Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ysu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A OG1 SER 1.A O no hydrogen 3.397 N/A VAL 6.A N GLN 14.A O no hydrogen 2.838 N/A VAL 7.A N GLU 105.A OE1 no hydrogen 2.733 N/A THR 8.A N GLU 105.A OE1 no hydrogen 2.945 N/A THR 8.A OG1 GLU 105.A OE1 no hydrogen 2.813 N/A ARG 11.A NH2 VAL 114.A O no hydrogen 3.200 N/A GLN 14.A N VAL 6.A O no hydrogen 2.925 N/A GLN 14.A NE2 PHE 12.A O no hydrogen 3.530 N/A ARG 16.A N THR 4.A O no hydrogen 2.479 N/A ARG 16.A NH2 THR 23.A O no hydrogen 2.982 N/A SER 17.A OG ASP 3.A OD2 no hydrogen 3.365 N/A THR 18.A N PRO 15.A O no hydrogen 2.860 N/A VAL 19.A N ARG 16.A O no hydrogen 3.256 N/A THR 24.A N TYR 106.A O no hydrogen 2.859 N/A VAL 26.A N VAL 104.A O no hydrogen 2.829 N/A ARG 28.A NH1 GLU 136.A OE1 no hydrogen 3.352 N/A ILE 31.A N THR 27.A O no hydrogen 2.671 N/A ASP 32.A N ARG 28.A O no hydrogen 2.582 N/A ARG 33.A N GLN 29.A O no hydrogen 3.127 N/A ARG 33.A NE ASP 497.A OD2 no hydrogen 2.979 N/A ARG 33.A NH1 ASP 490.A OD1 no hydrogen 2.676 N/A ARG 33.A NH2 ASP 490.A OD1 no hydrogen 2.792 N/A ARG 33.A NH2 ASP 497.A OD1 no hydrogen 2.598 N/A ARG 33.A NH2 TRP 498.A O no hydrogen 3.021 N/A GLN 35.A N ASP 32.A O no hydrogen 3.136 N/A GLN 35.A NE2 GLY 545.A O no hydrogen 2.701 N/A SER 36.A OG ASP 41.A OD2 no hydrogen 2.659 N/A ASN 40.A ND2 SER 61.A OG no hydrogen 2.857 N/A ASP 41.A N SER 38.A O no hydrogen 3.147 N/A ASP 41.A N SER 38.A OG no hydrogen 3.197 N/A VAL 42.A N SER 38.A O no hydrogen 3.338 N/A LEU 43.A N VAL 39.A O no hydrogen 2.962 N/A ARG 44.A N ASN 40.A O no hydrogen 2.865 N/A ARG 44.A NH2 ASP 530.A OD2 no hydrogen 3.115 N/A ARG 45.A NE ASP 41.A O no hydrogen 3.251 N/A ARG 45.A NH2 ASP 41.A OD2 no hydrogen 2.668 N/A LEU 46.A N LEU 43.A O no hydrogen 2.872 N/A GLY 48.A N ASP 464.A OD1 no hydrogen 2.784 N/A VAL 49.A N LEU 46.A O no hydrogen 3.305 N/A ASP 50.A N PHE 64.A O no hydrogen 3.049 N/A THR 52.A N SER 62.A O no hydrogen 3.270 N/A THR 52.A OG1 SER 62.A O no hydrogen 3.568 N/A GLN 53.A N THR 557.A OG1 no hydrogen 2.940 N/A GLN 53.A NE2 GLY 56.A O no hydrogen 2.915 N/A ASN 54.A N LEU 60.A O no hydrogen 3.084 N/A ASN 54.A ND2 LEU 60.A O no hydrogen 3.125 N/A GLN 59.A NE2 ASN 210.A O no hydrogen 3.071 N/A SER 61.A N ASP 92.A OD1 no hydrogen 3.276 N/A SER 61.A OG ASP 92.A OD2 no hydrogen 2.877 N/A SER 62.A N THR 52.A O no hydrogen 3.051 N/A PHE 64.A N ASP 50.A O no hydrogen 2.998 N/A ARG 66.A N GLY 48.A O no hydrogen 2.872 N/A ARG 66.A NE GLU 447.A OE1 no hydrogen 2.999 N/A ARG 66.A NH2 GLU 401.A OE1 no hydrogen 2.961 N/A ARG 66.A NH2 GLU 401.A OE2 no hydrogen 3.558 N/A ARG 66.A NH2 GLU 447.A OE1 no hydrogen 3.023 N/A THR 68.A N ILE 65.A O no hydrogen 2.840 N/A THR 68.A OG1 ILE 65.A O no hydrogen 2.709 N/A THR 68.A OG1 ASN 69.A O no hydrogen 3.533 N/A SER 71.A OG GLY 89.A O no hydrogen 3.293 N/A HIS 72.A N ASN 69.A O no hydrogen 3.001 N/A HIS 72.A NE2 GLU 395.A OE1 no hydrogen 2.862 N/A LEU 76.A N VAL 124.A O no hydrogen 2.790 N/A ILE 77.A N VAL 80.A O no hydrogen 3.010 N/A ASP 78.A N ILE 126.A O no hydrogen 3.220 N/A VAL 80.A N ILE 77.A O no hydrogen 3.221 N/A ARG 81.A NE ASP 118.A OD1 no hydrogen 3.270 N/A ARG 81.A NE ASP 118.A OD2 no hydrogen 3.446 N/A ARG 81.A NH2 SER 117.A O no hydrogen 2.630 N/A ARG 81.A NH2 ASP 118.A OD1 no hydrogen 3.079 N/A LEU 82.A N VAL 75.A O no hydrogen 2.793 N/A ALA 85.A N LEU 82.A O no hydrogen 3.004 N/A GLY 86.A N ASN 83.A O no hydrogen 3.351 N/A GLY 89.A N ALA 85.A O no hydrogen 2.715 N/A SER 94.A N ASP 92.A OD2 no hydrogen 3.225 N/A SER 94.A OG GLY 58.A O no hydrogen 3.481 N/A SER 94.A OG GLN 59.A O no hydrogen 3.008 N/A SER 94.A OG ASP 92.A OD2 no hydrogen 2.882 N/A GLN 95.A NE2 GLN 95.A O no hydrogen 3.526 N/A PHE 96.A N LEU 93.A O no hydrogen 3.197 N/A VAL 101.A N ILE 98.A O no hydrogen 3.032 N/A GLN 102.A N ILE 127.A O no hydrogen 2.933 N/A GLN 102.A NE2 LEU 100.A O no hydrogen 3.683 N/A ARG 103.A N ILE 127.A O no hydrogen 3.264 N/A ARG 103.A NE GLU 105.A OE2 no hydrogen 2.960 N/A ARG 103.A NH2 LEU 5.A O no hydrogen 3.216 N/A VAL 104.A N VAL 26.A O no hydrogen 2.853 N/A GLU 105.A N ASN 125.A O no hydrogen 3.112 N/A TYR 106.A N THR 24.A O no hydrogen 2.913 N/A TYR 106.A OH PRO 47.A O no hydrogen 2.679 N/A ILE 107.A N VAL 123.A O no hydrogen 3.213 N/A ARG 108.A N PRO 22.A O no hydrogen 2.826 N/A ARG 108.A NE GLU 447.A OE1 no hydrogen 2.784 N/A ARG 108.A NE GLU 447.A OE2 no hydrogen 3.079 N/A ARG 108.A NH1 THR 24.A OG1 no hydrogen 2.729 N/A ARG 108.A NH2 GLU 447.A OE2 no hydrogen 2.770 N/A GLY 109.A N GLY 121.A O no hydrogen 2.978 N/A ARG 111.A N ALA 119.A O no hydrogen 2.951 N/A SER 112.A OG GLY 116.A O no hydrogen 2.944 N/A VAL 114.A N ARG 111.A O no hydrogen 3.112 N/A TYR 115.A N ARG 111.A O no hydrogen 2.936 N/A TYR 115.A OH THR 8.A O no hydrogen 2.496 N/A GLY 116.A N SER 112.A O no hydrogen 2.791 N/A SER 117.A OG ASP 118.A OD2 no hydrogen 3.181 N/A ASP 118.A N TYR 375.A O no hydrogen 2.949 N/A ILE 120.A N HIS 72.A O no hydrogen 3.098 N/A GLY 121.A N HIS 72.A O no hydrogen 2.859 N/A VAL 123.A N ILE 107.A O no hydrogen 3.071 N/A VAL 124.A N LEU 74.A O no hydrogen 2.915 N/A ASN 125.A N GLU 105.A O no hydrogen 2.860 N/A ASN 125.A ND2 THR 8.A OG1 no hydrogen 3.149 N/A ILE 126.A N LEU 76.A O no hydrogen 2.703 N/A ILE 127.A N ARG 103.A O no hydrogen 2.844 N/A THR 128.A N ASP 78.A OD1 no hydrogen 2.686 N/A THR 128.A OG1 ASP 78.A OD1 no hydrogen 3.031 N/A THR 128.A OG1 ASP 78.A OD2 no hydrogen 2.733 N/A THR 128.A OG1 TYR 185.A OH no hydrogen 3.044 N/A GLY 134.A N GLN 154.A O no hydrogen 3.142 N/A THR 135.A N PHE 576.A O no hydrogen 3.148 N/A GLU 136.A N SER 152.A O no hydrogen 2.857 N/A ILE 137.A N TYR 574.A O no hydrogen 3.266 N/A SER 138.A N ASP 150.A O no hydrogen 2.834 N/A SER 138.A OG ASP 150.A O no hydrogen 2.934 N/A ALA 139.A N GLY 572.A O no hydrogen 2.841 N/A GLY 140.A N ASN 148.A O no hydrogen 2.672 N/A TRP 141.A N LEU 570.A O no hydrogen 2.674 N/A GLY 142.A N TYR 146.A O no hydrogen 2.752 N/A SER 143.A N TYR 568.A O no hydrogen 2.902 N/A SER 143.A OG TYR 568.A O no hydrogen 3.208 N/A SER 145.A OG HIS 173.A ND1 no hydrogen 2.945 N/A GLN 147.A N HIS 171.A O no hydrogen 2.805 N/A ASN 148.A N GLY 140.A O no hydrogen 2.816 N/A ASN 148.A ND2 TYR 169.A O no hydrogen 3.513 N/A TYR 149.A N TYR 169.A O no hydrogen 2.979 N/A ASP 150.A N SER 138.A O no hydrogen 2.683 N/A VAL 151.A N GLY 167.A O no hydrogen 3.119 N/A SER 152.A N GLU 136.A O no hydrogen 3.246 N/A THR 153.A N LEU 165.A O no hydrogen 2.735 N/A THR 153.A OG1 GLY 134.A O no hydrogen 3.211 N/A GLN 154.A N GLY 134.A O no hydrogen 2.891 N/A GLN 155.A N VAL 163.A O no hydrogen 2.777 N/A GLN 156.A NE2 GLY 158.A O no hydrogen 3.533 N/A LEU 157.A N THR 161.A O no hydrogen 2.721 N/A ARG 162.A N GLU 189.A O no hydrogen 2.958 N/A VAL 163.A N GLN 155.A O no hydrogen 2.787 N/A THR 164.A N ALA 187.A O no hydrogen 2.754 N/A THR 164.A OG1 GLN 154.A OE1 no hydrogen 3.353 N/A LEU 165.A N THR 153.A O no hydrogen 2.663 N/A LEU 166.A N TYR 185.A O no hydrogen 2.795 N/A GLY 167.A N VAL 151.A O no hydrogen 2.973 N/A ASP 168.A N THR 183.A O no hydrogen 2.812 N/A TYR 169.A N TYR 149.A O no hydrogen 3.104 N/A ALA 170.A N SER 181.A O no hydrogen 2.896 N/A HIS 171.A N GLN 147.A O no hydrogen 2.850 N/A THR 172.A N PHE 179.A O no hydrogen 3.087 N/A HIS 173.A N ASN 144.A O no hydrogen 2.918 N/A PHE 179.A N THR 172.A O no hydrogen 2.972 N/A LEU 180.A N ARG 208.A O no hydrogen 2.671 N/A SER 181.A N ALA 170.A O no hydrogen 2.810 N/A LYS 182.A N ASP 206.A O no hydrogen 2.854 N/A THR 183.A N ASP 168.A O no hydrogen 2.732 N/A LEU 184.A N GLY 204.A O no hydrogen 2.995 N/A TYR 185.A N LEU 166.A O no hydrogen 2.711 N/A TYR 185.A OH THR 128.A OG1 no hydrogen 3.044 N/A GLY 186.A N GLY 202.A O no hydrogen 2.778 N/A ALA 187.A N THR 164.A O no hydrogen 2.858 N/A LEU 188.A N VAL 200.A O no hydrogen 3.122 N/A GLU 189.A N ARG 162.A O no hydrogen 2.910 N/A HIS 190.A N GLY 198.A O no hydrogen 2.719 N/A ASN 191.A N LYS 160.A O no hydrogen 2.798 N/A THR 193.A N TRP 196.A O no hydrogen 3.176 N/A TRP 196.A N THR 193.A OG1 no hydrogen 3.296 N/A SER 197.A N ARG 237.A O no hydrogen 2.807 N/A SER 197.A OG ARG 237.A O no hydrogen 2.988 N/A GLY 198.A N HIS 190.A O no hydrogen 3.131 N/A PHE 199.A N GLY 235.A O no hydrogen 3.319 N/A VAL 200.A N LEU 188.A O no hydrogen 3.186 N/A ARG 201.A NH1 TYR 185.A OH no hydrogen 3.355 N/A GLY 202.A N GLY 186.A O no hydrogen 2.862 N/A TYR 203.A N SER 231.A O no hydrogen 3.175 N/A GLY 204.A N LEU 184.A O no hydrogen 2.912 N/A TYR 205.A N SER 229.A O no hydrogen 2.812 N/A ASP 206.A N LYS 182.A O no hydrogen 2.803 N/A ASN 207.A N LEU 227.A O no hydrogen 2.738 N/A ASN 207.A ND2 LEU 180.A O no hydrogen 3.572 N/A ASN 207.A ND2 SER 181.A OG no hydrogen 2.714 N/A ARG 208.A N LEU 180.A O no hydrogen 2.800 N/A ARG 208.A NH1 ASP 177.A OD1 no hydrogen 3.098 N/A ARG 208.A NH2 ASP 177.A OD1 no hydrogen 3.288 N/A THR 209.A N ARG 225.A O no hydrogen 2.843 N/A ASN 210.A N GLY 178.A O no hydrogen 2.866 N/A TYR 211.A N ASP 223.A O no hydrogen 3.022 N/A TYR 211.A OH LEU 222.A O no hydrogen 2.932 N/A TYR 211.A OH ASN 258.A OD1 no hydrogen 2.478 N/A SER 219.A N SER 216.A O no hydrogen 3.155 N/A THR 224.A OG1 ASN 210.A OD1 no hydrogen 2.980 N/A THR 224.A OG1 ASP 223.A OD2 no hydrogen 2.820 N/A ARG 225.A N THR 209.A O no hydrogen 2.808 N/A ARG 225.A NE ASP 256.A OD1 no hydrogen 2.511 N/A ARG 225.A NE ASP 256.A OD2 no hydrogen 3.129 N/A ARG 225.A NH2 ASP 256.A OD2 no hydrogen 3.275 N/A LYS 226.A N TYR 257.A O no hydrogen 2.886 N/A LEU 227.A N ASN 207.A O no hydrogen 2.839 N/A TYR 228.A N LYS 255.A O no hydrogen 2.860 N/A SER 229.A N TYR 205.A O no hydrogen 3.106 N/A GLN 230.A N HIS 253.A O no hydrogen 2.926 N/A SER 231.A N TYR 203.A O no hydrogen 2.912 N/A SER 231.A OG SER 252.A OG no hydrogen 3.049 N/A TRP 232.A N TYR 251.A O no hydrogen 2.967 N/A TRP 232.A NE1 GLN 230.A OE1 no hydrogen 2.688 N/A ASP 233.A N ARG 201.A O no hydrogen 2.767 N/A ALA 234.A N THR 249.A O no hydrogen 2.795 N/A GLY 235.A N PHE 199.A O no hydrogen 2.761 N/A LEU 236.A N LEU 247.A O no hydrogen 2.900 N/A ARG 237.A N SER 197.A O no hydrogen 2.609 N/A ARG 237.A NH1 GLN 246.A OE1 no hydrogen 2.660 N/A ARG 237.A NH2 GLN 246.A OE1 no hydrogen 3.545 N/A TYR 238.A N SER 245.A O no hydrogen 3.037 N/A ASN 239.A N ALA 195.A O no hydrogen 2.928 N/A GLY 240.A N ILE 243.A O no hydrogen 3.158 N/A LYS 244.A N ASN 285.A O no hydrogen 2.757 N/A SER 245.A N TYR 238.A O no hydrogen 2.745 N/A GLN 246.A N ALA 283.A O no hydrogen 2.828 N/A LEU 247.A N LEU 236.A O no hydrogen 2.986 N/A ILE 248.A N GLN 281.A O no hydrogen 2.975 N/A THR 249.A N ALA 234.A O no hydrogen 2.956 N/A THR 249.A OG1 ALA 234.A O no hydrogen 3.027 N/A SER 250.A N THR 279.A O no hydrogen 2.945 N/A SER 250.A OG ASP 233.A OD2 no hydrogen 2.953 N/A TYR 251.A N TRP 232.A O no hydrogen 2.977 N/A SER 252.A N GLN 277.A O no hydrogen 2.733 N/A SER 252.A OG SER 231.A OG no hydrogen 3.049 N/A HIS 253.A N GLN 230.A O no hydrogen 2.977 N/A HIS 253.A NE2 GLU 274.A OE2 no hydrogen 3.111 N/A SER 254.A N MET 275.A O no hydrogen 3.151 N/A LYS 255.A N TYR 228.A O no hydrogen 2.625 N/A ASP 256.A N ASP 273.A O no hydrogen 3.018 N/A TYR 257.A N LYS 226.A O no hydrogen 2.796 N/A ASN 258.A N THR 271.A O no hydrogen 2.889 N/A TYR 259.A N THR 224.A O no hydrogen 3.061 N/A GLY 264.A N ASP 260.A O no hydrogen 2.821 N/A SER 269.A N ASP 267.A OD2 no hydrogen 3.297 N/A SER 269.A OG ASP 267.A OD2 no hydrogen 2.594 N/A ALA 270.A N ASP 267.A O no hydrogen 3.006 N/A THR 271.A N ASN 258.A O no hydrogen 2.794 N/A THR 271.A OG1 ASN 258.A O no hydrogen 3.513 N/A ASP 273.A N ASP 256.A O no hydrogen 3.033 N/A GLU 274.A N THR 308.A OG1 no hydrogen 3.044 N/A MET 275.A N SER 254.A O no hydrogen 3.125 N/A LYS 276.A N THR 303.A O no hydrogen 2.846 N/A GLN 277.A N SER 252.A O no hydrogen 2.682 N/A TYR 278.A N LYS 301.A O no hydrogen 2.742 N/A THR 279.A N SER 250.A O no hydrogen 2.905 N/A THR 279.A OG1 SER 250.A O no hydrogen 3.537 N/A VAL 280.A N TRP 299.A O no hydrogen 3.087 N/A GLN 281.A N ILE 248.A O no hydrogen 2.779 N/A TRP 282.A N VAL 297.A O no hydrogen 2.652 N/A TRP 282.A NE1 SER 245.A OG no hydrogen 3.284 N/A ALA 283.A N GLN 246.A O no hydrogen 2.832 N/A ASN 284.A ND2 LYS 244.A O no hydrogen 3.461 N/A ASN 284.A ND2 SER 245.A OG no hydrogen 3.422 N/A ASN 285.A N LYS 244.A O no hydrogen 3.048 N/A ASN 285.A ND2 SER 292.A OG no hydrogen 3.208 N/A VAL 286.A N ILE 293.A O no hydrogen 2.829 N/A ILE 287.A N LEU 242.A O no hydrogen 2.819 N/A VAL 288.A N GLY 291.A O no hydrogen 3.199 N/A SER 292.A N LEU 327.A O no hydrogen 2.839 N/A SER 292.A OG ASN 285.A OD1 no hydrogen 3.142 N/A ILE 293.A N VAL 286.A O no hydrogen 2.884 N/A GLY 294.A N THR 325.A O no hydrogen 2.460 N/A ALA 295.A N ASN 284.A O no hydrogen 2.938 N/A GLY 296.A N TYR 323.A O no hydrogen 3.177 N/A VAL 297.A N TRP 282.A O no hydrogen 2.769 N/A ASP 298.A N GLY 321.A O no hydrogen 2.881 N/A TRP 299.A N VAL 280.A O no hydrogen 2.862 N/A GLN 300.A N ASN 319.A O no hydrogen 2.789 N/A GLN 300.A NE2 GLN 277.A OE1 no hydrogen 3.577 N/A LYS 301.A N TYR 278.A O no hydrogen 2.870 N/A GLN 302.A N GLN 317.A O no hydrogen 2.907 N/A THR 303.A N LYS 276.A O no hydrogen 2.801 N/A THR 304.A N TYR 315.A O no hydrogen 3.043 N/A THR 305.A N GLU 274.A O no hydrogen 3.339 N/A THR 305.A OG1 GLU 274.A OE1 no hydrogen 3.537 N/A GLY 307.A N VAL 311.A O no hydrogen 2.968 N/A THR 308.A N THR 305.A O no hydrogen 2.718 N/A THR 308.A OG1 LEU 272.A O no hydrogen 3.479 N/A THR 308.A OG1 GLU 274.A O no hydrogen 3.163 N/A THR 308.A OG1 THR 305.A O no hydrogen 2.768 N/A GLY 309.A N ASP 273.A OD2 no hydrogen 2.962 N/A TYR 315.A N THR 304.A OG1 no hydrogen 2.952 N/A TYR 315.A OH ASP 313.A OD1 no hydrogen 3.221 N/A GLN 317.A N GLN 302.A O no hydrogen 3.019 N/A ARG 318.A N SER 345.A OG no hydrogen 3.077 N/A ASN 319.A N GLN 300.A O no hydrogen 2.863 N/A THR 320.A N ASP 343.A O no hydrogen 3.070 N/A GLY 321.A N ASP 298.A O no hydrogen 2.787 N/A ILE 322.A N SER 341.A O no hydrogen 3.279 N/A TYR 323.A N GLY 296.A O no hydrogen 3.072 N/A LEU 324.A N ALA 339.A O no hydrogen 2.900 N/A THR 325.A N GLY 294.A O no hydrogen 2.512 N/A THR 325.A OG1 GLY 337.A O no hydrogen 2.961 N/A GLY 326.A N GLY 337.A O no hydrogen 2.701 N/A LEU 327.A N SER 292.A O no hydrogen 2.929 N/A GLN 328.A N PHE 335.A O no hydrogen 2.998 N/A GLN 328.A NE2 VAL 288.A O no hydrogen 2.796 N/A GLN 328.A NE2 LEU 327.A O no hydrogen 3.583 N/A GLN 329.A N HIS 290.A O no hydrogen 2.829 N/A PHE 333.A N VAL 330.A O no hydrogen 2.819 N/A THR 334.A OG1 PHE 333.A O no hydrogen 2.782 N/A THR 334.A OG1 GLY 358.A O no hydrogen 3.449 N/A PHE 335.A N GLN 328.A O no hydrogen 2.992 N/A GLU 336.A N SER 356.A O no hydrogen 3.012 N/A GLY 337.A N GLY 326.A O no hydrogen 2.812 N/A ALA 338.A N GLN 354.A O no hydrogen 3.158 N/A ALA 339.A N LEU 324.A O no hydrogen 2.694 N/A ARG 340.A N THR 352.A O no hydrogen 2.930 N/A ARG 340.A NH2 ASP 298.A OD2 no hydrogen 3.337 N/A SER 341.A N ILE 322.A O no hydrogen 3.017 N/A ASP 342.A N HIS 350.A O no hydrogen 2.966 N/A ASP 343.A N THR 320.A O no hydrogen 2.800 N/A ASN 344.A N GLY 348.A O no hydrogen 2.899 N/A ASN 344.A ND2 ARG 318.A O no hydrogen 2.770 N/A SER 345.A N ARG 318.A O no hydrogen 2.893 N/A SER 345.A OG ARG 318.A O no hydrogen 3.363 N/A GLN 346.A NE2 PRO 390.A O no hydrogen 2.601 N/A ARG 349.A NE SER 341.A OG no hydrogen 3.003 N/A HIS 350.A N ASP 342.A O no hydrogen 2.904 N/A THR 352.A N ARG 340.A O no hydrogen 3.044 N/A TRP 353.A N THR 373.A OG1 no hydrogen 3.155 N/A GLN 354.A N ALA 338.A O no hydrogen 3.188 N/A THR 355.A N TYR 371.A O no hydrogen 2.962 N/A SER 356.A N GLU 336.A O no hydrogen 2.932 N/A SER 356.A OG GLU 336.A OE2 no hydrogen 3.370 N/A ALA 357.A N ALA 369.A O no hydrogen 2.932 N/A GLU 360.A N ASP 332.A O no hydrogen 2.896 N/A ILE 362.A N TYR 365.A O no hydrogen 3.330 N/A TYR 365.A N ILE 362.A O no hydrogen 2.824 N/A TYR 365.A OH THR 408.A OG1 no hydrogen 2.497 N/A ARG 366.A N GLU 405.A O no hydrogen 2.920 N/A ARG 366.A NE GLU 405.A OE1 no hydrogen 2.995 N/A PHE 367.A N TRP 359.A O no hydrogen 3.262 N/A ILE 368.A N ALA 403.A O no hydrogen 2.758 N/A ALA 369.A N ALA 357.A O no hydrogen 3.346 N/A SER 370.A N GLU 401.A O no hydrogen 2.875 N/A SER 370.A OG GLU 401.A O no hydrogen 3.436 N/A TYR 371.A N THR 355.A O no hydrogen 3.102 N/A GLY 372.A N GLN 399.A O no hydrogen 2.822 N/A THR 373.A N TRP 353.A O no hydrogen 3.005 N/A SER 374.A N SER 397.A O no hydrogen 2.833 N/A SER 374.A OG SER 397.A OG no hydrogen 3.165 N/A TYR 375.A N SER 112.A OG no hydrogen 3.011 N/A LYS 376.A N GLU 395.A O no hydrogen 2.760 N/A LYS 376.A NZ SER 71.A O no hydrogen 3.334 N/A LYS 376.A NZ GLY 89.A O no hydrogen 2.865 N/A ALA 377.A N SER 117.A OG no hydrogen 3.034 N/A GLN 382.A N ASN 379.A OD1 no hydrogen 3.324 N/A LEU 383.A N LEU 380.A O no hydrogen 3.342 N/A TYR 384.A N LEU 380.A O no hydrogen 3.113 N/A GLY 385.A N GLY 381.A O no hydrogen 2.971 N/A ASN 389.A N GLN 382.A O no hydrogen 3.012 N/A GLU 395.A N LYS 376.A O no hydrogen 2.570 N/A LYS 396.A N SER 423.A O no hydrogen 2.875 N/A SER 397.A OG SER 374.A OG no hydrogen 3.165 N/A SER 397.A OG ASN 420.A OD1 no hydrogen 3.199 N/A LYS 398.A N ASP 421.A O no hydrogen 3.187 N/A GLN 399.A N GLY 372.A O no hydrogen 2.832 N/A GLN 399.A NE2 ILE 120.A O no hydrogen 2.643 N/A TRP 400.A N ARG 419.A O no hydrogen 2.907 N/A GLU 401.A N SER 370.A O no hydrogen 2.880 N/A GLY 402.A N GLY 417.A O no hydrogen 3.031 N/A ALA 403.A N ILE 368.A O no hydrogen 2.690 N/A PHE 404.A N ILE 415.A O no hydrogen 2.890 N/A GLU 405.A N ARG 366.A O no hydrogen 2.964 N/A GLY 406.A N TRP 413.A O no hydrogen 3.300 N/A LEU 407.A N GLY 364.A O no hydrogen 2.961 N/A THR 408.A N VAL 411.A O no hydrogen 2.725 N/A THR 408.A OG1 TYR 365.A OH no hydrogen 2.497 N/A VAL 411.A N THR 408.A O no hydrogen 2.743 N/A ASN 412.A N ASN 451.A O no hydrogen 3.156 N/A TRP 413.A N GLY 406.A O no hydrogen 3.084 N/A TRP 413.A NE1 THR 408.A OG1 no hydrogen 3.029 N/A ARG 414.A N THR 449.A O no hydrogen 2.771 N/A ILE 415.A N PHE 404.A O no hydrogen 3.218 N/A SER 416.A N GLU 447.A O no hydrogen 2.988 N/A SER 416.A OG GLU 447.A O no hydrogen 3.366 N/A GLY 417.A N GLY 402.A O no hydrogen 2.880 N/A TYR 418.A N GLY 445.A O no hydrogen 2.982 N/A ARG 419.A N TRP 400.A O no hydrogen 2.696 N/A ARG 419.A NE ASP 421.A OD2 no hydrogen 2.879 N/A ARG 419.A NH2 ASP 421.A OD2 no hydrogen 3.234 N/A ASN 420.A N ILE 443.A O no hydrogen 2.789 N/A ASP 421.A N LYS 398.A O no hydrogen 2.718 N/A SER 423.A N LYS 396.A O no hydrogen 2.592 N/A LEU 425.A N GLY 439.A O no hydrogen 2.714 N/A ILE 426.A N GLU 395.A OE2 no hydrogen 2.900 N/A ASP 427.A N TYR 436.A O no hydrogen 2.846 N/A ASP 429.A N LYS 434.A O no hydrogen 3.061 N/A HIS 431.A N ASP 429.A OD1 no hydrogen 3.367 N/A THR 432.A OG1 ASP 429.A OD2 no hydrogen 2.709 N/A LEU 433.A N ASP 429.A O no hydrogen 2.909 N/A TYR 435.A N TYR 387.A O no hydrogen 2.614 N/A TYR 436.A N ASP 427.A O no hydrogen 2.699 N/A ASN 437.A ND2 ASP 393.A O no hydrogen 3.425 N/A GLY 439.A N ASP 427.A OD2 no hydrogen 2.806 N/A ALA 441.A N VAL 422.A O no hydrogen 2.783 N/A ARG 442.A N ARG 469.A O no hydrogen 3.201 N/A ILE 443.A N ASN 420.A O no hydrogen 2.837 N/A GLY 445.A N TYR 418.A O no hydrogen 3.240 N/A VAL 446.A N TYR 465.A O no hydrogen 2.910 N/A GLU 447.A N SER 416.A O no hydrogen 2.732 N/A ALA 448.A N TYR 463.A O no hydrogen 2.772 N/A THR 449.A N ARG 414.A O no hydrogen 2.956 N/A ALA 450.A N VAL 461.A O no hydrogen 3.161 N/A ASN 451.A N ASN 412.A O no hydrogen 3.036 N/A PHE 452.A N HIS 459.A O no hydrogen 2.963 N/A THR 454.A N LEU 457.A O no hydrogen 2.841 N/A THR 454.A OG1 HIS 459.A NE2 no hydrogen 2.766 N/A LEU 457.A N THR 454.A O no hydrogen 3.147 N/A THR 458.A N ASP 490.A O no hydrogen 2.666 N/A THR 458.A OG1 ASP 453.A OD1 no hydrogen 3.397 N/A HIS 459.A N PHE 452.A O no hydrogen 2.816 N/A HIS 459.A NE2 THR 454.A OG1 no hydrogen 2.766 N/A THR 460.A N GLN 488.A O no hydrogen 2.971 N/A VAL 461.A N ALA 450.A O no hydrogen 3.218 N/A SER 462.A N LYS 486.A O no hydrogen 2.791 N/A TYR 463.A N ALA 448.A O no hydrogen 2.486 N/A ASP 464.A N GLN 484.A O no hydrogen 3.219 N/A TYR 465.A N VAL 446.A O no hydrogen 2.898 N/A VAL 466.A N LYS 482.A O no hydrogen 3.056 N/A ASP 467.A N LYS 444.A O no hydrogen 3.037 N/A ARG 469.A N ARG 442.A O no hydrogen 3.418 N/A ARG 469.A NH1 ASP 474.A O no hydrogen 2.947 N/A ASN 470.A N THR 475.A O no hydrogen 2.777 N/A ALA 471.A N LYS 440.A O no hydrogen 3.164 N/A ILE 472.A N ASN 470.A OD1 no hydrogen 3.396 N/A ASP 474.A N ASN 470.A O no hydrogen 2.935 N/A THR 475.A N THR 473.A OG1 no hydrogen 3.270 N/A LEU 477.A N ALA 468.A O no hydrogen 2.970 N/A ARG 479.A N TYR 509.A O no hydrogen 2.681 N/A ARG 479.A NH1 ASP 510.A OD1 no hydrogen 2.709 N/A ARG 479.A NH1 ASP 510.A OD2 no hydrogen 3.212 N/A ARG 480.A NE GLY 67.A O no hydrogen 2.787 N/A ARG 480.A NH1 LEU 478.A O no hydrogen 3.446 N/A ARG 480.A NH2 GLY 67.A O no hydrogen 3.153 N/A ALA 481.A N ASP 50.A OD2 no hydrogen 2.668 N/A LYS 482.A N THR 507.A O no hydrogen 3.388 N/A GLN 484.A N ASP 464.A O no hydrogen 3.203 N/A GLN 484.A NE2 VAL 49.A O no hydrogen 2.846 N/A VAL 485.A N TYR 504.A O no hydrogen 2.688 N/A LYS 486.A N SER 462.A O no hydrogen 3.087 N/A LYS 486.A NZ LEU 46.A O no hydrogen 3.473 N/A LYS 486.A NZ VAL 49.A O no hydrogen 3.250 N/A TYR 487.A N TYR 502.A O no hydrogen 3.092 N/A TYR 487.A OH HIS 459.A ND1 no hydrogen 2.482 N/A GLN 488.A N THR 460.A O no hydrogen 3.171 N/A LEU 489.A N ILE 500.A O no hydrogen 3.101 N/A ASP 490.A N THR 458.A O no hydrogen 2.836 N/A TRP 491.A N TRP 498.A O no hydrogen 3.097 N/A GLN 492.A N GLN 492.A OE1 no hydrogen 2.925 N/A LEU 493.A N PHE 496.A O no hydrogen 2.519 N/A PHE 496.A N LEU 493.A O no hydrogen 3.162 N/A ASP 497.A N ALA 534.A O no hydrogen 2.773 N/A ILE 500.A N LEU 489.A O no hydrogen 2.805 N/A THR 501.A N ASP 530.A O no hydrogen 3.242 N/A TYR 502.A N TYR 487.A O no hydrogen 2.698 N/A TYR 502.A OH SER 527.A OG no hydrogen 2.918 N/A GLN 503.A N LEU 528.A O no hydrogen 2.910 N/A GLN 503.A NE2 ARG 44.A O no hydrogen 3.495 N/A TYR 504.A N VAL 485.A O no hydrogen 2.677 N/A LEU 505.A N VAL 526.A O no hydrogen 3.196 N/A GLY 506.A N GLN 483.A O no hydrogen 2.967 N/A LYS 511.A N ASP 510.A OD1 no hydrogen 2.816 N/A LYS 511.A NZ TYR 518.A O no hydrogen 3.000 N/A ASP 512.A N GLN 519.A O no hydrogen 2.754 N/A SER 514.A N ASP 512.A OD1 no hydrogen 3.192 N/A SER 514.A OG ASP 512.A OD1 no hydrogen 3.372 N/A VAL 521.A N ASP 510.A O no hydrogen 2.689 N/A MET 523.A N ARG 508.A O no hydrogen 3.134 N/A VAL 526.A N LEU 505.A O no hydrogen 3.233 N/A SER 527.A OG TYR 502.A OH no hydrogen 2.918 N/A LEU 528.A N GLN 503.A O no hydrogen 2.632 N/A ASP 530.A N THR 501.A O no hydrogen 2.936 N/A LEU 531.A N ILE 547.A O no hydrogen 3.056 N/A ALA 532.A N GLY 499.A O no hydrogen 3.256 N/A VAL 533.A N GLY 545.A O no hydrogen 2.924 N/A ALA 534.A N ASP 497.A O no hydrogen 3.034 N/A TYR 535.A N VAL 543.A O no hydrogen 2.859 N/A THR 538.A N LEU 541.A O no hydrogen 3.223 N/A THR 542.A N SER 573.A O no hydrogen 3.022 N/A THR 542.A OG1 HIS 540.A O no hydrogen 3.545 N/A VAL 543.A N TYR 535.A O no hydrogen 2.853 N/A ARG 544.A N SER 571.A O no hydrogen 2.706 N/A GLY 545.A N VAL 533.A O no hydrogen 2.748 N/A LYS 546.A N THR 569.A O no hydrogen 2.912 N/A LYS 546.A NZ GLN 35.A O no hydrogen 3.001 N/A ILE 547.A N LEU 531.A O no hydrogen 2.908 N/A ALA 548.A N GLU 567.A O no hydrogen 2.954 N/A ASN 549.A N ASP 530.A OD1 no hydrogen 3.398 N/A ASN 549.A ND2 LYS 553.A O no hydrogen 3.490 N/A LEU 550.A N TRP 529.A O no hydrogen 2.928 N/A ASP 552.A N ASN 549.A O no hydrogen 3.238 N/A LYS 553.A N ASN 549.A OD1 no hydrogen 3.327 N/A THR 557.A OG1 GLN 53.A O no hydrogen 3.410 N/A TYR 559.A N ASP 510.A OD2 no hydrogen 2.942 N/A GLY 560.A N GLU 556.A OE1 no hydrogen 3.507 N/A TYR 561.A N VAL 558.A O no hydrogen 2.983 N/A TYR 561.A OH ASP 212.A OD1 no hydrogen 3.271 N/A ARG 566.A N ASP 552.A OD2 no hydrogen 2.692 N/A ARG 566.A NE TYR 568.A OH no hydrogen 3.299 N/A TYR 568.A N SER 143.A OG no hydrogen 2.712 N/A THR 569.A N LYS 546.A O no hydrogen 2.931 N/A LEU 570.A N TRP 141.A O no hydrogen 2.698 N/A SER 571.A N ARG 544.A O no hydrogen 2.872 N/A SER 571.A OG ARG 544.A O no hydrogen 3.169 N/A GLY 572.A N ALA 139.A O no hydrogen 2.992 N/A SER 573.A N THR 542.A O no hydrogen 3.102 N/A TYR 574.A N ILE 137.A O no hydrogen 2.665 N/A THR 575.A N HIS 540.A O no hydrogen 3.162 N/A PHE 576.A N THR 135.A O no hydrogen 3.021 N/A