Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wyi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ASP 253.A O no hydrogen 3.152 N/A THR 3.A OG1 ASP 253.A OD1 no hydrogen 3.340 N/A LYS 4.A N ASP 253.A O no hydrogen 3.447 N/A LYS 5.A N LYS 223.A O no hydrogen 2.837 N/A LYS 5.A NZ ASP 267.A OD2 no hydrogen 2.445 N/A VAL 6.A N GLU 255.A O no hydrogen 2.764 N/A HIS 7.A N LEU 225.A O no hydrogen 2.836 N/A HIS 7.A ND1 SER 259.A OG no hydrogen 3.026 N/A HIS 7.A NE2 HIS 224.A ND1 no hydrogen 3.315 N/A ILE 8.A N VAL 257.A O no hydrogen 2.924 N/A ILE 9.A N MET 227.A O no hydrogen 2.923 N/A SER 10.A OG ASN 229.A OD1 no hydrogen 2.877 N/A SER 10.A OG HIS 258.A NE2 no hydrogen 2.878 N/A HIS 11.A N ASN 229.A O no hydrogen 3.181 N/A HIS 11.A NE2 TYR 192.A O no hydrogen 2.787 N/A SER 12.A OG GLN 234.A O no hydrogen 2.730 N/A HIS 13.A N CYS 231.A O no hydrogen 3.021 N/A HIS 13.A ND1 ASP 52.A OD1 no hydrogen 2.865 N/A TRP 14.A N ASP 52.A OD2 no hydrogen 2.764 N/A ARG 16.A NE ASP 60.A OD2 no hydrogen 2.663 N/A ARG 16.A NH2 ASP 60.A OD1 no hydrogen 2.839 N/A ARG 16.A NH2 ASP 60.A OD2 no hydrogen 3.408 N/A TRP 18.A NE1 TYR 569.A OH no hydrogen 2.781 N/A MET 20.A N HIS 25.A NE2 no hydrogen 3.159 N/A HIS 25.A N ALA 21.A O no hydrogen 3.332 N/A HIS 26.A N TYR 22.A O no hydrogen 2.583 N/A HIS 26.A ND1 GLU 23.A OE1 no hydrogen 2.733 N/A HIS 26.A NE2 ASP 60.A O no hydrogen 2.744 N/A MET 27.A N GLU 23.A O no hydrogen 2.836 N/A ARG 28.A NH1 GLN 24.A O no hydrogen 2.875 N/A ARG 28.A NH1 GLN 24.A OE1 no hydrogen 2.985 N/A LEU 29.A N HIS 25.A O no hydrogen 3.035 N/A LEU 29.A N HIS 26.A O no hydrogen 2.979 N/A ILE 30.A N HIS 26.A O no hydrogen 3.106 N/A ASN 31.A N MET 27.A O no hydrogen 3.302 N/A LEU 32.A N ARG 28.A O no hydrogen 3.112 N/A ILE 33.A N LEU 29.A O no hydrogen 2.983 N/A ASP 34.A N ILE 30.A O no hydrogen 2.916 N/A ASP 35.A N ASN 31.A O no hydrogen 2.816 N/A LEU 36.A N LEU 32.A O no hydrogen 2.896 N/A LEU 37.A N ILE 33.A O no hydrogen 2.945 N/A GLU 38.A N ASP 34.A O no hydrogen 3.170 N/A VAL 39.A N ASP 35.A O no hydrogen 2.963 N/A PHE 40.A N LEU 36.A O no hydrogen 2.907 N/A GLN 41.A N GLU 38.A O no hydrogen 3.112 N/A THR 42.A N GLU 38.A O no hydrogen 3.122 N/A THR 42.A OG1 GLU 38.A O no hydrogen 3.357 N/A THR 42.A OG1 VAL 39.A O no hydrogen 3.558 N/A ASP 43.A N VAL 39.A O no hydrogen 2.987 N/A PHE 46.A N ASP 43.A O no hydrogen 3.084 N/A HIS 47.A N HIS 258.A ND1 no hydrogen 3.157 N/A HIS 47.A ND1 SER 48.A OG no hydrogen 2.819 N/A SER 48.A OG HIS 47.A ND1 no hydrogen 2.819 N/A PHE 49.A N LYS 80.A O no hydrogen 2.872 N/A HIS 50.A N SER 10.A O no hydrogen 2.790 N/A LEU 51.A N ARG 82.A O no hydrogen 2.953 N/A GLN 54.A N LEU 51.A O no hydrogen 3.374 N/A GLN 54.A NE2 TRP 14.A O no hydrogen 2.942 N/A GLN 54.A NE2 ASP 52.A OD2 no hydrogen 2.979 N/A THR 55.A N PHE 86.A O no hydrogen 2.738 N/A THR 55.A OG1 PHE 86.A O no hydrogen 3.569 N/A THR 55.A OG1 ASP 110.A OD2 no hydrogen 2.643 N/A ILE 56.A N TYR 87.A O no hydrogen 3.148 N/A LEU 58.A N THR 55.A O no hydrogen 2.931 N/A ASP 60.A N ILE 56.A O no hydrogen 2.803 N/A TYR 61.A N ILE 57.A O no hydrogen 2.989 N/A TYR 61.A OH ASP 34.A OD1 no hydrogen 2.734 N/A LEU 62.A N LEU 58.A O no hydrogen 3.001 N/A LYS 63.A N ASP 59.A O no hydrogen 2.978 N/A VAL 64.A N TYR 61.A O no hydrogen 3.107 N/A ARG 65.A N TYR 61.A O no hydrogen 2.899 N/A ARG 65.A NE ASP 34.A OD1 no hydrogen 3.095 N/A ARG 65.A NE ASP 34.A OD2 no hydrogen 3.382 N/A ARG 65.A NH2 ASP 34.A OD2 no hydrogen 2.904 N/A GLU 67.A N GLU 67.A OE1 no hydrogen 2.844 N/A ARG 68.A N ARG 65.A O no hydrogen 3.068 N/A GLU 69.A N PRO 66.A O no hydrogen 3.221 N/A GLU 71.A N GLU 71.A OE1 no hydrogen 2.770 N/A ILE 72.A N ARG 68.A O no hydrogen 3.025 N/A ARG 73.A N GLU 69.A O no hydrogen 2.785 N/A ARG 73.A NH1 ARG 113.A O no hydrogen 2.817 N/A ARG 73.A NH2 GLU 69.A OE1 no hydrogen 2.588 N/A GLN 74.A N PRO 70.A O no hydrogen 2.866 N/A ALA 75.A N GLU 71.A O no hydrogen 3.053 N/A ILE 76.A N ILE 72.A O no hydrogen 2.961 N/A ALA 77.A N ARG 73.A O no hydrogen 2.859 N/A SER 78.A N GLN 74.A O no hydrogen 3.035 N/A SER 78.A OG GLN 74.A O no hydrogen 3.327 N/A SER 78.A OG ALA 75.A O no hydrogen 3.359 N/A GLY 79.A N ILE 76.A O no hydrogen 3.230 N/A LYS 80.A NZ PHE 40.A O no hydrogen 3.223 N/A LEU 81.A N ALA 75.A O no hydrogen 3.109 N/A ARG 82.A N PHE 49.A O no hydrogen 2.943 N/A ARG 82.A NE GLY 79.A O no hydrogen 2.712 N/A PHE 86.A N GLY 53.A O no hydrogen 2.996 N/A TYR 87.A N ASN 103.A O no hydrogen 3.239 N/A TYR 87.A N ASN 103.A OD1 no hydrogen 2.967 N/A ILE 88.A N ASN 103.A OD1 no hydrogen 2.840 N/A GLN 90.A N GLN 90.A OE1 no hydrogen 2.867 N/A GLN 90.A NE2 ASN 100.A OD1 no hydrogen 2.742 N/A LEU 94.A N ASP 91.A OD2 no hydrogen 2.761 N/A THR 95.A OG1 ASP 91.A O no hydrogen 2.890 N/A THR 95.A OG1 ASP 92.A O no hydrogen 3.419 N/A SER 96.A OG SER 99.A OG no hydrogen 2.569 N/A SER 96.A OG GLU 316.A OE2 no hydrogen 2.545 N/A SER 97.A N GLU 714.A OE1 no hydrogen 3.040 N/A SER 97.A OG GLU 714.A OE2 no hydrogen 2.928 N/A SER 99.A N SER 96.A OG no hydrogen 2.896 N/A SER 99.A OG SER 96.A OG no hydrogen 2.569 N/A ASN 100.A N SER 96.A O no hydrogen 3.133 N/A ASN 100.A N SER 97.A O no hydrogen 2.979 N/A ASN 100.A ND2 ASP 92.A O no hydrogen 3.186 N/A ASN 100.A ND2 SER 96.A O no hydrogen 3.132 N/A VAL 101.A N SER 97.A O no hydrogen 3.417 N/A ARG 102.A N GLU 98.A O no hydrogen 2.718 N/A ARG 102.A NH1 GLU 98.A OE1 no hydrogen 2.524 N/A ARG 102.A NH2 GLU 320.A OE1 no hydrogen 2.567 N/A ASN 103.A N SER 99.A O no hydrogen 2.968 N/A ASN 103.A ND2 ILE 88.A O no hydrogen 2.842 N/A LEU 105.A N VAL 101.A O no hydrogen 2.824 N/A ILE 106.A N ARG 102.A O no hydrogen 2.876 N/A GLY 107.A N ASN 103.A O no hydrogen 3.079 N/A LYS 108.A N MET 104.A O no hydrogen 2.864 N/A GLU 109.A N LEU 105.A O no hydrogen 3.108 N/A ASP 110.A N ILE 106.A O no hydrogen 2.881 N/A CYS 111.A N GLY 107.A O no hydrogen 2.892 N/A CYS 111.A SG GLY 107.A O no hydrogen 3.359 N/A ASP 112.A N LYS 108.A O no hydrogen 2.775 N/A ARG 113.A N GLU 109.A O no hydrogen 3.024 N/A ARG 113.A NH2 ASP 59.A OD1 no hydrogen 3.142 N/A TRP 114.A N ASP 110.A O no hydrogen 3.049 N/A GLY 115.A N CYS 111.A O no hydrogen 2.723 N/A ALA 116.A N CYS 111.A O no hydrogen 3.224 N/A SER 117.A OG VAL 118.A O no hydrogen 3.510 N/A VAL 118.A N ILE 83.A O no hydrogen 2.928 N/A LEU 120.A N VAL 118.A O no hydrogen 2.895 N/A GLY 121.A N ALA 144.A O no hydrogen 2.806 N/A PHE 123.A N ALA 146.A O no hydrogen 2.782 N/A GLY 128.A N THR 126.A O no hydrogen 2.893 N/A ASN 129.A N ILE 283.A O no hydrogen 2.838 N/A MET 130.A N ASP 92.A OD2 no hydrogen 2.831 N/A GLN 132.A NE2 PHE 690.A O no hydrogen 2.783 N/A GLN 132.A NE2 ALA 886.A O no hydrogen 2.992 N/A THR 133.A N MET 130.A O no hydrogen 3.190 N/A THR 133.A OG1 MET 130.A O no hydrogen 2.649 N/A GLN 135.A NE2 GLN 132.A OE1 no hydrogen 2.739 N/A GLN 135.A NE2 ALA 886.A O no hydrogen 2.767 N/A LEU 136.A N GLN 132.A O no hydrogen 2.972 N/A MET 137.A N THR 133.A O no hydrogen 2.890 N/A LEU 138.A N PRO 134.A O no hydrogen 2.920 N/A LYS 139.A N GLN 135.A O no hydrogen 2.946 N/A LYS 139.A NZ GLN 135.A OE1 no hydrogen 3.276 N/A LYS 139.A NZ ILE 888.A O no hydrogen 3.200 N/A ALA 140.A N MET 137.A O no hydrogen 2.961 N/A GLY 141.A N LEU 138.A O no hydrogen 2.893 N/A LEU 142.A N MET 137.A O no hydrogen 2.800 N/A ALA 145.A N LEU 184.A O no hydrogen 3.070 N/A ALA 146.A N GLY 121.A O no hydrogen 2.762 N/A PHE 147.A N LEU 186.A O no hydrogen 3.007 N/A ARG 149.A NE ASP 125.A O no hydrogen 3.019 N/A ARG 149.A NE ASP 125.A OD1 no hydrogen 3.186 N/A ARG 149.A NH2 ASP 125.A OD1 no hydrogen 2.905 N/A ARG 152.A N TYR 166.A O no hydrogen 3.112 N/A ARG 152.A NH1 GLU 164.A OE1 no hydrogen 3.188 N/A THR 154.A N SER 168.A O no hydrogen 2.807 N/A THR 154.A OG1 SER 168.A O no hydrogen 3.450 N/A SER 163.A N ASP 161.A OD1 no hydrogen 2.958 N/A TYR 166.A N GLU 287.A OE1 no hydrogen 2.915 N/A SER 167.A OG GLU 164.A OE2 no hydrogen 2.879 N/A SER 168.A N ARG 152.A O no hydrogen 2.997 N/A SER 168.A OG PHE 170.A O no hydrogen 2.614 N/A SER 168.A OG SER 277.A OG no hydrogen 3.183 N/A GLN 169.A N SER 277.A OG no hydrogen 3.384 N/A GLN 169.A NE2 PHE 156.A O no hydrogen 3.628 N/A GLN 169.A NE2 ASN 158.A O no hydrogen 3.562 N/A PHE 170.A N SER 168.A OG no hydrogen 3.179 N/A SER 171.A N PHE 219.A O no hydrogen 2.816 N/A SER 171.A OG GLU 172.A OE1 no hydrogen 3.469 N/A SER 171.A OG GLU 172.A OE2 no hydrogen 2.884 N/A ILE 173.A N GLY 185.A O no hydrogen 2.767 N/A SER 174.A N SER 277.A O no hydrogen 3.066 N/A TRP 175.A N ILE 183.A O no hydrogen 3.085 N/A TRP 175.A NE1 GLY 281.A O no hydrogen 3.046 N/A GLN 176.A N VAL 279.A O no hydrogen 2.909 N/A GLY 177.A N SER 181.A O no hydrogen 2.889 N/A ASN 180.A N GLY 177.A O no hydrogen 3.091 N/A SER 181.A N ASP 179.A OD1 no hydrogen 3.173 N/A SER 181.A OG ASP 179.A OD1 no hydrogen 3.055 N/A SER 181.A OG ASP 179.A OD2 no hydrogen 2.778 N/A ILE 183.A N TRP 175.A O no hydrogen 3.024 N/A LEU 184.A N GLN 143.A O no hydrogen 3.000 N/A GLY 185.A N ILE 173.A O no hydrogen 2.835 N/A LEU 186.A N ALA 145.A O no hydrogen 2.874 N/A LEU 187.A N SER 171.A O no hydrogen 2.923 N/A PHE 188.A N PHE 147.A O no hydrogen 3.115 N/A ALA 189.A N LEU 187.A O no hydrogen 2.842 N/A ASN 190.A ND2 ASP 215.A O no hydrogen 2.977 N/A TRP 191.A N PHE 188.A O no hydrogen 2.894 N/A TYR 192.A OH ASP 232.A OD1 no hydrogen 2.815 N/A ASN 194.A N TRP 191.A O no hydrogen 3.236 N/A ASN 194.A ND2 LEU 226.A O no hydrogen 2.788 N/A GLY 195.A N MET 228.A O no hydrogen 2.911 N/A ASN 196.A N SER 193.A O no hydrogen 3.048 N/A ASN 196.A ND2 GLN 234.A OE1 no hydrogen 3.307 N/A ILE 198.A N GLN 237.A OE1 no hydrogen 3.009 N/A THR 201.A OG1 GLU 204.A OE1 no hydrogen 2.920 N/A GLU 204.A N GLU 204.A OE1 no hydrogen 2.824 N/A ALA 205.A N THR 201.A O no hydrogen 2.851 N/A ARG 206.A N GLU 202.A O no hydrogen 2.782 N/A LEU 207.A N ALA 203.A O no hydrogen 3.329 N/A PHE 208.A N GLU 204.A O no hydrogen 3.032 N/A TRP 209.A N ALA 205.A O no hydrogen 2.889 N/A ASP 210.A N ARG 206.A O no hydrogen 2.970 N/A LYS 211.A NZ ASP 215.A OD2 no hydrogen 3.159 N/A LYS 212.A N PHE 208.A O no hydrogen 2.959 N/A LYS 212.A NZ ASN 194.A O no hydrogen 3.025 N/A LEU 213.A N TRP 209.A O no hydrogen 2.888 N/A ASP 215.A N LYS 211.A O no hydrogen 2.866 N/A ALA 216.A N LYS 212.A O no hydrogen 2.994 N/A GLU 217.A N LEU 213.A O no hydrogen 2.845 N/A ARG 218.A N ALA 214.A O no hydrogen 3.119 N/A ARG 218.A NH1 ASP 215.A OD1 no hydrogen 3.546 N/A ARG 218.A NH2 ASP 215.A OD1 no hydrogen 2.924 N/A PHE 219.A N ALA 216.A O no hydrogen 3.089 N/A ALA 220.A N ALA 216.A O no hydrogen 3.039 N/A SER 221.A N GLU 172.A OE1 no hydrogen 2.936 N/A SER 221.A OG GLU 172.A OE1 no hydrogen 2.698 N/A HIS 224.A N THR 222.A OG1 no hydrogen 2.991 N/A HIS 224.A NE2 ASP 271.A OD2 no hydrogen 2.891 N/A LEU 225.A N LYS 5.A O no hydrogen 2.859 N/A MET 227.A N HIS 7.A O no hydrogen 2.824 N/A MET 228.A N ASN 194.A OD1 no hydrogen 2.671 N/A ASN 229.A N ILE 9.A O no hydrogen 2.782 N/A ASN 229.A ND2 GLY 195.A O no hydrogen 2.823 N/A ASN 229.A ND2 GLN 237.A OE1 no hydrogen 2.960 N/A HIS 233.A N HIS 13.A O no hydrogen 2.822 N/A HIS 233.A NE2 ASP 15.A O no hydrogen 2.934 N/A GLN 234.A N CYS 231.A O no hydrogen 3.180 N/A GLN 234.A NE2 GLU 197.A OE2 no hydrogen 3.016 N/A GLN 237.A NE2 ILE 198.A O no hydrogen 2.975 N/A GLN 237.A NE2 ASP 239.A OD1 no hydrogen 3.155 N/A VAL 240.A N GLN 237.A O no hydrogen 3.322 N/A THR 241.A OG1 ASP 43.A OD1 no hydrogen 3.532 N/A THR 241.A OG1 ASP 43.A OD2 no hydrogen 2.710 N/A ALA 243.A N ASP 239.A O no hydrogen 3.086 N/A ILE 244.A N VAL 240.A O no hydrogen 2.807 N/A ALA 245.A N THR 241.A O no hydrogen 2.945 N/A LEU 246.A N LYS 242.A O no hydrogen 3.064 N/A ALA 247.A N ALA 243.A O no hydrogen 3.127 N/A ASN 248.A N ILE 244.A O no hydrogen 2.980 N/A ASN 248.A ND2 PHE 256.A O no hydrogen 2.931 N/A GLN 249.A N ALA 245.A O no hydrogen 3.170 N/A LEU 250.A N LEU 246.A O no hydrogen 3.007 N/A LEU 250.A N ALA 247.A O no hydrogen 3.255 N/A TYR 251.A N ALA 247.A O no hydrogen 3.099 N/A TYR 251.A OH ASP 210.A OD1 no hydrogen 2.777 N/A TYR 254.A N TYR 251.A O no hydrogen 3.042 N/A TYR 254.A OH GLU 217.A OE2 no hydrogen 2.403 N/A GLU 255.A N LYS 4.A O no hydrogen 2.823 N/A PHE 256.A N ASN 248.A OD1 no hydrogen 2.882 N/A VAL 257.A N VAL 6.A O no hydrogen 2.920 N/A HIS 258.A NE2 SER 10.A OG no hydrogen 2.878 N/A SER 259.A N ILE 8.A O no hydrogen 2.778 N/A SER 259.A OG HIS 7.A ND1 no hydrogen 3.026 N/A SER 259.A OG CYS 260.A O no hydrogen 3.510 N/A TYR 264.A N CYS 260.A O no hydrogen 3.077 N/A TYR 264.A OH HIS 224.A O no hydrogen 3.276 N/A LEU 265.A N PHE 261.A O no hydrogen 2.738 N/A ALA 266.A N GLU 262.A O no hydrogen 3.071 N/A ASP 267.A N ASP 263.A O no hydrogen 3.048 N/A LEU 268.A N TYR 264.A O no hydrogen 3.067 N/A ALA 269.A N LEU 265.A O no hydrogen 3.036 N/A ASP 271.A N ASP 267.A O no hydrogen 3.345 N/A SER 277.A OG SER 168.A OG no hydrogen 3.183 N/A VAL 279.A N SER 174.A O no hydrogen 2.883 N/A GLN 280.A NE2 GLN 176.A OE1 no hydrogen 2.785 N/A GLY 281.A N GLN 176.A O no hydrogen 2.918 N/A ILE 283.A N ASN 129.A O no hydrogen 3.048 N/A THR 284.A N GLN 286.A OE1 no hydrogen 2.952 N/A GLN 286.A N GLN 286.A OE1 no hydrogen 2.711 N/A GLN 286.A NE2 GLU 282.A O no hydrogen 3.136 N/A THR 288.A OG1 SER 285.A O no hydrogen 2.783 N/A GLY 290.A N THR 288.A OG1 no hydrogen 3.318 N/A TRP 291.A N ASP 289.A OD1 no hydrogen 2.814 N/A TYR 292.A OH ASP 626.A OD1 no hydrogen 2.969 N/A TYR 292.A OH ASP 626.A OD2 no hydrogen 2.961 N/A ALA 295.A N THR 293.A OG1 no hydrogen 3.213 N/A ASN 296.A ND2 GLU 735.A OE1 no hydrogen 3.067 N/A THR 297.A N LEU 294.A O no hydrogen 3.038 N/A THR 297.A OG1 LEU 294.A O no hydrogen 2.887 N/A ALA 298.A N ALA 295.A O no hydrogen 2.889 N/A SER 299.A N ASN 296.A O no hydrogen 3.035 N/A SER 299.A OG ASN 296.A O no hydrogen 3.246 N/A SER 299.A OG GLU 735.A OE1 no hydrogen 2.670 N/A ALA 300.A N ASN 296.A O no hydrogen 3.273 N/A ALA 300.A N THR 297.A O no hydrogen 3.339 N/A ARG 301.A NE TYR 303.A OH no hydrogen 3.030 N/A ARG 301.A NH1 ASP 360.A OD1 no hydrogen 3.369 N/A ARG 301.A NH1 GLU 568.A OE2 no hydrogen 2.538 N/A ARG 301.A NH2 TYR 303.A OH no hydrogen 3.318 N/A ARG 301.A NH2 ASP 360.A OD1 no hydrogen 3.169 N/A LEU 304.A N ARG 301.A O no hydrogen 2.835 N/A LYS 305.A NZ THR 297.A O no hydrogen 2.857 N/A LYS 305.A NZ ALA 300.A O no hydrogen 2.817 N/A LYS 305.A NZ ILE 354.A O no hydrogen 2.779 N/A GLN 306.A N ILE 302.A O no hydrogen 2.897 N/A GLN 306.A NE2 SER 774.A O no hydrogen 2.716 N/A ALA 307.A N TYR 303.A O no hydrogen 2.981 N/A ASN 308.A N LEU 304.A O no hydrogen 2.911 N/A THR 309.A N LYS 305.A O no hydrogen 2.932 N/A THR 309.A OG1 LYS 305.A O no hydrogen 3.006 N/A ARG 310.A N GLN 306.A O no hydrogen 2.960 N/A VAL 311.A N ALA 307.A O no hydrogen 2.992 N/A SER 312.A N ASN 308.A O no hydrogen 2.908 N/A SER 312.A OG ASN 308.A O no hydrogen 2.757 N/A ARG 313.A N THR 309.A O no hydrogen 2.987 N/A ARG 313.A NE ASN 317.A OD1 no hydrogen 2.736 N/A ARG 313.A NH1 GLU 316.A OE1 no hydrogen 2.835 N/A ARG 313.A NH2 GLN 798.A OE1 no hydrogen 2.929 N/A GLN 314.A N ARG 310.A O no hydrogen 3.033 N/A GLN 314.A NE2 THR 319.A OG1 no hydrogen 2.935 N/A LEU 315.A N VAL 311.A O no hydrogen 2.913 N/A GLU 316.A N SER 312.A O no hydrogen 2.835 N/A ASN 317.A N ARG 313.A O no hydrogen 2.784 N/A ILE 318.A N GLN 314.A O no hydrogen 3.355 N/A THR 319.A N GLN 314.A O no hydrogen 2.864 N/A THR 319.A OG1 GLN 314.A O no hydrogen 3.134 N/A THR 319.A OG1 GLY 377.A O no hydrogen 2.597 N/A GLU 320.A N LEU 315.A O no hydrogen 3.138 N/A LEU 322.A N ILE 318.A O no hydrogen 3.146 N/A ALA 323.A N THR 319.A O no hydrogen 2.808 N/A ALA 324.A N GLU 320.A O no hydrogen 2.697 N/A MET 325.A N PRO 321.A O no hydrogen 3.033 N/A ALA 326.A N LEU 322.A O no hydrogen 2.917 N/A TYR 327.A N ALA 323.A O no hydrogen 3.233 N/A GLU 328.A N MET 325.A O no hydrogen 3.073 N/A VAL 329.A N ALA 326.A O no hydrogen 2.830 N/A THR 330.A N ALA 326.A O no hydrogen 2.908 N/A THR 330.A OG1 ALA 326.A O no hydrogen 3.519 N/A SER 331.A N TYR 327.A O no hydrogen 2.725 N/A THR 332.A N THR 330.A OG1 no hydrogen 3.137 N/A HIS 335.A N TYR 333.A O no hydrogen 2.869 N/A HIS 335.A NE2 ASN 839.A OD1 no hydrogen 2.824 N/A GLN 337.A N GLN 337.A OE1 no hydrogen 2.894 N/A LEU 338.A N PRO 334.A O no hydrogen 3.009 N/A ARG 339.A N HIS 335.A O no hydrogen 2.852 N/A ARG 339.A NE GLU 109.A OE1 no hydrogen 3.182 N/A ARG 339.A NE GLU 109.A OE2 no hydrogen 3.413 N/A ARG 339.A NH1 ASP 336.A OD1 no hydrogen 2.962 N/A ARG 339.A NH2 GLU 109.A OE2 no hydrogen 3.312 N/A ARG 339.A NH2 ASP 336.A OD1 no hydrogen 3.494 N/A TYR 340.A N ASP 336.A O no hydrogen 2.991 N/A ALA 341.A N GLN 337.A O no hydrogen 2.934 N/A TRP 342.A N LEU 338.A O no hydrogen 2.875 N/A TRP 342.A NE1 GLU 320.A OE2 no hydrogen 2.894 N/A LYS 343.A N ARG 339.A O no hydrogen 2.918 N/A LYS 343.A NZ ASP 59.A OD2 no hydrogen 2.787 N/A LYS 343.A NZ ASP 110.A OD1 no hydrogen 3.043 N/A LYS 343.A NZ ASP 110.A OD2 no hydrogen 3.406 N/A THR 344.A N TYR 340.A O no hydrogen 3.080 N/A THR 344.A OG1 TYR 340.A O no hydrogen 2.658 N/A LEU 345.A N ALA 341.A O no hydrogen 2.839 N/A MET 346.A N TRP 342.A O no hydrogen 2.814 N/A GLN 347.A N LYS 343.A O no hydrogen 3.069 N/A GLN 347.A NE2 TYR 87.A OH no hydrogen 3.483 N/A GLN 347.A NE2 LYS 343.A O no hydrogen 3.162 N/A ASN 348.A N LEU 345.A O no hydrogen 2.920 N/A ASN 348.A ND2 MET 366.A O no hydrogen 2.875 N/A HIS 349.A N MET 346.A O no hydrogen 2.772 N/A HIS 349.A NE2 ASN 308.A OD1 no hydrogen 2.824 N/A HIS 351.A N LEU 89.A O no hydrogen 2.969 N/A HIS 351.A ND1 LEU 89.A O no hydrogen 3.139 N/A SER 353.A N PRO 350.A O no hydrogen 2.845 N/A SER 353.A OG GLU 17.A OE2 no hydrogen 2.697 N/A ILE 354.A N PRO 350.A O no hydrogen 3.176 N/A CYS 355.A N HIS 351.A O no hydrogen 2.873 N/A CYS 355.A SG ASP 91.A OD1 no hydrogen 3.327 N/A CYS 355.A SG THR 297.A OG1 no hydrogen 3.766 N/A GLY 356.A N SER 353.A O no hydrogen 2.997 N/A CYS 357.A SG ASP 352.A O no hydrogen 3.911 N/A CYS 357.A SG ASP 352.A OD1 no hydrogen 3.611 N/A SER 358.A N HIS 363.A NE2 no hydrogen 3.024 N/A SER 358.A OG ASP 352.A O no hydrogen 2.788 N/A VAL 359.A N TRP 18.A O no hydrogen 3.052 N/A HIS 363.A N VAL 359.A O no hydrogen 3.433 N/A ARG 364.A N ASP 360.A O no hydrogen 3.105 N/A ARG 364.A NH1 GLU 766.A OE1 no hydrogen 2.819 N/A GLU 365.A N SER 361.A O no hydrogen 3.033 N/A MET 366.A N VAL 362.A O no hydrogen 2.994 N/A MET 367.A N HIS 363.A O no hydrogen 3.202 N/A THR 368.A N ARG 364.A O no hydrogen 3.444 N/A ARG 369.A N GLU 365.A O no hydrogen 3.077 N/A ARG 369.A NH1 GLU 17.A OE2 no hydrogen 2.968 N/A ARG 369.A NH1 ASN 348.A OD1 no hydrogen 2.867 N/A ARG 369.A NH2 GLU 17.A OE1 no hydrogen 2.902 N/A PHE 370.A N MET 366.A O no hydrogen 2.827 N/A GLU 371.A N MET 367.A O no hydrogen 3.028 N/A LYS 372.A N THR 368.A O no hydrogen 2.907 N/A ALA 373.A N ARG 369.A O no hydrogen 2.921 N/A TYR 374.A N PHE 370.A O no hydrogen 2.914 N/A GLU 375.A N GLU 371.A O no hydrogen 2.948 N/A VAL 376.A N LYS 372.A O no hydrogen 3.245 N/A GLY 377.A N ALA 373.A O no hydrogen 3.035 N/A HIS 378.A N TYR 374.A O no hydrogen 2.707 N/A TYR 379.A N GLU 375.A O no hydrogen 2.774 N/A LEU 380.A N VAL 376.A O no hydrogen 3.061 N/A ALA 381.A N GLY 377.A O no hydrogen 2.921 N/A LYS 382.A N HIS 378.A O no hydrogen 3.139 N/A GLU 383.A N TYR 379.A O no hydrogen 3.078 N/A ALA 384.A N LEU 380.A O no hydrogen 2.983 N/A ALA 385.A N ALA 381.A O no hydrogen 3.011 N/A LYS 386.A N LYS 382.A O no hydrogen 3.104 N/A GLN 387.A N GLU 383.A O no hydrogen 2.958 N/A ILE 388.A N ALA 384.A O no hydrogen 3.015 N/A ALA 389.A N ALA 385.A O no hydrogen 3.001 N/A ASP 390.A N LYS 386.A O no hydrogen 2.770 N/A ALA 391.A N ILE 388.A O no hydrogen 2.996 N/A ILE 392.A N ALA 389.A O no hydrogen 3.202 N/A ASP 393.A N LEU 813.A O no hydrogen 2.945 N/A THR 394.A N HIS 809.A O no hydrogen 2.940 N/A THR 394.A OG1 ASN 807.A O no hydrogen 2.600 N/A THR 394.A OG1 HIS 809.A O no hydrogen 3.516 N/A ARG 395.A N ASP 393.A OD1 no hydrogen 3.283 N/A ARG 395.A NE ASP 393.A OD1 no hydrogen 2.637 N/A ARG 395.A NH2 ASP 393.A OD1 no hydrogen 3.529 N/A ARG 395.A NH2 ASP 393.A OD2 no hydrogen 2.949 N/A PHE 397.A N THR 394.A O no hydrogen 3.292 N/A SER 401.A N PRO 398.A O no hydrogen 2.922 N/A SER 401.A OG PRO 398.A O no hydrogen 2.741 N/A GLN 402.A N LEU 510.A O no hydrogen 2.667 N/A PHE 404.A N LEU 508.A O no hydrogen 2.739 N/A VAL 405.A N THR 804.A O no hydrogen 2.865 N/A LEU 406.A N LYS 506.A O no hydrogen 2.920 N/A PHE 407.A N ILE 802.A O no hydrogen 2.714 N/A ASN 408.A N SER 504.A O no hydrogen 2.906 N/A ASN 408.A ND2 HIS 412.A O no hydrogen 3.006 N/A ASN 408.A ND2 LEU 500.A O no hydrogen 3.087 N/A ASN 408.A ND2 PRO 501.A O no hydrogen 2.908 N/A THR 409.A OG1 ASN 317.A O no hydrogen 2.545 N/A SER 410.A N ASN 408.A OD1 no hydrogen 3.029 N/A GLY 411.A N GLU 796.A OE2 no hydrogen 3.177 N/A HIS 412.A N GLU 796.A OE1 no hydrogen 3.039 N/A HIS 412.A ND1 GLU 796.A OE2 no hydrogen 2.727 N/A HIS 412.A NE2 ASN 824.A O no hydrogen 2.794 N/A LYS 414.A N LEU 500.A O no hydrogen 2.770 N/A LYS 414.A NZ ASN 408.A OD1 no hydrogen 3.431 N/A LYS 414.A NZ SER 410.A OG no hydrogen 2.882 N/A LYS 414.A NZ GLU 796.A O no hydrogen 3.412 N/A LYS 414.A NZ VAL 799.A O no hydrogen 2.852 N/A THR 415.A OG1 THR 499.A OG1 no hydrogen 2.763 N/A SER 416.A N ILE 498.A O no hydrogen 3.093 N/A VAL 417.A N GLU 650.A OE1 no hydrogen 3.276 N/A VAL 417.A N GLU 650.A OE2 no hydrogen 3.374 N/A ALA 418.A N LEU 496.A O no hydrogen 2.804 N/A LEU 420.A N LEU 494.A O no hydrogen 2.785 N/A LEU 422.A N VAL 492.A O no hydrogen 2.875 N/A THR 423.A N GLN 805.A OE1 no hydrogen 2.809 N/A TRP 424.A N ILE 490.A O no hydrogen 2.807 N/A TRP 424.A NE1 TYR 444.A OH no hydrogen 2.876 N/A LYS 426.A NZ ASP 477.A OD2 no hydrogen 2.751 N/A LYS 426.A NZ TYR 487.A OH no hydrogen 3.546 N/A TYR 427.A N PHE 488.A O no hydrogen 2.698 N/A PHE 429.A N PRO 486.A O no hydrogen 3.312 N/A ARG 432.A N PHE 429.A O no hydrogen 3.138 N/A ARG 432.A NH1 GLU 440.A OE1 no hydrogen 2.460 N/A ARG 432.A NH2 GLU 440.A OE1 no hydrogen 2.734 N/A GLU 436.A N PHE 433.A O no hydrogen 2.899 N/A VAL 437.A N PHE 433.A O no hydrogen 3.464 N/A TYR 438.A N PRO 434.A O no hydrogen 2.864 N/A GLN 439.A N LYS 435.A O no hydrogen 3.195 N/A GLU 440.A N GLU 436.A O no hydrogen 3.172 N/A ALA 441.A N VAL 437.A O no hydrogen 3.189 N/A GLN 442.A N TYR 438.A O no hydrogen 3.029 N/A GLU 443.A N GLN 439.A O no hydrogen 2.902 N/A TYR 444.A N GLU 440.A O no hydrogen 2.869 N/A LEU 445.A N ALA 441.A O no hydrogen 3.085 N/A ALA 446.A N GLN 442.A O no hydrogen 3.108 N/A ALA 446.A N GLU 443.A O no hydrogen 3.157 N/A ARG 447.A N GLU 443.A O no hydrogen 3.008 N/A SER 451.A N GLY 513.A O no hydrogen 2.958 N/A GLN 453.A N LYS 511.A O no hydrogen 2.778 N/A ILE 455.A N ALA 509.A O no hydrogen 3.003 N/A ASP 456.A N GLN 460.A O no hydrogen 2.998 N/A SER 458.A N ASP 456.A OD1 no hydrogen 3.028 N/A SER 458.A OG ASP 456.A OD1 no hydrogen 2.917 N/A GLY 459.A N ASP 456.A O no hydrogen 2.973 N/A GLN 460.A N ASP 456.A OD1 no hydrogen 2.996 N/A ARG 462.A N ILE 454.A O no hydrogen 2.879 N/A ARG 462.A NH1 PRO 497.A O no hydrogen 2.901 N/A ALA 465.A N ARG 462.A O no hydrogen 3.343 N/A GLU 466.A N ARG 495.A O no hydrogen 2.892 N/A LEU 468.A N ARG 493.A O no hydrogen 2.710 N/A GLY 469.A N ARG 493.A O no hydrogen 3.275 N/A SER 471.A N LYS 491.A O no hydrogen 3.157 N/A ALA 473.A N ALA 489.A O no hydrogen 2.883 N/A ASP 475.A N TYR 487.A O no hydrogen 2.908 N/A TYR 476.A N ASP 475.A OD1 no hydrogen 2.684 N/A ASP 477.A N GLU 485.A O no hydrogen 2.971 N/A LYS 480.A NZ GLU 383.A OE1 no hydrogen 2.529 N/A LYS 480.A NZ GLU 383.A OE2 no hydrogen 3.206 N/A GLU 485.A N ASP 477.A O no hydrogen 2.876 N/A TYR 487.A N ASP 475.A O no hydrogen 2.989 N/A TYR 487.A OH ASP 477.A OD1 no hydrogen 2.927 N/A PHE 488.A N TYR 427.A O no hydrogen 2.973 N/A ALA 489.A N ALA 473.A O no hydrogen 2.735 N/A ILE 490.A N LYS 425.A O no hydrogen 2.983 N/A LYS 491.A N SER 471.A O no hydrogen 2.910 N/A VAL 492.A N LEU 422.A O no hydrogen 2.704 N/A ARG 493.A N GLY 469.A O no hydrogen 2.933 N/A ARG 493.A NH1 GLU 419.A OE1 no hydrogen 2.887 N/A ARG 493.A NH1 LEU 420.A O no hydrogen 3.478 N/A ARG 493.A NH2 GLU 419.A OE1 no hydrogen 2.937 N/A LEU 494.A N LEU 420.A O no hydrogen 2.925 N/A ARG 495.A N GLU 466.A O no hydrogen 2.856 N/A ARG 495.A NE GLU 419.A OE2 no hydrogen 2.901 N/A ARG 495.A NH1 GLU 466.A OE1 no hydrogen 3.227 N/A ARG 495.A NH2 GLU 419.A OE2 no hydrogen 3.150 N/A ARG 495.A NH2 GLU 600.A OE1 no hydrogen 3.041 N/A LEU 496.A N ALA 418.A O no hydrogen 2.820 N/A ILE 498.A N SER 416.A O no hydrogen 2.964 N/A THR 499.A OG1 THR 415.A OG1 no hydrogen 2.763 N/A LEU 500.A N LYS 414.A O no hydrogen 2.809 N/A MET 503.A N SER 410.A O no hydrogen 3.027 N/A SER 504.A N ASN 408.A O no hydrogen 3.059 N/A SER 504.A OG PRO 501.A O no hydrogen 2.887 N/A SER 504.A OG ALA 502.A O no hydrogen 2.835 N/A SER 504.A OG SER 818.A OG no hydrogen 3.133 N/A TRP 505.A N TYR 817.A O no hydrogen 3.005 N/A TRP 505.A NE1 ALA 814.A O no hydrogen 2.870 N/A LYS 506.A N LEU 406.A O no hydrogen 3.017 N/A THR 507.A N ALA 815.A O no hydrogen 2.938 N/A THR 507.A OG1 ALA 815.A O no hydrogen 2.842 N/A LEU 508.A N PHE 404.A O no hydrogen 2.758 N/A ALA 509.A N ILE 455.A O no hydrogen 2.976 N/A LEU 510.A N GLN 402.A O no hydrogen 2.748 N/A LYS 511.A N GLN 453.A O no hydrogen 2.994 N/A LYS 511.A NZ ASP 400.A OD1 no hydrogen 3.156 N/A LYS 511.A NZ ASP 400.A OD2 no hydrogen 3.525 N/A GLY 513.A N SER 451.A O no hydrogen 2.817 N/A LEU 519.A N THR 595.A O no hydrogen 2.961 N/A TYR 520.A N ASN 594.A OD1 no hydrogen 2.888 N/A ASP 521.A N CYS 526.A O no hydrogen 2.737 N/A SER 523.A N ASP 521.A OD1 no hydrogen 3.098 N/A SER 523.A OG ASP 521.A OD1 no hydrogen 2.744 N/A ASN 524.A N ASP 521.A O no hydrogen 3.330 N/A CYS 526.A N ASP 521.A O no hydrogen 3.115 N/A CYS 526.A SG LEU 527.A O no hydrogen 4.016 N/A CYS 526.A SG VAL 534.A O no hydrogen 3.783 N/A LEU 527.A N VAL 534.A O no hydrogen 2.771 N/A GLU 528.A N LEU 519.A O no hydrogen 2.999 N/A ASN 529.A N LEU 532.A O no hydrogen 3.058 N/A ASN 529.A ND2 GLU 650.A O no hydrogen 2.886 N/A ASN 529.A ND2 ASN 653.A O no hydrogen 3.269 N/A PHE 531.A N ASN 529.A OD1 no hydrogen 2.756 N/A LEU 532.A N ASN 529.A OD1 no hydrogen 2.976 N/A LYS 533.A N THR 545.A O no hydrogen 2.910 N/A VAL 534.A N LEU 527.A O no hydrogen 2.591 N/A MET 535.A N THR 543.A O no hydrogen 2.858 N/A ILE 536.A N GLN 525.A O no hydrogen 2.795 N/A GLN 537.A N ARG 541.A O no hydrogen 2.893 N/A GLN 537.A NE2 ASP 539.A OD1 no hydrogen 3.074 N/A GLN 537.A NE2 ASP 555.A OD1 no hydrogen 3.216 N/A GLY 540.A N GLN 537.A O no hydrogen 2.875 N/A ARG 541.A N ASP 539.A OD1 no hydrogen 2.992 N/A ARG 541.A NE ASP 539.A OD2 no hydrogen 2.796 N/A ARG 541.A NH2 ASP 539.A OD2 no hydrogen 2.758 N/A LEU 542.A N LEU 556.A O no hydrogen 2.812 N/A THR 543.A N MET 535.A O no hydrogen 3.082 N/A THR 543.A OG1 GLN 537.A OE1 no hydrogen 2.723 N/A ILE 544.A N TYR 553.A O no hydrogen 2.790 N/A THR 545.A N LYS 533.A O no hydrogen 2.855 N/A ASP 546.A N LEU 551.A O no hydrogen 3.004 N/A LYS 547.A N PHE 531.A O no hydrogen 2.924 N/A LYS 547.A NZ GLU 528.A OE1 no hydrogen 2.751 N/A LYS 547.A NZ ASN 529.A O no hydrogen 2.841 N/A GLN 548.A N ASP 546.A OD1 no hydrogen 2.890 N/A SER 549.A N ASP 546.A OD1 no hydrogen 2.969 N/A GLY 550.A N ASP 546.A O no hydrogen 2.797 N/A TYR 553.A N ILE 544.A O no hydrogen 2.822 N/A ASP 555.A N GLN 537.A OE1 no hydrogen 3.050 N/A LEU 556.A N LEU 542.A O no hydrogen 2.813 N/A ARG 558.A N LEU 674.A O no hydrogen 3.122 N/A ARG 558.A NE ASP 583.A OD1 no hydrogen 2.980 N/A ARG 558.A NE ASP 583.A OD2 no hydrogen 3.467 N/A ARG 558.A NH2 ASP 583.A OD2 no hydrogen 2.973 N/A GLU 560.A N ARG 672.A O no hydrogen 2.871 N/A ASP 561.A N PHE 580.A O no hydrogen 2.832 N/A CYS 562.A N ARG 670.A O no hydrogen 2.843 N/A GLY 563.A N ASP 577.A OD1 no hydrogen 3.456 N/A ASP 564.A N ASN 668.A O no hydrogen 2.969 N/A ILE 565.A N ARG 572.A O no hydrogen 2.795 N/A GLY 566.A N ASP 564.A OD1 no hydrogen 2.747 N/A ASN 567.A N ILE 570.A O no hydrogen 2.986 N/A GLU 568.A N MET 756.A O no hydrogen 2.955 N/A TYR 569.A N ASN 567.A OD1 no hydrogen 2.724 N/A ILE 570.A N ASN 567.A OD1 no hydrogen 2.920 N/A SER 571.A N ASN 296.A OD1 no hydrogen 2.789 N/A SER 571.A OG ASP 564.A OD2 no hydrogen 2.632 N/A ARG 572.A N ASP 564.A OD1 no hydrogen 3.024 N/A ARG 572.A NE ILE 627.A O no hydrogen 2.829 N/A ARG 572.A NH1 GLN 573.A O no hydrogen 3.084 N/A ARG 572.A NH1 ASN 575.A OD1 no hydrogen 3.570 N/A ARG 572.A NH2 ILE 627.A O no hydrogen 3.494 N/A ARG 572.A NH2 THR 628.A O no hydrogen 2.823 N/A GLN 573.A NE2 GLY 563.A O no hydrogen 2.958 N/A GLN 573.A NE2 SER 571.A OG no hydrogen 3.247 N/A PHE 580.A N ASP 561.A O no hydrogen 2.887 N/A ALA 582.A N PHE 559.A O no hydrogen 3.182 N/A GLN 584.A N TYR 581.A O no hydrogen 3.084 N/A GLY 585.A N ALA 582.A O no hydrogen 3.009 N/A THR 586.A N THR 606.A O no hydrogen 2.849 N/A LYS 588.A N GLN 604.A O no hydrogen 2.929 N/A ASN 590.A N GLU 602.A O no hydrogen 3.010 N/A ASN 590.A ND2 GLU 602.A OE1 no hydrogen 3.152 N/A ILE 592.A N GLU 600.A O no hydrogen 2.913 N/A SER 593.A N GLU 600.A O no hydrogen 3.369 N/A SER 593.A OG GLU 600.A OE1 no hydrogen 2.771 N/A ASN 594.A ND2 TYR 520.A O no hydrogen 3.014 N/A THR 595.A N VAL 598.A O no hydrogen 2.805 N/A THR 595.A OG1 VAL 598.A O no hydrogen 3.302 N/A GLN 597.A N THR 595.A OG1 no hydrogen 3.038 N/A VAL 598.A N THR 595.A OG1 no hydrogen 3.222 N/A ALA 599.A N MET 649.A O no hydrogen 2.971 N/A GLU 600.A N SER 593.A O no hydrogen 2.895 N/A LEU 601.A N ILE 647.A O no hydrogen 2.843 N/A GLU 602.A N ASN 590.A O no hydrogen 2.759 N/A ILE 603.A N THR 645.A O no hydrogen 2.887 N/A GLN 604.A N LYS 588.A O no hydrogen 2.887 N/A GLN 605.A N LEU 643.A O no hydrogen 2.851 N/A THR 606.A N THR 586.A O no hydrogen 2.901 N/A PHE 607.A N LEU 641.A O no hydrogen 3.110 N/A ILE 609.A N ALA 639.A O no hydrogen 2.975 N/A ILE 611.A N GLU 637.A O no hydrogen 3.071 N/A SER 612.A OG ALA 613.A O no hydrogen 2.719 N/A ASP 614.A N ARG 633.A O no hydrogen 2.742 N/A LEU 616.A N ASP 614.A OD1 no hydrogen 3.162 N/A LEU 617.A N ASP 614.A O no hydrogen 3.384 N/A GLN 618.A NE2 GLU 622.A OE2 no hydrogen 2.849 N/A GLN 618.A NE2 TYR 761.A OH no hydrogen 2.966 N/A GLU 620.A N LEU 616.A O no hydrogen 3.059 N/A MET 621.A N LEU 617.A O no hydrogen 2.842 N/A GLU 622.A N GLN 618.A O no hydrogen 3.071 N/A ALA 623.A N ALA 619.A O no hydrogen 3.273 N/A VAL 624.A N MET 621.A O no hydrogen 2.943 N/A ILE 625.A N GLU 620.A O no hydrogen 3.025 N/A THR 628.A N ASP 626.A OD2 no hydrogen 3.079 N/A THR 628.A OG1 ASP 626.A OD2 no hydrogen 2.480 N/A GLU 629.A N ASP 626.A O no hydrogen 3.007 N/A ARG 630.A NE ILE 625.A O no hydrogen 2.961 N/A ARG 630.A NH1 ILE 565.A O no hydrogen 2.936 N/A ARG 630.A NH1 GLU 755.A OE2 no hydrogen 2.959 N/A ARG 630.A NH2 ILE 625.A O no hydrogen 3.145 N/A ARG 630.A NH2 GLU 755.A OE2 no hydrogen 2.736 N/A GLN 631.A N GLU 620.A OE2 no hydrogen 2.746 N/A GLN 631.A NE2 GLU 629.A O no hydrogen 2.975 N/A ALA 632.A N GLU 620.A OE1 no hydrogen 3.173 N/A ARG 633.A N ASP 614.A OD2 no hydrogen 2.787 N/A ARG 634.A NH1 ASP 561.A OD2 no hydrogen 2.908 N/A ARG 634.A NH2 ASP 561.A OD2 no hydrogen 2.784 N/A SER 635.A N SER 612.A O no hydrogen 2.822 N/A SER 635.A OG SER 612.A O no hydrogen 3.322 N/A SER 635.A OG GLU 637.A O no hydrogen 3.015 N/A ALA 639.A N ILE 609.A O no hydrogen 2.841 N/A LEU 641.A N PHE 607.A O no hydrogen 2.884 N/A LEU 643.A N GLN 605.A O no hydrogen 2.817 N/A THR 644.A N ARG 661.A O no hydrogen 2.924 N/A THR 645.A N ILE 603.A O no hydrogen 2.985 N/A THR 645.A OG1 THR 660.A OG1 no hydrogen 2.677 N/A LEU 646.A N THR 659.A O no hydrogen 2.797 N/A ILE 647.A N LEU 601.A O no hydrogen 2.655 N/A ARG 648.A N GLN 657.A O no hydrogen 2.888 N/A ARG 648.A NE GLU 650.A OE2 no hydrogen 2.833 N/A ARG 648.A NH1 GLU 419.A OE2 no hydrogen 3.515 N/A ARG 648.A NH2 VAL 417.A O no hydrogen 3.162 N/A ARG 648.A NH2 GLU 419.A OE2 no hydrogen 2.732 N/A MET 649.A N ALA 599.A O no hydrogen 3.013 N/A LYS 651.A N GLN 597.A O no hydrogen 2.808 N/A ASN 653.A N GLU 650.A O no hydrogen 3.453 N/A ASN 653.A ND2 GLU 650.A OE1 no hydrogen 3.056 N/A ARG 655.A N ASN 653.A OD1 no hydrogen 3.089 N/A LEU 656.A N PHE 779.A O no hydrogen 2.849 N/A GLN 657.A N ARG 648.A O no hydrogen 3.141 N/A PHE 658.A N TYR 777.A O no hydrogen 2.781 N/A THR 659.A N LEU 646.A O no hydrogen 2.980 N/A THR 660.A N LEU 775.A O no hydrogen 2.886 N/A THR 660.A OG1 THR 645.A OG1 no hydrogen 2.677 N/A THR 660.A OG1 TYR 777.A OH no hydrogen 2.674 N/A ARG 661.A N THR 644.A O no hydrogen 2.712 N/A ARG 661.A NH2 GLU 602.A OE2 no hydrogen 2.541 N/A PHE 662.A N HIS 773.A O no hydrogen 3.383 N/A ASN 664.A N GLY 771.A O no hydrogen 2.823 N/A ASN 664.A ND2 MET 666.A O no hydrogen 3.348 N/A ASN 664.A ND2 CYS 769.A O no hydrogen 2.964 N/A MET 666.A N ASN 664.A OD1 no hydrogen 3.068 N/A THR 667.A N ILE 611.A O no hydrogen 2.997 N/A THR 667.A OG1 ILE 611.A O no hydrogen 3.427 N/A ASN 668.A N GLN 768.A OE1 no hydrogen 2.862 N/A ASN 668.A ND2 ASP 564.A O no hydrogen 2.678 N/A HIS 669.A N SER 752.A O no hydrogen 3.177 N/A HIS 669.A ND1 ASP 561.A OD1 no hydrogen 2.552 N/A HIS 669.A NE2 ASN 664.A OD1 no hydrogen 2.912 N/A ARG 670.A N CYS 562.A O no hydrogen 2.722 N/A ARG 670.A NH2 GLU 560.A OE1 no hydrogen 3.510 N/A LEU 671.A N LEU 750.A O no hydrogen 2.889 N/A ARG 672.A N GLU 560.A O no hydrogen 2.878 N/A ARG 672.A NE GLU 560.A OE1 no hydrogen 2.644 N/A ARG 672.A NH1 GLU 737.A OE1 no hydrogen 2.596 N/A ARG 672.A NH2 GLU 560.A OE1 no hydrogen 3.165 N/A ARG 672.A NH2 GLU 560.A OE2 no hydrogen 3.176 N/A VAL 673.A N ILE 747.A O no hydrogen 3.019 N/A LEU 674.A N ARG 558.A O no hydrogen 2.698 N/A PHE 675.A N ILE 745.A O no hydrogen 2.773 N/A THR 677.A N ASN 743.A O no hydrogen 3.176 N/A THR 677.A OG1 ASN 743.A O no hydrogen 2.647 N/A HIS 678.A N THR 742.A O no hydrogen 2.756 N/A LEU 679.A N THR 677.A OG1 no hydrogen 3.337 N/A HIS 684.A N ARG 695.A O no hydrogen 2.889 N/A HIS 684.A ND1 ASN 697.A OD1 no hydrogen 2.738 N/A HIS 684.A NE2 TYR 736.A OH no hydrogen 2.641 N/A LEU 685.A N SER 718.A O no hydrogen 2.765 N/A ALA 686.A N VAL 693.A O no hydrogen 2.832 N/A ASP 687.A N PHE 716.A O no hydrogen 3.017 N/A SER 688.A N GLU 691.A O no hydrogen 2.682 N/A PHE 690.A N SER 97.A OG no hydrogen 3.166 N/A THR 692.A OG1 LEU 848.A O no hydrogen 2.624 N/A VAL 693.A N ALA 686.A O no hydrogen 2.774 N/A ARG 695.A N HIS 684.A O no hydrogen 2.946 N/A ARG 695.A NE GLU 282.A OE2 no hydrogen 2.803 N/A ARG 695.A NH1 HIS 712.A O no hydrogen 2.681 N/A ARG 695.A NH1 TYR 736.A OH no hydrogen 2.893 N/A ARG 695.A NH2 GLU 282.A OE1 no hydrogen 2.890 N/A ASN 697.A N ASP 682.A O no hydrogen 2.773 N/A ASN 697.A ND2 THR 681.A O no hydrogen 3.143 N/A ASN 697.A ND2 HIS 683.A O no hydrogen 3.192 N/A THR 702.A N ASP 700.A OD1 no hydrogen 3.197 N/A THR 702.A OG1 ASP 700.A OD1 no hydrogen 3.309 N/A PHE 703.A N ASP 700.A O no hydrogen 3.013 N/A TRP 704.A N ASP 700.A O no hydrogen 2.801 N/A TRP 704.A NE1 SER 708.A O no hydrogen 2.948 N/A LYS 705.A N ASP 289.A O no hydrogen 2.626 N/A ASN 706.A N ASP 289.A O no hydrogen 3.005 N/A ASN 706.A ND2 GLY 290.A O no hydrogen 2.942 N/A SER 708.A N ASN 706.A OD1 no hydrogen 2.960 N/A ASN 709.A N GLU 737.A OE2 no hydrogen 2.854 N/A GLN 711.A N TYR 736.A O no hydrogen 2.881 N/A GLN 711.A NE2 ASN 709.A OD1 no hydrogen 3.163 N/A GLN 711.A NE2 PRO 710.A O no hydrogen 3.275 N/A GLN 713.A N ASN 734.A O no hydrogen 2.934 N/A GLN 713.A NE2 LEU 733.A O no hydrogen 2.852 N/A GLU 714.A N ASP 687.A O no hydrogen 2.769 N/A CYS 715.A N ASP 687.A OD2 no hydrogen 2.647 N/A VAL 717.A N ILE 728.A O no hydrogen 3.061 N/A SER 718.A N LEU 685.A O no hydrogen 2.700 N/A SER 718.A OG VAL 726.A O no hydrogen 3.148 N/A SER 718.A OG THR 727.A OG1 no hydrogen 3.230 N/A SER 718.A OG TYR 791.A OH no hydrogen 3.371 N/A LEU 719.A N VAL 726.A O no hydrogen 2.923 N/A ASP 721.A N ASN 724.A O no hydrogen 2.910 N/A GLU 723.A N ASP 721.A OD1 no hydrogen 2.675 N/A ASN 724.A N ASP 721.A OD1 no hydrogen 2.918 N/A GLY 725.A N ILE 782.A O no hydrogen 2.951 N/A VAL 726.A N LEU 719.A O no hydrogen 2.825 N/A THR 727.A N GLU 780.A O no hydrogen 2.896 N/A THR 727.A OG1 SER 718.A OG no hydrogen 3.230 N/A THR 727.A OG1 SER 790.A OG no hydrogen 2.696 N/A ILE 728.A N VAL 717.A O no hydrogen 2.996 N/A GLY 729.A N SER 778.A O no hydrogen 3.001 N/A ASN 730.A N CYS 715.A O no hydrogen 2.991 N/A ASN 730.A ND2 GLU 714.A O no hydrogen 3.486 N/A TYR 731.A N SER 776.A O no hydrogen 3.026 N/A ASN 734.A ND2 GLN 713.A O no hydrogen 2.813 N/A ASN 734.A ND2 GLU 714.A O no hydrogen 3.466 N/A TYR 736.A N GLN 711.A O no hydrogen 3.158 N/A TYR 736.A OH HIS 684.A NE2 no hydrogen 2.641 N/A GLU 737.A N ALA 746.A O no hydrogen 2.826 N/A LEU 739.A N THR 744.A O no hydrogen 2.829 N/A THR 742.A N LEU 739.A O no hydrogen 3.377 N/A THR 742.A OG1 THR 744.A OG1 no hydrogen 2.574 N/A ASN 743.A ND2 LEU 679.A O no hydrogen 2.699 N/A ASN 743.A ND2 THR 681.A O no hydrogen 3.033 N/A THR 744.A N LEU 739.A O no hydrogen 2.980 N/A THR 744.A OG1 THR 742.A OG1 no hydrogen 2.574 N/A ILE 745.A N PHE 675.A O no hydrogen 2.873 N/A ALA 746.A N GLU 737.A O no hydrogen 2.832 N/A ILE 747.A N VAL 673.A O no hydrogen 2.909 N/A THR 748.A N GLU 735.A O no hydrogen 3.035 N/A THR 748.A OG1 GLU 735.A OE2 no hydrogen 2.683 N/A LEU 749.A N LEU 671.A O no hydrogen 2.848 N/A LEU 750.A N LEU 671.A O no hydrogen 3.306 N/A ARG 751.A NE ASP 564.A OD2 no hydrogen 3.037 N/A ARG 751.A NH1 SER 299.A OG no hydrogen 3.046 N/A SER 752.A N HIS 669.A O no hydrogen 2.834 N/A SER 752.A OG GLN 768.A O no hydrogen 2.777 N/A VAL 753.A N ALA 767.A O no hydrogen 3.309 N/A MET 756.A N PHE 762.A O no hydrogen 3.052 N/A THR 764.A N GLY 754.A O no hydrogen 2.756 N/A GLU 766.A N ASP 360.A OD2 no hydrogen 2.926 N/A ALA 767.A N THR 764.A O no hydrogen 2.917 N/A GLN 768.A N PRO 765.A O no hydrogen 3.198 N/A GLN 768.A NE2 ASN 668.A OD1 no hydrogen 3.179 N/A CYS 769.A N GLU 766.A O no hydrogen 3.161 N/A CYS 769.A SG ARG 751.A O no hydrogen 4.010 N/A CYS 769.A SG ALA 767.A O no hydrogen 3.426 N/A GLY 771.A N ASN 664.A O no hydrogen 2.909 N/A HIS 773.A N PHE 662.A O no hydrogen 2.955 N/A HIS 773.A NE2 CYS 769.A O no hydrogen 2.732 N/A LEU 775.A N THR 660.A O no hydrogen 2.797 N/A TYR 777.A N PHE 658.A O no hydrogen 3.149 N/A TYR 777.A OH THR 660.A OG1 no hydrogen 2.674 N/A SER 778.A N GLY 729.A O no hydrogen 2.687 N/A PHE 779.A N LEU 656.A O no hydrogen 2.919 N/A GLU 780.A N THR 727.A O no hydrogen 2.919 N/A SER 781.A OG ASP 546.A OD2 no hydrogen 2.560 N/A ILE 782.A N GLY 725.A O no hydrogen 2.784 N/A THR 783.A N THR 786.A OG1 no hydrogen 3.244 N/A THR 786.A N THR 783.A O no hydrogen 2.966 N/A GLN 787.A NE2 TYR 791.A OH no hydrogen 3.181 N/A SER 790.A N THR 786.A O no hydrogen 2.979 N/A SER 790.A OG THR 727.A OG1 no hydrogen 2.696 N/A SER 790.A OG GLN 787.A O no hydrogen 2.627 N/A TYR 791.A N PHE 788.A O no hydrogen 2.873 N/A TYR 791.A OH SER 718.A OG no hydrogen 3.371 N/A TRP 792.A N PHE 788.A O no hydrogen 3.090 N/A TRP 792.A NE1 ASP 825.A OD1 no hydrogen 2.896 N/A ARG 793.A N ALA 789.A O no hydrogen 2.897 N/A ARG 793.A NH1 GLU 780.A OE2 no hydrogen 3.032 N/A ALA 794.A N SER 790.A O no hydrogen 3.199 N/A GLN 795.A N TYR 791.A O no hydrogen 3.135 N/A GLN 795.A NE2 LEU 829.A O no hydrogen 3.135 N/A GLU 796.A N TRP 792.A O no hydrogen 2.708 N/A GLY 797.A N ARG 793.A O no hydrogen 2.715 N/A GLN 798.A N GLN 795.A O no hydrogen 3.452 N/A GLN 798.A NE2 ASN 730.A O no hydrogen 2.754 N/A VAL 799.A N GLU 796.A O no hydrogen 2.921 N/A ILE 802.A N PHE 407.A O no hydrogen 2.953 N/A THR 804.A N VAL 405.A O no hydrogen 2.999 N/A GLN 805.A NE2 THR 423.A O no hydrogen 2.885 N/A THR 806.A N PRO 403.A O no hydrogen 3.436 N/A THR 806.A OG1 ASP 390.A OD1 no hydrogen 2.957 N/A THR 806.A OG1 HIS 809.A NE2 no hydrogen 2.768 N/A ASN 807.A ND2.A GLN 808.A O no hydrogen 3.626 N/A GLN 808.A N GLN 808.A OE1 no hydrogen 2.739 N/A GLN 808.A NE2 PHE 397.A O no hydrogen 3.166 N/A GLN 808.A NE2 SER 401.A O no hydrogen 2.930 N/A HIS 809.A N THR 394.A OG1 no hydrogen 2.896 N/A HIS 809.A NE2 THR 806.A OG1 no hydrogen 2.768 N/A LEU 813.A N ALA 391.A O no hydrogen 2.905 N/A TYR 817.A N TRP 505.A O no hydrogen 2.991 N/A SER 818.A OG SER 504.A OG no hydrogen 3.133 N/A TYR 819.A N MET 503.A O no hydrogen 2.784 N/A TYR 819.A OH GLU 328.A OE1 no hydrogen 2.919 N/A TYR 819.A OH TYR 863.A OH no hydrogen 2.826 N/A THR 821.A N SER 859.A O no hydrogen 2.802 N/A ASN 824.A ND2.B ASP 855.A O no hydrogen 3.002 N/A GLN 826.A N ASN 824.A OD1.B no hydrogen 2.848 N/A GLN 826.A NE2 ASN 847.A OD1 no hydrogen 3.041 N/A GLN 826.A NE2 LYS 852.A O no hydrogen 3.082 N/A GLN 826.A NE2 THR 853.A O no hydrogen 3.408 N/A VAL 827.A N ASN 824.A O no hydrogen 3.109 N/A ALA 828.A N TYR 846.A O no hydrogen 2.959 N/A THR 830.A N ARG 844.A O no hydrogen 2.938 N/A THR 830.A OG1 GLU 98.A OE2 no hydrogen 2.472 N/A THR 830.A OG1 ARG 844.A O no hydrogen 3.524 N/A ALA 831.A N ARG 844.A O no hydrogen 3.414 N/A LYS 833.A N ILE 842.A O no hydrogen 2.933 N/A LYS 833.A NZ ARG 834.A O no hydrogen 2.958 N/A LYS 833.A NZ GLU 872.A OE1 no hydrogen 3.409 N/A LYS 833.A NZ GLU 872.A OE2 no hydrogen 2.675 N/A ARG 834.A N TYR 333.A OH no hydrogen 3.338 N/A ARG 834.A NE ALA 324.A O no hydrogen 2.935 N/A ARG 834.A NH1 ASN 839.A O no hydrogen 2.840 N/A ARG 834.A NH2 ALA 324.A O no hydrogen 2.896 N/A ARG 834.A NH2 TYR 863.A OH no hydrogen 3.147 N/A ARG 835.A N ALA 840.A O no hydrogen 2.845 N/A ARG 835.A NE GLU 872.A O no hydrogen 3.048 N/A ARG 835.A NH1 ASP 838.A OD1 no hydrogen 3.173 N/A ARG 835.A NH2 GLU 872.A O no hydrogen 2.953 N/A ARG 835.A NH2 ASP 874.A OD1 no hydrogen 2.745 N/A ASN 839.A N ARG 835.A O no hydrogen 2.896 N/A ALA 840.A N ASP 838.A OD1 no hydrogen 3.044 N/A LEU 841.A N TRP 893.A O no hydrogen 2.773 N/A ILE 842.A N LYS 833.A O no hydrogen 2.833 N/A THR 843.A N LEU 891.A O no hydrogen 2.841 N/A ARG 844.A N ALA 831.A O no hydrogen 3.127 N/A ARG 844.A NE GLU 98.A OE2 no hydrogen 2.840 N/A ARG 844.A NH1 THR 890.A OG1 no hydrogen 2.907 N/A ARG 844.A NH2 GLU 98.A OE1 no hydrogen 2.811 N/A SER 845.A N LEU 889.A O no hydrogen 2.873 N/A TYR 846.A N ALA 828.A O no hydrogen 3.075 N/A ASN 847.A N GLU 887.A O no hydrogen 3.010 N/A ASN 847.A ND2 LYS 852.A O no hydrogen 2.931 N/A ASN 847.A ND2 GLY 884.A O no hydrogen 3.009 N/A LEU 848.A N GLN 826.A O no hydrogen 2.864 N/A SER 849.A N ASN 847.A OD1 no hydrogen 2.911 N/A ASN 850.A ND2 GLU 691.A OE1 no hydrogen 2.930 N/A ASP 851.A N SER 849.A OG no hydrogen 3.188 N/A LYS 852.A N SER 849.A OG no hydrogen 3.395 N/A CYS 854.A N LEU 883.A O no hydrogen 3.421 N/A CYS 854.A SG ASP 855.A O no hydrogen 3.915 N/A PHE 856.A N SER 881.A O no hydrogen 2.848 N/A SER 857.A OG GLY 822.A O no hydrogen 3.467 N/A SER 857.A OG ASP 855.A OD2 no hydrogen 3.148 N/A SER 859.A N THR 821.A O no hydrogen 2.906 N/A TYR 863.A N LEU 860.A O no hydrogen 3.015 N/A TYR 863.A OH TYR 819.A OH no hydrogen 2.826 N/A ASN 864.A N LYS 894.A O no hydrogen 2.970 N/A LYS 866.A N ALA 892.A O no hydrogen 3.012 N/A THR 868.A N THR 890.A O no hydrogen 2.880 N/A THR 868.A OG1 ASN 869.A O no hydrogen 2.909 N/A ASN 869.A N LYS 873.A O no hydrogen 3.037 N/A LEU 870.A N LYS 139.A O no hydrogen 2.893 N/A GLU 872.A N ASN 869.A O no hydrogen 2.854 N/A LYS 873.A N ASN 869.A OD1 no hydrogen 3.059 N/A SER 875.A N VAL 867.A O no hydrogen 2.979 N/A SER 875.A OG VAL 867.A O no hydrogen 3.308 N/A LEU 883.A N CYS 854.A O no hydrogen 3.027 N/A GLY 884.A N GLU 887.A OE2 no hydrogen 2.827 N/A ALA 886.A N SER 849.A O no hydrogen 3.074 N/A GLU 887.A N GLY 884.A O no hydrogen 3.071 N/A ILE 888.A N GLN 135.A OE1 no hydrogen 2.764 N/A LEU 889.A N SER 845.A O no hydrogen 2.658 N/A LEU 891.A N THR 843.A O no hydrogen 2.831 N/A ALA 892.A N LYS 866.A O no hydrogen 2.884 N/A TRP 893.A N LEU 841.A O no hydrogen 2.673 N/A TRP 893.A NE1 THR 843.A OG1 no hydrogen 3.040 N/A LYS 894.A N ASN 864.A O no hydrogen 2.990 N/A GLN 896.A N ASN 862.A O no hydrogen 2.796 N/A