.A O no hydrogen 3.254 N/A ARG 773.A NH1 ASP 501.A OD2 no hydrogen 2.885 N/A ARG 773.A NH2 GLU 770.A OE1 no hydrogen 3.493 N/A ARG 773.A NH2 GLU 770.A OE2 no hydrogen 2.763 N/A MET 774.A N GLU 770.A O no hydrogen 3.160 N/A VAL 775.A N TRP 771.A O no hydrogen 2.984 N/A ILE 776.A N THR 772.A O no hydrogen 2.866 N/A ARG 777.A N ARG 773.A O no hydrogen 3.097 N/A ARG 777.A NE ASN 681.A OD1 no hydrogen 3.251 N/A ASN 778.A N MET 774.A O no hydrogen 3.039 N/A ASN 778.A ND2 ASN 681.A O no hydrogen 3.013 N/A ASN 778.A ND2 MET 774.A O no hydrogen 3.001 N/A ILE 779.A N VAL 775.A O no hydrogen 2.963 N/A ALA 780.A N ILE 776.A O no hydrogen 2.904 N/A THR 781.A N ASN 778.A O no hydrogen 3.136 N/A THR 781.A OG1 ARG 777.A O no hydrogen 2.835 N/A THR 781.A OG1 ASN 778.A O no hydrogen 3.399 N/A SER 782.A N ILE 779.A O no hydrogen 3.175 N/A SER 782.A OG ILE 779.A O no hydrogen 2.729 N/A LYS 784.A NZ GLU 672.A OE1 no hydrogen 2.775 N/A PHE 785.A N SER 782.A O no hydrogen 2.973 N/A SER 786.A N GLY 783.A O no hydrogen 3.243 N/A SER 787.A N ILE 461.A O no hydrogen 2.870 N/A SER 787.A OG SER 135.A OG no hydrogen 2.652 N/A ASP 788.A N SER 786.A OG no hydrogen 3.090 N/A ARG 789.A N SER 786.A O no hydrogen 3.019 N/A ARG 789.A NE LYS 784.A O no hydrogen 2.706 N/A ARG 789.A NH1 THR 458.A O no hydrogen 3.077 N/A ARG 789.A NH1 ASN 459.A O no hydrogen 3.083 N/A ARG 789.A NH1 LYS 784.A O no hydrogen 2.828 N/A ARG 789.A NH2 THR 458.A O no hydrogen 2.874 N/A ARG 789.A NH2 GLN 793.A OE1 no hydrogen 2.881 N/A THR 790.A N SER 786.A O no hydrogen 3.397 N/A THR 790.A OG1 THR 458.A O no hydrogen 2.931 N/A ILE 791.A N SER 787.A O no hydrogen 2.842 N/A ALA 792.A N ASP 788.A O no hydrogen 3.048 N/A GLN 793.A N ARG 789.A O no hydrogen 3.070 N/A TYR 794.A N THR 790.A O no hydrogen 3.023 N/A ALA 795.A N ILE 791.A O no hydrogen 2.810 N/A ARG 796.A N ALA 792.A O no hydrogen 3.036 N/A ARG 796.A NE GLU 802.A OE1 no hydrogen 3.101 N/A ARG 796.A NH1 GLU 802.A OE1 no hydrogen 3.518 N/A GLU 797.A N GLN 793.A O no hydrogen 2.806 N/A ILE 798.A N TYR 794.A O no hydrogen 2.838 N/A TRP 799.A N TYR 794.A O no hydrogen 2.890 N/A TRP 799.A NE1 GLN 311.A OE1 no hydrogen 2.719 N/A VAL 801.A N ALA 795.A O no hydrogen 2.908 N/A SER 804.A N LEU 139.A O no hydrogen 2.770 N/A ARG 805.A NE THR 138.A O no hydrogen 3.120 N/A ARG 805.A NH1 THR 138.A O no hydrogen 2.921 N/A ARG 805.A NH1 TYR 222.A O no hydrogen 3.339 N/A ARG 805.A NH2 SER 488.A OG no hydrogen 3.097 N/A GLN 806.A N SER 804.A OG no hydrogen 3.250 N/A GLN 806.A NE2 SER 804.A OG no hydrogen 3.233 N/A ARG 807.A NH1 ARG 805.A O no hydrogen 2.987 N/A LEU 808.A N ASN 224.A O no hydrogen 3.005 N/A