Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qey_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N GLN 2.A OE1 no hydrogen 3.107 N/A ASP 8.A N GLN 2.A OE1 no hydrogen 3.282 N/A PHE 9.A N GLU 30.A OE1 no hydrogen 2.904 N/A SER 10.A N ASP 8.A OD1 no hydrogen 3.194 N/A SER 10.A OG ASP 8.A OD1 no hydrogen 2.726 N/A LYS 12.A N PHE 9.A O no hydrogen 3.147 N/A VAL 13.A N SER 10.A O no hydrogen 3.375 N/A ILE 14.A N ILE 41.A O no hydrogen 2.808 N/A GLN 15.A NE2 ILE 43.A O no hydrogen 3.113 N/A GLN 15.A NE2 GLU 50.A OE1 no hydrogen 2.623 N/A SER 20.A N SER 17.A O no hydrogen 3.335 N/A SER 20.A OG SER 17.A O no hydrogen 2.958 N/A ARG 26.A N PRO 22.A O no hydrogen 2.877 N/A ARG 26.A NE GLU 30.A OE2 no hydrogen 2.797 N/A ARG 26.A NH1 ASP 19.A OD1 no hydrogen 2.952 N/A ARG 26.A NH2 GLU 30.A OE1 no hydrogen 3.100 N/A ARG 26.A NH2 GLU 30.A OE2 no hydrogen 3.403 N/A LYS 27.A N GLN 23.A O no hydrogen 3.020 N/A LYS 27.A NZ GLU 24.A OE1 no hydrogen 3.169 N/A PHE 28.A N GLU 24.A O no hydrogen 3.165 N/A VAL 29.A N VAL 25.A O no hydrogen 2.924 N/A GLU 30.A N ARG 26.A O no hydrogen 2.791 N/A GLY 31.A N LYS 27.A O no hydrogen 2.968 N/A ASN 32.A N PHE 28.A O no hydrogen 3.294 N/A ASN 32.A ND2 PHE 28.A O no hydrogen 3.103 N/A ALA 33.A N VAL 29.A O no hydrogen 2.861 N/A GLN 34.A N GLU 30.A O no hydrogen 2.898 N/A GLN 34.A NE2.B LEU 7.A O no hydrogen 3.088 N/A LEU 35.A N GLY 31.A O no hydrogen 3.258 N/A CYS 36.A N ASN 32.A O no hydrogen 2.806 N/A CYS 36.A SG ASN 32.A O no hydrogen 3.370 N/A CYS 36.A SG PHE 128.A O no hydrogen 4.000 N/A GLN 37.A N ALA 33.A O no hydrogen 2.867 N/A GLN 37.A NE2.B GLN 34.A O no hydrogen 2.770 N/A GLU 39.A N ARG 135.A O no hydrogen 2.732 N/A TYR 40.A N ARG 135.A O no hydrogen 3.465 N/A ILE 41.A N LYS 12.A O no hydrogen 2.826 N/A HIS 42.A N MET 137.A O no hydrogen 2.884 N/A HIS 42.A NE2 GLU 50.A OE1 no hydrogen 2.907 N/A ILE 43.A N GLN 15.A O no hydrogen 3.052 N/A CYS 44.A N VAL 139.A O no hydrogen 2.956 N/A CYS 44.A SG VAL 139.A O no hydrogen 3.398 N/A ASP 45.A N GLU 50.A OE1 no hydrogen 2.955 N/A GLY 46.A N GLU 50.A OE2 no hydrogen 2.935 N/A SER 47.A N ASP 45.A OD1 no hydrogen 2.952 N/A SER 47.A OG ASP 45.A OD1 no hydrogen 2.820 N/A SER 47.A OG ASP 45.A OD2 no hydrogen 3.301 N/A SER 47.A OG GLU 49.A OE2.A no hydrogen 3.392 N/A GLU 50.A N SER 47.A OG no hydrogen 3.247 N/A TYR 51.A N SER 47.A O no hydrogen 3.118 N/A GLY 52.A N GLU 48.A O no hydrogen 2.804 N/A ARG 53.A N GLU 49.A O no hydrogen 3.004 N/A LEU 54.A N GLU 50.A O no hydrogen 3.149 N/A LEU 55.A N TYR 51.A O no hydrogen 3.066 N/A ALA 56.A N GLY 52.A O no hydrogen 3.023 N/A HIS 57.A N ARG 53.A O no hydrogen 2.946 N/A MET 58.A N LEU 54.A O no hydrogen 2.998 N/A GLN 59.A N LEU 55.A O no hydrogen 2.928 N/A GLU 60.A N ALA 56.A O no hydrogen 3.013 N/A GLU 61.A N HIS 57.A O no hydrogen 3.127 N/A GLY 62.A N GLN 59.A O no hydrogen 3.159 N/A VAL 63.A N MET 58.A O no hydrogen 2.790 N/A ILE 64.A N MET 58.A O no hydrogen 3.353 N/A ARG 65.A N LEU 75.A O no hydrogen 2.811 N/A ARG 65.A NE GLU 360.A OE1 no hydrogen 2.837 N/A ARG 65.A NH2 GLU 360.A OE2 no hydrogen 2.875 N/A LEU 67.A N CYS 73.A O no hydrogen 2.860 N/A LYS 69.A N GLY 364.A O no hydrogen 3.257 N/A LYS 69.A NZ ASP 363.A OD2 no hydrogen 2.805 N/A TYR 70.A N LEU 67.A O no hydrogen 3.259 N/A ASP 71.A N GLN 350.A O no hydrogen 3.324 N/A ASN 72.A ND2 ASN 352.A OD1 no hydrogen 2.975 N/A CYS 73.A SG ASP 71.A O no hydrogen 3.619 N/A CYS 73.A SG ILE 349.A O no hydrogen 3.774 N/A TRP 74.A N THR 353.A O no hydrogen 2.989 N/A TRP 74.A NE1 ASN 72.A OD1 no hydrogen 2.866 N/A LEU 75.A N ARG 65.A O no hydrogen 2.794 N/A ALA 76.A N PHE 355.A O no hydrogen 2.841 N/A THR 78.A N ASN 357.A OD1 no hydrogen 2.896 N/A THR 78.A OG1 ASP 79.A O no hydrogen 3.099 N/A THR 78.A OG1 ASP 82.A O no hydrogen 3.162 N/A THR 78.A OG1 ASN 357.A OD1 no hydrogen 3.390 N/A ARG 81.A N ASP 79.A OD1 no hydrogen 3.125 N/A ARG 81.A NE ASP 79.A OD1 no hydrogen 3.263 N/A ARG 81.A NE ASP 79.A OD2 no hydrogen 3.212 N/A ARG 81.A NH2 ASP 79.A OD2 no hydrogen 2.775 N/A ASP 82.A N ASP 79.A O no hydrogen 2.778 N/A LYS 89.A N ILE 86.A O no hydrogen 2.980 N/A THR 90.A N GLU 87.A O no hydrogen 3.024 N/A THR 90.A OG1 ILE 86.A O no hydrogen 2.725 N/A VAL 91.A N ILE 217.A O no hydrogen 2.838 N/A ILE 92.A N ARG 113.A O no hydrogen 3.025 N/A ILE 93.A N HIS 219.A O no hydrogen 2.800 N/A THR 94.A OG1 GLU 96.A O no hydrogen 2.879 N/A THR 94.A OG1 THR 100.A OG1 no hydrogen 2.724 N/A ASP 99.A N GLU 96.A O no hydrogen 3.199 N/A THR 100.A N GLN 97.A O no hydrogen 2.903 N/A THR 100.A OG1 THR 94.A OG1 no hydrogen 2.724 N/A VAL 101.A N GLN 97.A O no hydrogen 2.981 N/A LYS 105.A N ASP 586.A O no hydrogen 2.924 N/A SER 106.A N ASP 586.A OD2 no hydrogen 2.733 N/A GLY 107.A N ASP 586.A OD2 no hydrogen 3.009 N/A GLN 110.A N GLN 587.A OE1 no hydrogen 2.804 N/A LEU 111.A N SER 109.A OG no hydrogen 3.232 N/A ARG 113.A NE.B GLU 87.A O no hydrogen 3.420 N/A TRP 114.A NE1 THR 94.A O no hydrogen 2.883 N/A MET 115.A N ILE 92.A O no hydrogen 3.225 N/A GLU 118.A N GLU 118.A OE1.A no hydrogen 2.721 N/A ASP 119.A N SER 116.A OG no hydrogen 2.976 N/A PHE 120.A N SER 116.A O no hydrogen 2.960 N/A GLU 121.A N GLU 117.A O no hydrogen 2.957 N/A LYS 122.A N GLU 118.A O no hydrogen 3.300 N/A ALA 123.A N ASP 119.A O no hydrogen 3.084 N/A PHE 124.A N PHE 120.A O no hydrogen 2.686 N/A ASN 125.A N GLU 121.A O no hydrogen 2.965 N/A ALA 126.A N LYS 122.A O no hydrogen 3.074 N/A ALA 126.A N ALA 123.A O no hydrogen 3.290 N/A ARG 127.A N PHE 124.A O no hydrogen 3.034 N/A ARG 127.A NE LEU 214.A O no hydrogen 2.728 N/A ARG 127.A NH1 ALA 123.A O no hydrogen 2.940 N/A PHE 128.A N PHE 124.A O no hydrogen 3.021 N/A GLY 130.A N LEU 35.A O no hydrogen 2.835 N/A CYS 131.A N PHE 128.A O no hydrogen 2.936 N/A CYS 131.A SG PHE 128.A O no hydrogen 3.190 N/A CYS 131.A SG SER 193.A OG no hydrogen 3.273 N/A MET 132.A N CYS 36.A O no hydrogen 2.896 N/A LYS 133.A N GLY 130.A O no hydrogen 3.224 N/A ARG 135.A N MET 132.A O no hydrogen 2.832 N/A ARG 135.A NE CYS 196.A O no hydrogen 2.945 N/A ARG 135.A NH2 CYS 196.A O no hydrogen 2.749 N/A MET 137.A N TYR 40.A O no hydrogen 2.754 N/A TYR 138.A N THR 159.A O no hydrogen 2.676 N/A VAL 139.A N HIS 42.A O no hydrogen 2.760 N/A ILE 140.A N GLU 157.A O no hydrogen 2.660 N/A PHE 142.A N GLY 155.A O no hydrogen 2.926 N/A SER 143.A N ARG 173.A O no hydrogen 2.770 N/A SER 143.A OG GLY 145.A O no hydrogen 2.756 N/A MET 144.A N LYS 153.A O no hydrogen 2.729 N/A SER 149.A N PRO 146.A O no hydrogen 2.940 N/A SER 149.A OG PRO 421.A O no hydrogen 2.639 N/A LEU 151.A N SER 149.A OG no hydrogen 3.081 N/A ALA 152.A N SER 149.A O no hydrogen 3.162 N/A LYS 153.A N MET 144.A O no hydrogen 3.223 N/A LYS 153.A NZ GLU 256.A OE1 no hydrogen 2.769 N/A LYS 153.A NZ GLU 256.A OE2 no hydrogen 3.354 N/A GLY 155.A N PHE 142.A O no hydrogen 2.776 N/A ILE 156.A N ILE 188.A O no hydrogen 3.022 N/A GLU 157.A N ILE 140.A O no hydrogen 2.819 N/A LEU 158.A N CYS 190.A O no hydrogen 2.850 N/A THR 159.A N TYR 138.A O no hydrogen 3.024 N/A THR 159.A OG1 HIS 192.A ND1 no hydrogen 2.852 N/A SER 161.A N THR 159.A OG1 no hydrogen 3.079 N/A TYR 163.A OH THR 356.A OG1 no hydrogen 2.587 N/A VAL 164.A N SER 161.A OG no hydrogen 3.149 N/A VAL 165.A N SER 161.A O no hydrogen 3.320 N/A ALA 166.A N PRO 162.A O no hydrogen 3.078 N/A SER 167.A N TYR 163.A O no hydrogen 3.082 N/A SER 167.A OG TYR 163.A O no hydrogen 2.891 N/A MET 168.A N VAL 164.A O no hydrogen 2.792 N/A ARG 169.A N VAL 165.A O no hydrogen 3.039 N/A ARG 169.A NE GLY 46.A O no hydrogen 3.112 N/A ARG 169.A NH2 GLY 46.A O no hydrogen 3.116 N/A MET 171.A N SER 167.A O no hydrogen 2.930 N/A THR 172.A N MET 168.A O no hydrogen 2.873 N/A THR 172.A OG1 MET 168.A O no hydrogen 2.568 N/A ARG 173.A N SER 143.A O no hydrogen 3.401 N/A ARG 173.A NH1 GLU 327.A O no hydrogen 2.917 N/A ARG 173.A NH2 GLU 419.A OE1 no hydrogen 2.845 N/A GLY 175.A N PRO 141.A O no hydrogen 2.972 N/A THR 176.A N ASP 45.A O no hydrogen 3.154 N/A VAL 178.A N GLY 175.A O no hydrogen 3.157 N/A GLU 180.A N THR 176.A O no hydrogen 3.063 N/A ALA 181.A N SER 177.A O no hydrogen 3.073 N/A LEU 182.A N VAL 178.A O no hydrogen 2.830 N/A GLY 183.A N LEU 179.A O no hydrogen 3.243 N/A GLY 185.A N LEU 182.A O no hydrogen 2.976 N/A ILE 188.A N ILE 154.A O no hydrogen 2.957 N/A LYS 189.A N ARG 224.A O no hydrogen 3.022 N/A CYS 190.A N ILE 156.A O no hydrogen 2.869 N/A CYS 190.A SG ILE 188.A O no hydrogen 3.866 N/A LEU 191.A N ILE 226.A O no hydrogen 2.805 N/A HIS 192.A N LEU 158.A O no hydrogen 2.793 N/A HIS 192.A ND1 THR 159.A OG1 no hydrogen 2.852 N/A HIS 192.A NE2 SER 231.A O no hydrogen 2.664 N/A SER 193.A N SER 228.A O no hydrogen 3.049 N/A SER 193.A OG ASP 160.A OD2 no hydrogen 2.891 N/A VAL 194.A N ASP 160.A OD1 no hydrogen 3.026 N/A GLY 195.A N SER 193.A OG no hydrogen 3.209 N/A CYS 196.A SG VAL 194.A O no hydrogen 3.856 N/A CYS 196.A SG CYS 210.A O no hydrogen 3.247 N/A LEU 198.A N LYS 133.A O no hydrogen 2.717 N/A TRP 208.A N VAL 205.A O no hydrogen 3.026 N/A TRP 208.A NE1 ASP 82.A OD2 no hydrogen 2.614 N/A CYS 210.A SG ASP 79.A OD2 no hydrogen 3.473 N/A CYS 210.A SG TRP 208.A O no hydrogen 3.955 N/A ASN 211.A N GLY 230.A O no hydrogen 2.540 N/A GLU 213.A N GLU 213.A OE2 no hydrogen 2.778 N/A LEU 214.A N ASN 211.A O no hydrogen 3.204 N/A THR 215.A N PRO 212.A O no hydrogen 3.196 N/A THR 215.A OG1 ASN 211.A O no hydrogen 2.752 N/A THR 215.A OG1 PRO 212.A O no hydrogen 3.356 N/A LEU 216.A N PHE 229.A O no hydrogen 2.933 N/A ILE 217.A N LYS 89.A O no hydrogen 2.782 N/A ALA 218.A N ILE 227.A O no hydrogen 2.846 N/A HIS 219.A N VAL 91.A O no hydrogen 2.937 N/A HIS 219.A ND1 VAL 91.A O no hydrogen 2.811 N/A LEU 220.A N GLU 225.A O no hydrogen 2.803 N/A ARG 223.A N LEU 220.A O no hydrogen 2.994 N/A ARG 223.A NE.B GLU 225.A OE1 no hydrogen 3.269 N/A ARG 223.A NH1.A GLU 121.A OE2 no hydrogen 3.562 N/A ARG 223.A NH2.A GLU 225.A OE1 no hydrogen 2.792 N/A ARG 224.A N PRO 221.A O no hydrogen 3.161 N/A ARG 224.A NH1 PRO 221.A O no hydrogen 3.172 N/A ARG 224.A NH1 GLU 255.A OE1 no hydrogen 3.166 N/A ARG 224.A NH1 GLU 255.A OE2 no hydrogen 3.388 N/A ARG 224.A NH2 GLU 255.A OE2 no hydrogen 2.936 N/A GLU 225.A N LEU 220.A O no hydrogen 3.117 N/A ILE 226.A N LYS 189.A O no hydrogen 2.789 N/A ILE 227.A N ALA 218.A O no hydrogen 2.944 N/A SER 228.A N LEU 191.A O no hydrogen 2.793 N/A SER 228.A OG ASN 236.A O no hydrogen 2.546 N/A PHE 229.A N LEU 216.A O no hydrogen 2.963 N/A GLY 230.A N SER 193.A O no hydrogen 2.914 N/A SER 231.A OG ASP 82.A OD1 no hydrogen 2.475 N/A GLY 232.A N ASP 82.A OD2 no hydrogen 2.847 N/A TYR 233.A N SER 231.A OG no hydrogen 3.278 N/A TYR 233.A OH ASN 401.A O no hydrogen 3.053 N/A ASN 236.A N TYR 233.A O no hydrogen 2.858 N/A ASN 236.A ND2 ALA 84.A O no hydrogen 2.893 N/A ASN 236.A ND2 SER 231.A OG no hydrogen 2.973 N/A SER 237.A N GLY 234.A O no hydrogen 3.109 N/A SER 237.A OG GLY 232.A O no hydrogen 2.848 N/A SER 237.A OG GLY 234.A O no hydrogen 3.444 N/A LEU 238.A N GLY 234.A O no hydrogen 2.741 N/A LEU 239.A N GLU 157.A OE1 no hydrogen 3.187 N/A LYS 241.A N LEU 238.A O no hydrogen 2.851 N/A LYS 241.A NZ LYS 241.A O no hydrogen 3.214 N/A LYS 241.A NZ ASP 309.A OD2 no hydrogen 2.771 N/A LYS 241.A NZ GLU 327.A OE1 no hydrogen 3.291 N/A LYS 241.A NZ GLU 327.A OE2 no hydrogen 2.577 N/A LYS 242.A NZ ASP 309.A OD1 no hydrogen 3.390 N/A LYS 242.A NZ ASP 309.A OD2 no hydrogen 2.679 N/A CYS 243.A SG HIS 219.A NE2 no hydrogen 3.251 N/A CYS 243.A SG GLY 235.A O no hydrogen 3.490 N/A PHE 244.A N LEU 239.A O no hydrogen 2.940 N/A ALA 245.A N GLY 240.A O no hydrogen 3.010 N/A LEU 246.A N LYS 242.A O no hydrogen 3.074 N/A ARG 247.A N LYS 242.A O no hydrogen 3.116 N/A ARG 247.A NE PRO 472.A O no hydrogen 3.084 N/A ARG 247.A NH1 HIS 219.A NE2 no hydrogen 3.177 N/A ARG 247.A NH2 PRO 472.A O no hydrogen 2.926 N/A ILE 248.A N CYS 243.A O no hydrogen 2.932 N/A ALA 249.A N PHE 244.A O no hydrogen 2.971 N/A SER 250.A N LEU 246.A O no hydrogen 2.973 N/A SER 250.A OG LEU 246.A O no hydrogen 2.828 N/A SER 250.A OG ARG 247.A O no hydrogen 3.118 N/A ARG 251.A NE GLU 255.A OE1 no hydrogen 2.728 N/A ARG 251.A NH1 ASP 222.A OD1 no hydrogen 3.542 N/A ARG 251.A NH1 ASP 222.A OD2 no hydrogen 3.235 N/A ARG 251.A NH2 ASP 222.A OD2 no hydrogen 3.009 N/A ARG 251.A NH2 GLU 255.A OE1 no hydrogen 2.772 N/A LEU 252.A N ILE 248.A O no hydrogen 3.034 N/A ALA 253.A N ALA 249.A O no hydrogen 2.709 N/A LYS 254.A N SER 250.A O no hydrogen 2.923 N/A GLU 255.A N ARG 251.A O no hydrogen 3.052 N/A GLU 256.A N LEU 252.A O no hydrogen 2.837 N/A GLU 256.A N ALA 253.A O no hydrogen 3.263 N/A GLY 257.A N ALA 253.A O no hydrogen 2.831 N/A TRP 258.A N ALA 253.A O no hydrogen 2.968 N/A TRP 258.A NE1 GLU 256.A OE1 no hydrogen 2.874 N/A LEU 259.A N MET 313.A O no hydrogen 2.757 N/A GLU 261.A N ALA 311.A O no hydrogen 2.879 N/A HIS 262.A ND1 ALA 469.A O no hydrogen 2.862 N/A HIS 262.A NE2 ASP 309.A OD1 no hydrogen 3.151 N/A LEU 264.A N ALA 280.A O no hydrogen 3.080 N/A ILE 265.A N GLY 307.A O no hydrogen 2.831 N/A LEU 266.A N LEU 278.A O no hydrogen 2.904 N/A GLY 267.A N GLU 304.A O no hydrogen 2.731 N/A ILE 268.A N LYS 276.A O no hydrogen 2.802 N/A THR 269.A N LYS 302.A O no hydrogen 2.787 N/A ASN 270.A N LYS 274.A O no hydrogen 2.938 N/A GLY 273.A N ASN 270.A O no hydrogen 2.994 N/A LYS 274.A N ASN 270.A OD1 no hydrogen 2.749 N/A LYS 275.A NZ TYR 277.A OH no hydrogen 3.055 N/A LYS 275.A NZ GLU 304.A OE1 no hydrogen 3.280 N/A LYS 275.A NZ ASP 415.A OD1 no hydrogen 2.730 N/A LYS 276.A N ILE 268.A O no hydrogen 2.897 N/A LYS 276.A NZ GLU 427.A OE1 no hydrogen 2.769 N/A TYR 277.A OH ASP 415.A OD1 no hydrogen 3.347 N/A TYR 277.A OH ASP 415.A OD2 no hydrogen 2.654 N/A LEU 278.A N LEU 266.A O no hydrogen 2.816 N/A ALA 279.A N GLY 428.A O no hydrogen 2.957 N/A ALA 280.A N LEU 264.A O no hydrogen 3.217 N/A ALA 281.A N ILE 430.A O no hydrogen 2.774 N/A CYS 286.A N PRO 283.A O no hydrogen 3.213 N/A CYS 286.A SG SER 284.A O no hydrogen 3.697 N/A CYS 286.A SG SER 460.A OG no hydrogen 3.301 N/A LYS 288.A NZ PHE 282.A O no hydrogen 2.691 N/A THR 289.A OG1 ASP 308.A OD2 no hydrogen 2.587 N/A LEU 291.A N GLY 287.A O no hydrogen 3.160 N/A ALA 292.A N LYS 288.A O no hydrogen 2.815 N/A MET 293.A N THR 289.A O no hydrogen 3.229 N/A MET 294.A N LEU 291.A O no hydrogen 3.232 N/A THR 297.A N GLY 519.A O no hydrogen 3.289 N/A THR 297.A OG1 GLY 519.A O no hydrogen 3.401 N/A THR 297.A OG1 GLU 520.A OE1 no hydrogen 2.649 N/A TRP 301.A N LEU 298.A O no hydrogen 3.411 N/A LYS 302.A N THR 269.A O no hydrogen 2.942 N/A GLU 304.A N GLY 267.A O no hydrogen 2.730 N/A CYS 305.A N ILE 413.A O no hydrogen 2.914 N/A VAL 306.A N ILE 265.A O no hydrogen 2.961 N/A GLY 307.A N ILE 265.A O no hydrogen 3.111 N/A ALA 311.A N GLU 261.A O no hydrogen 2.957 N/A TRP 312.A N ILE 324.A O no hydrogen 3.074 N/A TRP 312.A NE1 ALA 245.A O no hydrogen 2.912 N/A MET 313.A N LEU 259.A O no hydrogen 2.802 N/A LYS 314.A N ARG 322.A O no hydrogen 2.805 N/A LYS 314.A NZ.A PHE 315.A O no hydrogen 3.172 N/A LYS 314.A NZ.B GLU 256.A O no hydrogen 3.282 N/A ASP 316.A N ASN 320.A O no hydrogen 2.856 N/A GLN 318.A N ASP 316.A OD1 no hydrogen 2.986 N/A GLY 319.A N ASP 316.A O no hydrogen 2.921 N/A ASN 320.A N ASP 316.A OD1 no hydrogen 2.887 N/A ARG 322.A N LYS 314.A O no hydrogen 2.945 N/A ARG 322.A NH1 GLY 423.A O no hydrogen 3.123 N/A ALA 323.A N VAL 424.A O no hydrogen 2.797 N/A ILE 324.A N TRP 312.A O no hydrogen 2.922 N/A ASN 325.A ND2 VAL 306.A O no hydrogen 2.839 N/A GLU 327.A N ASN 325.A OD1 no hydrogen 3.026 N/A ASN 328.A N MET 171.A O no hydrogen 2.777 N/A ASN 328.A ND2 THR 172.A O no hydrogen 3.208 N/A PHE 330.A N THR 406.A O no hydrogen 2.883 N/A GLY 332.A N PHE 404.A O no hydrogen 3.029 N/A ALA 334.A N SER 402.A O no hydrogen 2.839 N/A GLY 336.A N GLU 369.A O no hydrogen 2.755 N/A THR 337.A N ALA 334.A O no hydrogen 3.070 N/A THR 337.A OG1 VAL 333.A O no hydrogen 3.009 N/A THR 337.A OG1 ALA 334.A O no hydrogen 2.994 N/A SER 338.A N THR 341.A OG1 no hydrogen 2.801 N/A SER 338.A OG THR 341.A OG1 no hydrogen 3.178 N/A THR 341.A N SER 338.A OG no hydrogen 3.166 N/A THR 341.A OG1 GLY 336.A O no hydrogen 2.629 N/A THR 341.A OG1 SER 338.A OG no hydrogen 3.178 N/A ASN 342.A N SER 338.A O no hydrogen 2.813 N/A ASN 342.A ND2 THR 289.A O no hydrogen 3.496 N/A ASN 344.A ND2 MET 293.A O no hydrogen 2.797 N/A ALA 345.A N ASN 342.A O no hydrogen 3.188 N/A ALA 345.A N ASN 342.A OD1 no hydrogen 3.211 N/A ILE 346.A N ASN 342.A O no hydrogen 3.229 N/A LYS 347.A N PRO 343.A O no hydrogen 3.258 N/A THR 348.A N ASN 344.A O no hydrogen 3.212 N/A THR 348.A OG1 ASN 344.A O no hydrogen 2.679 N/A ILE 349.A N ALA 345.A O no hydrogen 3.095 N/A GLN 350.A NE2 ILE 346.A O no hydrogen 3.284 N/A ASN 352.A N ASP 71.A O no hydrogen 2.886 N/A ASN 352.A ND2 GLN 410.A OE1 no hydrogen 2.747 N/A THR 353.A OG1 LYS 351.A O no hydrogen 2.824 N/A THR 353.A OG1 THR 406.A OG1 no hydrogen 2.960 N/A ILE 354.A N CYS 405.A O no hydrogen 2.988 N/A PHE 355.A N TRP 74.A O no hydrogen 2.728 N/A THR 356.A N ARG 403.A O no hydrogen 2.855 N/A THR 356.A OG1 TYR 163.A OH no hydrogen 2.587 N/A ASN 357.A N ALA 76.A O no hydrogen 2.817 N/A ASN 357.A ND2 THR 78.A OG1 no hydrogen 3.035 N/A ALA 359.A N TYR 367.A O no hydrogen 2.892 N/A GLU 360.A N THR 382.A O no hydrogen 2.757 N/A THR 361.A N GLY 365.A O no hydrogen 2.967 N/A THR 361.A OG1 ASP 363.A OD1 no hydrogen 2.700 N/A SER 362.A N THR 380.A O no hydrogen 2.893 N/A SER 362.A OG.B THR 380.A O no hydrogen 3.164 N/A GLY 364.A N THR 361.A O no hydrogen 2.937 N/A GLY 365.A N THR 361.A OG1 no hydrogen 2.884 N/A VAL 366.A N TYR 70.A OH no hydrogen 3.170 N/A TYR 367.A N ALA 359.A O no hydrogen 2.839 N/A TYR 367.A OH GLU 373.A O no hydrogen 2.853 N/A TRP 368.A NE1 THR 337.A O no hydrogen 2.858 N/A ILE 371.A N TRP 368.A O no hydrogen 3.276 N/A VAL 379.A N ALA 376.A O no hydrogen 3.120 N/A THR 380.A N SER 362.A OG.A no hydrogen 3.238 N/A THR 380.A N SER 362.A OG.B no hydrogen 3.169 N/A THR 380.A OG1 SER 362.A OG.B no hydrogen 2.372 N/A THR 382.A N GLU 360.A O no hydrogen 2.735 N/A SER 383.A N LYS 387.A O no hydrogen 2.719 N/A SER 383.A OG LYS 387.A O no hydrogen 3.418 N/A TRP 384.A N CYS 397.A O no hydrogen 2.851 N/A LYS 385.A N SER 383.A OG no hydrogen 3.188 N/A ASN 386.A N SER 383.A O no hydrogen 2.925 N/A TRP 389.A N ILE 381.A O no hydrogen 2.945 N/A TRP 389.A NE1 GLU 395.A O no hydrogen 2.612 N/A ARG 390.A N ASP 393.A OD2 no hydrogen 2.958 N/A ASP 393.A N ARG 390.A O no hydrogen 3.092 N/A CYS 397.A N GLU 369.A OE1 no hydrogen 2.881 N/A CYS 397.A SG GLU 369.A OE1 no hydrogen 3.600 N/A CYS 397.A SG GLU 369.A OE2 no hydrogen 3.720 N/A ALA 398.A N GLU 369.A OE2 no hydrogen 3.222 N/A HIS 399.A N ASN 357.A O no hydrogen 3.075 N/A ASN 401.A N HIS 399.A ND1 no hydrogen 3.234 N/A SER 402.A N HIS 399.A O no hydrogen 2.874 N/A SER 402.A OG HIS 399.A O no hydrogen 2.792 N/A ARG 403.A N THR 356.A O no hydrogen 3.068 N/A ARG 403.A NH1 PHE 331.A O no hydrogen 2.743 N/A PHE 404.A N GLY 332.A O no hydrogen 2.811 N/A CYS 405.A N ILE 354.A O no hydrogen 2.680 N/A CYS 405.A SG SER 167.A O no hydrogen 3.883 N/A THR 406.A N PHE 330.A O no hydrogen 3.077 N/A THR 406.A OG1 THR 348.A O no hydrogen 3.423 N/A THR 406.A OG1 THR 353.A OG1 no hydrogen 2.960 N/A ALA 408.A N ASN 328.A O no hydrogen 3.138 N/A GLN 410.A N PRO 407.A O no hydrogen 3.305 N/A GLN 410.A NE2 THR 348.A O no hydrogen 3.078 N/A GLN 410.A NE2 LYS 351.A O no hydrogen 2.795 N/A CYS 411.A N ALA 408.A O no hydrogen 3.097 N/A ILE 414.A N CYS 411.A O no hydrogen 3.139 N/A ASP 415.A N CYS 305.A O no hydrogen 2.728 N/A ALA 417.A N ASP 415.A OD2 no hydrogen 2.984 N/A TRP 418.A N ASP 415.A O no hydrogen 3.013 N/A SER 420.A N ALA 417.A O no hydrogen 3.213 N/A SER 420.A OG.B GLU 422.A OE1 no hydrogen 2.640 N/A SER 420.A OG.B GLU 422.A OE2 no hydrogen 3.036 N/A GLU 422.A N GLU 422.A OE2 no hydrogen 2.706 N/A GLY 423.A N SER 420.A O no hydrogen 3.077 N/A VAL 424.A N ALA 323.A O no hydrogen 2.771 N/A ILE 426.A N LEU 321.A O no hydrogen 2.829 N/A GLU 427.A N TYR 277.A O no hydrogen 3.000 N/A ILE 429.A N LYS 498.A O no hydrogen 2.874 N/A ILE 430.A N ALA 279.A O no hydrogen 2.802 N/A PHE 431.A N PHE 500.A O no hydrogen 2.829 N/A ARG 434.A N SER 460.A OG no hydrogen 2.816 N/A ARG 434.A NE ALA 285.A O no hydrogen 2.707 N/A ARG 434.A NH1 ALA 285.A O no hydrogen 2.857 N/A ARG 435.A NH1 GLU 576.A OE2 no hydrogen 2.864 N/A ARG 435.A NH2 GLU 576.A OE1 no hydrogen 3.101 N/A LEU 441.A N LEU 565.A O no hydrogen 3.317 N/A TYR 443.A N HIS 501.A O no hydrogen 2.909 N/A GLU 444.A N TYR 545.A O no hydrogen 2.686 N/A ALA 445.A N ILE 499.A O no hydrogen 2.913 N/A LEU 446.A N HIS 450.A ND1 no hydrogen 3.007 N/A SER 447.A OG GLN 449.A OE1 no hydrogen 3.490 N/A TRP 448.A NE1 TRP 485.A O no hydrogen 2.892 N/A HIS 450.A N SER 447.A OG no hydrogen 3.143 N/A GLY 451.A N SER 447.A O no hydrogen 2.853 N/A VAL 452.A N TRP 448.A O no hydrogen 2.847 N/A PHE 453.A N GLN 449.A O no hydrogen 3.120 N/A VAL 454.A N HIS 450.A O no hydrogen 2.884 N/A GLY 455.A N GLY 451.A O no hydrogen 3.097 N/A ALA 456.A N VAL 452.A O no hydrogen 3.008 N/A ALA 457.A N PHE 453.A O no hydrogen 2.840 N/A ALA 457.A N VAL 454.A O no hydrogen 3.297 N/A MET 458.A N GLY 455.A O no hydrogen 3.410 N/A ARG 459.A NH1 GLU 576.A OE1 no hydrogen 3.270 N/A ARG 459.A NH1 GLU 576.A OE2 no hydrogen 3.521 N/A ARG 459.A NH2 ILE 463.A O no hydrogen 3.503 N/A SER 460.A N MET 464.A O no hydrogen 2.916 N/A GLU 461.A N ARG 434.A O no hydrogen 2.692 N/A MET 464.A N SER 460.A O no hydrogen 3.085 N/A HIS 465.A NE2 GLU 579.A OE1.B no hydrogen 2.652 N/A ASP 466.A N MET 458.A O no hydrogen 2.905 N/A PHE 468.A N GLY 455.A O no hydrogen 2.825 N/A ALA 469.A N ASP 466.A O no hydrogen 3.090 N/A MET 470.A N PRO 467.A O no hydrogen 2.870 N/A ARG 471.A N ASP 466.A OD1 no hydrogen 2.957 N/A ARG 471.A NH1 GLU 87.A OE2 no hydrogen 2.574 N/A ARG 471.A NH2 GLN 110.A O no hydrogen 3.064 N/A PHE 473.A N MET 470.A O no hydrogen 2.732 N/A GLY 475.A N SER 250.A OG no hydrogen 3.039 N/A ASN 477.A N ASP 99.A O no hydrogen 2.938 N/A ASN 477.A ND2 ARG 98.A O no hydrogen 2.728 N/A ASN 477.A ND2 ASP 591.A OD2 no hydrogen 2.760 N/A LYS 480.A N ASN 477.A OD1 no hydrogen 3.124 N/A TYR 481.A N ASN 477.A O no hydrogen 2.902 N/A TYR 481.A OH GLU 261.A OE1 no hydrogen 2.523 N/A TYR 481.A OH GLU 261.A OE2 no hydrogen 3.210 N/A LEU 482.A N PHE 478.A O no hydrogen 2.814 N/A ALA 483.A N GLY 479.A O no hydrogen 3.024 N/A HIS 484.A N LYS 480.A O no hydrogen 2.850 N/A HIS 484.A NE2 TRP 258.A O no hydrogen 2.784 N/A TRP 485.A N TYR 481.A O no hydrogen 3.033 N/A TRP 485.A NE1 GLU 261.A OE2 no hydrogen 2.950 N/A LEU 486.A N LEU 482.A O no hydrogen 2.973 N/A SER 487.A N ALA 483.A O no hydrogen 2.915 N/A SER 487.A OG HIS 484.A O no hydrogen 2.696 N/A MET 488.A N TRP 485.A O no hydrogen 3.338 N/A ALA 489.A N LEU 486.A O no hydrogen 3.197 N/A HIS 490.A N SER 487.A O no hydrogen 3.021 N/A ARG 491.A N MET 488.A O no hydrogen 3.251 N/A ALA 494.A N ARG 491.A O no hydrogen 3.375 N/A LYS 495.A N GLY 319.A O no hydrogen 2.745 N/A LYS 495.A NZ ASN 320.A OD1 no hydrogen 3.180 N/A LYS 498.A N GLU 427.A O no hydrogen 3.185 N/A LYS 498.A NZ GLU 444.A OE2 no hydrogen 2.643 N/A PHE 500.A N ILE 429.A O no hydrogen 2.915 N/A HIS 501.A N TYR 443.A O no hydrogen 2.787 N/A VAL 502.A N PHE 431.A O no hydrogen 2.726 N/A ASN 503.A N LEU 441.A O no hydrogen 2.803 N/A ASN 503.A ND2 GLY 433.A O no hydrogen 3.265 N/A ARG 506.A NH1 LEU 565.A O no hydrogen 3.064 N/A ARG 506.A NH1 GLY 567.A O no hydrogen 2.815 N/A ARG 506.A NH2 GLY 567.A O no hydrogen 3.038 N/A LYS 507.A N PRO 436.A O no hydrogen 2.835 N/A ASP 508.A N LYS 512.A O no hydrogen 3.023 N/A ASN 510.A N ASP 508.A OD2 no hydrogen 2.894 N/A GLY 511.A N ASP 508.A O no hydrogen 2.965 N/A LYS 512.A N ASP 508.A OD2 no hydrogen 3.214 N/A LEU 514.A N ARG 506.A O no hydrogen 2.921 N/A TRP 515.A NE1 ASN 521.A OD1 no hydrogen 2.645 N/A GLU 520.A N GLY 517.A O no hydrogen 3.036 N/A ASN 521.A N PHE 518.A O no hydrogen 2.906 N/A SER 522.A N GLY 519.A O no hydrogen 3.368 N/A SER 522.A OG GLY 519.A O no hydrogen 2.985 N/A ARG 523.A N GLU 520.A O no hydrogen 3.227 N/A ARG 523.A NE GLU 520.A OE1 no hydrogen 2.810 N/A ARG 523.A NH1 ASN 553.A O no hydrogen 2.969 N/A ARG 523.A NH1 LYS 555.A O no hydrogen 2.895 N/A ARG 523.A NH2 GLU 520.A OE1 no hydrogen 2.907 N/A ARG 523.A NH2 LYS 555.A O no hydrogen 3.087 N/A LEU 525.A N ASN 521.A O no hydrogen 3.016 N/A GLU 526.A N SER 522.A O no hydrogen 2.871 N/A TRP 527.A N ARG 523.A O no hydrogen 3.450 N/A TRP 527.A NE1 SER 537.A O no hydrogen 3.064 N/A MET 528.A N VAL 524.A O no hydrogen 3.074 N/A PHE 529.A N LEU 525.A O no hydrogen 2.878 N/A GLY 530.A N GLU 526.A O no hydrogen 3.011 N/A ARG 531.A N TRP 527.A O no hydrogen 2.979 N/A ARG 531.A NE.A GLU 444.A OE1 no hydrogen 2.742 N/A ARG 531.A NE.B ARG 531.A O no hydrogen 3.343 N/A ARG 531.A NH1.A GLU 535.A O no hydrogen 3.314 N/A ARG 531.A NH2.A GLU 444.A OE2 no hydrogen 2.873 N/A ARG 531.A NH2.B ARG 531.A O no hydrogen 3.341 N/A ILE 532.A N MET 528.A O no hydrogen 2.980 N/A GLU 533.A N PHE 529.A O no hydrogen 3.104 N/A GLY 534.A N ARG 531.A O no hydrogen 3.041 N/A GLU 535.A N GLY 530.A O no hydrogen 2.944 N/A SER 537.A N GLU 535.A O no hydrogen 2.926 N/A LYS 539.A N VAL 546.A O no hydrogen 2.725 N/A THR 541.A N GLY 544.A O no hydrogen 2.888 N/A THR 541.A OG1 GLY 544.A O no hydrogen 2.563 N/A ILE 543.A N THR 541.A OG1 no hydrogen 3.407 N/A GLY 544.A N THR 541.A O no hydrogen 3.140 N/A TYR 545.A N GLU 444.A O no hydrogen 2.904 N/A VAL 546.A N LYS 539.A O no hydrogen 2.868 N/A LYS 548.A N SER 537.A O no hydrogen 2.836 N/A LYS 548.A NZ ASP 536.A O no hydrogen 2.824 N/A LYS 548.A NZ ASP 536.A OD2 no hydrogen 3.226 N/A ALA 551.A N LYS 548.A O no hydrogen 3.125 N/A LYS 555.A N ASN 553.A OD1 no hydrogen 3.061 N/A LEU 557.A N LEU 554.A O no hydrogen 3.208 N/A LEU 565.A N ASN 561.A O no hydrogen 3.052 N/A PHE 566.A N VAL 562.A O no hydrogen 2.819 N/A GLY 567.A N GLU 564.A O no hydrogen 3.457 N/A SER 569.A OG GLU 571.A OE1.B no hydrogen 3.359 N/A LYS 570.A NZ SER 608.A O no hydrogen 3.344 N/A LYS 570.A NZ MET 610.A O no hydrogen 2.960 N/A PHE 572.A N SER 569.A OG no hydrogen 3.310 N/A TRP 573.A N SER 569.A O no hydrogen 3.030 N/A GLU 574.A N LYS 570.A O no hydrogen 2.766 N/A LYS 575.A N GLU 571.A O no hydrogen 3.336 N/A LYS 575.A NZ.A GLU 579.A OE2.A no hydrogen 3.397 N/A LYS 575.A NZ.B LYS 575.A O no hydrogen 2.897 N/A LYS 575.A NZ.B GLU 579.A OE2.A no hydrogen 2.460 N/A GLU 576.A N PHE 572.A O no hydrogen 2.876 N/A VAL 577.A N TRP 573.A O no hydrogen 2.931 N/A GLU 578.A N GLU 574.A O no hydrogen 3.272 N/A GLU 579.A N LYS 575.A O no hydrogen 3.031 N/A ILE 580.A N GLU 576.A O no hydrogen 2.935 N/A ASP 581.A N VAL 577.A O no hydrogen 2.803 N/A LYS 582.A N GLU 578.A O no hydrogen 2.993 N/A LYS 582.A NZ GLU 579.A OE2.A no hydrogen 2.963 N/A TYR 583.A N GLU 579.A O no hydrogen 3.081 N/A LEU 584.A N ILE 580.A O no hydrogen 2.971 N/A GLU 585.A N ASP 581.A O no hydrogen 2.936 N/A ASP 586.A N LYS 582.A O no hydrogen 3.183 N/A GLN 587.A N TYR 583.A O no hydrogen 2.830 N/A GLN 587.A NE2 GLN 108.A O no hydrogen 3.048 N/A GLN 587.A NE2 ASP 586.A OD1 no hydrogen 3.093 N/A VAL 588.A N LEU 584.A O no hydrogen 2.997 N/A ASN 589.A N LEU 584.A O no hydrogen 3.122 N/A ASN 589.A ND2 ILE 103.A O no hydrogen 3.093 N/A ASP 591.A N VAL 588.A O no hydrogen 2.998 N/A LEU 592.A N ASN 589.A O no hydrogen 3.350 N/A ILE 596.A N PRO 593.A O no hydrogen 3.053 N/A GLU 597.A N PRO 593.A O no hydrogen 3.223 N/A ARG 598.A N TYR 594.A O no hydrogen 2.883 N/A GLU 599.A N GLU 595.A O no hydrogen 2.959 N/A LEU 600.A N ILE 596.A O no hydrogen 3.005 N/A ARG 601.A N GLU 597.A O no hydrogen 3.001 N/A ALA 602.A N ARG 598.A O no hydrogen 2.857 N/A LEU 603.A N GLU 599.A O no hydrogen 2.921 N/A LYS 604.A N LEU 600.A O no hydrogen 2.970 N/A LYS 604.A NZ.B ASP 581.A OD2 no hydrogen 2.653 N/A GLN 605.A N ARG 601.A O no hydrogen 2.951 N/A ARG 606.A N ALA 602.A O no hydrogen 3.029 N/A ARG 606.A NE PRO 542.A O no hydrogen 2.637 N/A ARG 606.A NH2 PRO 542.A O no hydrogen 3.223 N/A ILE 607.A N LEU 603.A O no hydrogen 3.036 N/A SER 608.A N LYS 604.A O no hydrogen 3.087 N/A SER 608.A OG GLN 605.A O no hydrogen 2.516 N/A SER 608.A OG GLN 609.A OE1 no hydrogen 3.490 N/A GLN 609.A N GLN 605.A O no hydrogen 3.312 N/A GLN 609.A N ARG 606.A O no hydrogen 3.293 N/A MET 610.A N ILE 607.A O no hydrogen 3.064 N/A