Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rgm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N GLN 11.A O no hydrogen 2.807 N/A VAL 4.A N GLU 102.A OE1 no hydrogen 2.995 N/A THR 5.A OG1 GLU 102.A OE1 no hydrogen 2.564 N/A ARG 8.A NH2 VAL 111.A O no hydrogen 2.827 N/A ARG 8.A NH2 ASP 270.A OD2 no hydrogen 2.989 N/A PHE 9.A N ASN 7.A OD1 no hydrogen 2.917 N/A GLN 11.A N VAL 3.A O no hydrogen 2.837 N/A GLN 11.A NE2 THR 15.A OG1 no hydrogen 3.035 N/A ARG 13.A N THR 1.A O no hydrogen 2.919 N/A THR 15.A N PRO 12.A O no hydrogen 2.968 N/A THR 15.A OG1 PRO 12.A O no hydrogen 2.580 N/A VAL 16.A N ARG 13.A O no hydrogen 2.946 N/A LEU 17.A N GLU 308.A OE2 no hydrogen 2.851 N/A THR 21.A N TYR 103.A O no hydrogen 2.915 N/A VAL 23.A N VAL 101.A O no hydrogen 3.016 N/A THR 24.A N ASP 27.A OD2 no hydrogen 2.605 N/A THR 24.A OG1 ASP 27.A OD2 no hydrogen 2.999 N/A ASP 27.A N THR 24.A OG1 no hydrogen 3.327 N/A ILE 28.A N THR 24.A O no hydrogen 3.131 N/A ASP 29.A N ARG 25.A O no hydrogen 2.909 N/A ARG 30.A N GLN 26.A O no hydrogen 2.988 N/A ARG 30.A NE ASP 469.A OD1 no hydrogen 2.782 N/A ARG 30.A NE ASP 469.A OD2 no hydrogen 3.266 N/A ARG 30.A NH1 ASP 462.A OD1 no hydrogen 2.870 N/A ARG 30.A NH2 ASP 462.A OD1 no hydrogen 3.010 N/A ARG 30.A NH2 ASP 469.A OD2 no hydrogen 3.159 N/A TRP 31.A N ASP 27.A O no hydrogen 2.904 N/A GLN 32.A N ILE 28.A O no hydrogen 2.887 N/A GLN 32.A NE2 VAL 505.A O no hydrogen 3.065 N/A GLN 32.A NE2 GLY 517.A O no hydrogen 2.824 N/A SER 33.A OG ASP 38.A OD1 no hydrogen 2.415 N/A ASN 37.A ND2 SER 58.A OG no hydrogen 3.039 N/A ASP 38.A N SER 35.A OG no hydrogen 3.183 N/A VAL 39.A N VAL 36.A O no hydrogen 2.896 N/A LEU 40.A N VAL 36.A O no hydrogen 3.033 N/A ARG 41.A N ASN 37.A O no hydrogen 2.760 N/A ARG 41.A NE ASP 38.A OD2 no hydrogen 3.214 N/A ARG 41.A NH2 ASP 38.A OD2 no hydrogen 3.302 N/A ARG 41.A NH2 ASP 502.A OD2 no hydrogen 2.824 N/A ARG 42.A N VAL 39.A O no hydrogen 3.219 N/A ARG 42.A NE ASP 38.A O no hydrogen 2.978 N/A ARG 42.A NH2 ASP 38.A OD1 no hydrogen 2.779 N/A LEU 43.A N LEU 40.A O no hydrogen 3.121 N/A GLY 45.A N ASP 436.A OD2 no hydrogen 2.641 N/A VAL 46.A N LEU 43.A O no hydrogen 3.397 N/A ASP 47.A N PHE 61.A O no hydrogen 3.044 N/A THR 49.A N SER 59.A O no hydrogen 2.973 N/A GLN 50.A N THR 529.A OG1 no hydrogen 2.919 N/A GLN 50.A NE2 GLN 56.A O no hydrogen 3.479 N/A ASN 51.A N LEU 57.A O no hydrogen 3.004 N/A GLY 52.A N GLN 50.A O no hydrogen 2.796 N/A GLN 56.A N GLY 53.A O no hydrogen 3.327 N/A GLN 56.A NE2 ASN 204.A O no hydrogen 3.481 N/A SER 58.A N ASP 89.A OD1 no hydrogen 3.283 N/A SER 58.A N ASP 89.A OD2 no hydrogen 3.213 N/A SER 58.A OG ASP 89.A OD1 no hydrogen 2.802 N/A SER 59.A N THR 49.A O no hydrogen 2.951 N/A PHE 61.A N ASP 47.A O no hydrogen 2.937 N/A ARG 63.A N GLY 45.A O no hydrogen 2.854 N/A ARG 63.A NH1 GLU 373.A OE2 no hydrogen 2.872 N/A ARG 63.A NH2 GLU 373.A OE1 no hydrogen 2.958 N/A ARG 63.A NH2 GLU 419.A OE1 no hydrogen 2.879 N/A THR 65.A N ILE 62.A O no hydrogen 3.022 N/A THR 65.A OG1 ILE 62.A O no hydrogen 2.726 N/A HIS 69.A N ASN 66.A O no hydrogen 2.964 N/A HIS 69.A NE2 GLU 367.A OE1 no hydrogen 2.628 N/A LEU 71.A N GLY 119.A O no hydrogen 3.242 N/A LEU 73.A N VAL 121.A O no hydrogen 2.730 N/A ILE 74.A N VAL 77.A O no hydrogen 2.723 N/A ASP 75.A N ILE 123.A O no hydrogen 2.832 N/A GLY 76.A N ASN 122.A OD1 no hydrogen 2.989 N/A VAL 77.A N ILE 74.A O no hydrogen 2.839 N/A ARG 78.A NE ASP 115.A OD2 no hydrogen 3.043 N/A ARG 78.A NH1 GLN 272.A OE1 no hydrogen 2.657 N/A ARG 78.A NH2 TYR 112.A O no hydrogen 3.344 N/A ARG 78.A NH2 SER 114.A O no hydrogen 2.812 N/A LEU 79.A N VAL 72.A O no hydrogen 2.795 N/A ASN 80.A ND2 SER 211.A OG no hydrogen 2.656 N/A ALA 82.A N LEU 79.A O no hydrogen 3.351 N/A GLY 83.A N ASN 80.A O no hydrogen 2.926 N/A SER 87.A N ALA 82.A O no hydrogen 3.218 N/A SER 91.A N ASP 89.A OD1 no hydrogen 3.134 N/A SER 91.A OG GLN 56.A O no hydrogen 3.003 N/A SER 91.A OG ASP 89.A OD1 no hydrogen 2.719 N/A SER 91.A OG ASP 89.A OD2 no hydrogen 3.564 N/A GLN 92.A NE2 GLY 55.A O no hydrogen 3.059 N/A GLN 92.A NE2 THR 203.A OG1 no hydrogen 3.315 N/A PHE 93.A N LEU 90.A O no hydrogen 3.065 N/A LEU 97.A N PRO 94.A O no hydrogen 3.099 N/A VAL 98.A N ILE 95.A O no hydrogen 3.014 N/A GLN 99.A N ILE 124.A O no hydrogen 2.880 N/A ARG 100.A N ILE 124.A O no hydrogen 3.234 N/A ARG 100.A NE GLU 102.A OE2 no hydrogen 2.999 N/A ARG 100.A NH2 LEU 2.A O no hydrogen 2.736 N/A VAL 101.A N VAL 23.A O no hydrogen 2.948 N/A GLU 102.A N ASN 122.A O no hydrogen 3.027 N/A TYR 103.A N THR 21.A O no hydrogen 2.871 N/A TYR 103.A OH PRO 44.A O no hydrogen 2.627 N/A ILE 104.A N VAL 120.A O no hydrogen 2.946 N/A ARG 105.A N PRO 19.A O no hydrogen 3.006 N/A ARG 105.A NE GLU 419.A OE1 no hydrogen 2.730 N/A ARG 105.A NH1 THR 21.A OG1 no hydrogen 2.867 N/A ARG 105.A NH2 GLU 419.A OE2 no hydrogen 2.673 N/A GLY 106.A N GLY 118.A O no hydrogen 2.888 N/A ARG 108.A N ALA 116.A O no hydrogen 3.032 N/A ARG 108.A NH1 ALA 6.A O no hydrogen 2.836 N/A SER 109.A OG GLY 113.A O no hydrogen 2.694 N/A VAL 111.A N ARG 108.A O no hydrogen 3.235 N/A TYR 112.A N ARG 108.A O no hydrogen 2.952 N/A TYR 112.A OH THR 5.A O no hydrogen 2.485 N/A GLY 113.A N SER 109.A O no hydrogen 2.695 N/A SER 114.A OG ASP 115.A OD1 no hydrogen 2.558 N/A ASP 115.A N TYR 347.A O no hydrogen 2.926 N/A ILE 117.A N HIS 69.A O no hydrogen 3.242 N/A ILE 117.A N ASP 115.A O no hydrogen 2.915 N/A GLY 118.A N HIS 69.A O no hydrogen 2.789 N/A VAL 120.A N ILE 104.A O no hydrogen 2.787 N/A VAL 121.A N LEU 71.A O no hydrogen 2.718 N/A ASN 122.A N GLU 102.A O no hydrogen 2.897 N/A ASN 122.A ND2 THR 5.A OG1 no hydrogen 3.085 N/A ILE 123.A N LEU 73.A O no hydrogen 2.736 N/A ILE 124.A N ARG 100.A O no hydrogen 2.865 N/A THR 125.A N ASP 75.A OD1 no hydrogen 2.830 N/A THR 125.A OG1 ASP 75.A OD1 no hydrogen 3.466 N/A THR 125.A OG1 ASP 75.A OD2 no hydrogen 2.721 N/A THR 125.A OG1 TYR 179.A OH no hydrogen 3.203 N/A GLU 129.A N GLN 151.A OE1 no hydrogen 2.776 N/A GLY 131.A N GLN 151.A O no hydrogen 2.800 N/A THR 132.A N PHE 548.A O no hydrogen 3.474 N/A GLU 133.A N SER 149.A O no hydrogen 3.048 N/A ILE 134.A N TYR 546.A O no hydrogen 2.930 N/A SER 135.A N ASP 147.A O no hydrogen 2.910 N/A SER 135.A OG ASP 147.A O no hydrogen 3.555 N/A ALA 136.A N GLY 544.A O no hydrogen 2.992 N/A GLY 137.A N ASN 145.A O no hydrogen 2.959 N/A TRP 138.A N LEU 542.A O no hydrogen 2.946 N/A GLY 139.A N TYR 143.A O no hydrogen 3.095 N/A SER 140.A N TYR 540.A O no hydrogen 3.021 N/A SER 142.A OG HIS 170.A ND1 no hydrogen 3.183 N/A TYR 143.A N SER 140.A O no hydrogen 3.343 N/A GLN 144.A N HIS 168.A O no hydrogen 2.875 N/A ASN 145.A N GLY 137.A O no hydrogen 2.878 N/A ASN 145.A ND2 ASP 165.A OD1 no hydrogen 2.807 N/A ASN 145.A ND2 TYR 166.A O no hydrogen 3.144 N/A TYR 146.A N TYR 166.A O no hydrogen 2.944 N/A VAL 148.A N GLY 164.A O no hydrogen 2.962 N/A SER 149.A N GLU 133.A O no hydrogen 3.080 N/A CYS 150.A N LEU 162.A O no hydrogen 2.713 N/A GLN 151.A N GLY 131.A O no hydrogen 2.960 N/A GLN 151.A NE2 ARG 127.A O no hydrogen 2.815 N/A GLN 151.A NE2 THR 161.A OG1 no hydrogen 2.928 N/A GLN 152.A N VAL 160.A O no hydrogen 2.982 N/A LEU 154.A N THR 158.A O no hydrogen 2.905 N/A THR 158.A OG1 HIS 184.A ND1 no hydrogen 2.607 N/A ARG 159.A N GLU 183.A O no hydrogen 2.689 N/A ARG 159.A NH2 ARG 127.A O no hydrogen 3.410 N/A VAL 160.A N GLN 152.A O no hydrogen 2.941 N/A THR 161.A N ALA 181.A O no hydrogen 2.910 N/A LEU 162.A N CYS 150.A O no hydrogen 2.710 N/A LEU 163.A N TYR 179.A O no hydrogen 2.861 N/A GLY 164.A N VAL 148.A O no hydrogen 2.907 N/A ASP 165.A N THR 177.A O no hydrogen 2.845 N/A TYR 166.A N TYR 146.A O no hydrogen 2.831 N/A ALA 167.A N SER 175.A O no hydrogen 2.849 N/A HIS 168.A N GLN 144.A O no hydrogen 2.879 N/A THR 169.A N PHE 173.A O no hydrogen 3.154 N/A HIS 170.A N ASN 141.A O no hydrogen 3.125 N/A HIS 170.A ND1 SER 142.A OG no hydrogen 3.183 N/A PHE 173.A N THR 169.A O no hydrogen 2.945 N/A LEU 174.A N ARG 202.A O no hydrogen 2.771 N/A SER 175.A N ALA 167.A O no hydrogen 2.860 N/A SER 175.A OG ASN 201.A OD1 no hydrogen 3.037 N/A LYS 176.A N ASP 200.A O no hydrogen 3.019 N/A THR 177.A N ASP 165.A O no hydrogen 2.922 N/A LEU 178.A N GLY 198.A O no hydrogen 3.055 N/A TYR 179.A N LEU 163.A O no hydrogen 2.921 N/A TYR 179.A OH THR 125.A OG1 no hydrogen 3.203 N/A GLY 180.A N GLY 196.A O no hydrogen 2.887 N/A ALA 181.A N THR 161.A O no hydrogen 2.885 N/A LEU 182.A N VAL 194.A O no hydrogen 2.894 N/A GLU 183.A N ARG 159.A O no hydrogen 2.818 N/A HIS 184.A N GLY 192.A O no hydrogen 2.763 N/A HIS 184.A ND1 THR 158.A OG1 no hydrogen 2.607 N/A ASN 185.A N LYS 157.A O no hydrogen 2.824 N/A PHE 186.A N TRP 190.A O no hydrogen 3.005 N/A THR 187.A N TRP 190.A O no hydrogen 3.443 N/A ALA 189.A N THR 187.A OG1 no hydrogen 3.015 N/A TRP 190.A N THR 187.A OG1 no hydrogen 3.220 N/A SER 191.A N ARG 219.A O no hydrogen 2.997 N/A GLY 192.A N HIS 184.A O no hydrogen 2.691 N/A PHE 193.A N GLY 217.A O no hydrogen 3.180 N/A VAL 194.A N LEU 182.A O no hydrogen 2.929 N/A ARG 195.A N ASP 215.A O no hydrogen 2.780 N/A GLY 196.A N GLY 180.A O no hydrogen 2.980 N/A TYR 197.A N SER 213.A O no hydrogen 2.973 N/A GLY 198.A N LEU 178.A O no hydrogen 3.067 N/A TYR 199.A N SER 211.A O no hydrogen 2.997 N/A ASP 200.A N LYS 176.A O no hydrogen 2.912 N/A ASN 201.A N LEU 209.A O no hydrogen 2.949 N/A ASN 201.A ND2 GLN 92.A O no hydrogen 2.772 N/A ASN 201.A ND2 GLN 92.A OE1 no hydrogen 3.149 N/A ARG 202.A N LEU 174.A O no hydrogen 2.765 N/A THR 203.A N ARG 207.A O no hydrogen 2.825 N/A ASN 204.A N GLY 172.A O no hydrogen 2.849 N/A THR 206.A N TYR 241.A O no hydrogen 3.286 N/A THR 206.A OG1 ASN 204.A OD1 no hydrogen 3.303 N/A ARG 207.A N THR 203.A O no hydrogen 2.679 N/A ARG 207.A NE ASP 238.A OD1 no hydrogen 2.943 N/A ARG 207.A NH2 ASP 238.A OD2 no hydrogen 2.788 N/A LYS 208.A N TYR 239.A O no hydrogen 3.008 N/A LEU 209.A N ASN 201.A O no hydrogen 3.224 N/A TYR 210.A N LYS 237.A O no hydrogen 2.849 N/A SER 211.A N TYR 199.A O no hydrogen 3.187 N/A GLN 212.A N HIS 235.A O no hydrogen 2.901 N/A SER 213.A N TYR 197.A O no hydrogen 2.688 N/A SER 213.A OG SER 234.A OG no hydrogen 2.365 N/A TRP 214.A N TYR 233.A O no hydrogen 2.742 N/A ASP 215.A N ARG 195.A O no hydrogen 2.911 N/A ALA 216.A N THR 231.A O no hydrogen 2.958 N/A GLY 217.A N PHE 193.A O no hydrogen 3.146 N/A LEU 218.A N LEU 229.A O no hydrogen 3.005 N/A ARG 219.A N SER 191.A O no hydrogen 2.924 N/A ARG 219.A NH1 GLN 228.A OE1 no hydrogen 2.904 N/A TYR 220.A N SER 227.A O no hydrogen 2.831 N/A ASN 221.A N ALA 189.A O no hydrogen 2.803 N/A GLY 222.A N ILE 225.A O no hydrogen 2.820 N/A LYS 226.A N ASN 257.A O no hydrogen 2.813 N/A LYS 226.A NZ ASN 221.A OD1 no hydrogen 3.135 N/A SER 227.A N TYR 220.A O no hydrogen 2.831 N/A SER 227.A OG ALA 255.A O no hydrogen 3.307 N/A SER 227.A OG ASN 256.A OD1 no hydrogen 2.510 N/A GLN 228.A N ALA 255.A O no hydrogen 2.927 N/A LEU 229.A N LEU 218.A O no hydrogen 2.978 N/A ILE 230.A N GLN 253.A O no hydrogen 2.906 N/A THR 231.A N ALA 216.A O no hydrogen 2.785 N/A SER 232.A N THR 251.A O no hydrogen 2.723 N/A SER 232.A OG TRP 214.A O no hydrogen 3.398 N/A SER 232.A OG ASP 215.A OD1 no hydrogen 3.127 N/A SER 232.A OG ASP 215.A OD2 no hydrogen 3.307 N/A TYR 233.A N TRP 214.A O no hydrogen 2.691 N/A SER 234.A N GLN 249.A O no hydrogen 2.766 N/A SER 234.A OG SER 213.A OG no hydrogen 2.365 N/A HIS 235.A N GLN 212.A O no hydrogen 2.860 N/A HIS 235.A NE2 GLU 246.A OE2 no hydrogen 2.882 N/A SER 236.A N MET 247.A O no hydrogen 2.989 N/A LYS 237.A N TYR 210.A O no hydrogen 2.829 N/A ASP 238.A N ASP 245.A O no hydrogen 2.771 N/A TYR 239.A N LYS 208.A O no hydrogen 2.915 N/A ASN 240.A N THR 243.A O no hydrogen 2.981 N/A TYR 241.A N THR 206.A O no hydrogen 3.232 N/A THR 243.A N ASN 240.A O no hydrogen 2.781 N/A ASP 245.A N ASP 238.A O no hydrogen 2.821 N/A GLU 246.A N THR 280.A OG1 no hydrogen 3.044 N/A MET 247.A N SER 236.A O no hydrogen 3.179 N/A LYS 248.A N THR 275.A O no hydrogen 2.929 N/A GLN 249.A N SER 234.A O no hydrogen 2.885 N/A GLN 249.A NE2 ARG 78.A O no hydrogen 2.920 N/A TYR 250.A N LYS 273.A O no hydrogen 2.905 N/A THR 251.A N SER 232.A O no hydrogen 2.825 N/A VAL 252.A N TRP 271.A O no hydrogen 3.131 N/A GLN 253.A N ILE 230.A O no hydrogen 2.957 N/A GLN 253.A NE2 ASP 270.A OD1 no hydrogen 3.267 N/A TRP 254.A N VAL 269.A O no hydrogen 2.925 N/A ALA 255.A N GLN 228.A O no hydrogen 2.975 N/A ASN 256.A N ALA 267.A O no hydrogen 2.799 N/A ASN 257.A N LYS 226.A O no hydrogen 2.946 N/A VAL 258.A N ILE 265.A O no hydrogen 2.784 N/A ILE 259.A N LEU 224.A O no hydrogen 3.049 N/A VAL 260.A N GLY 263.A O no hydrogen 2.981 N/A SER 264.A N LEU 299.A O no hydrogen 2.867 N/A ILE 265.A N VAL 258.A O no hydrogen 3.096 N/A GLY 266.A N THR 297.A O no hydrogen 3.008 N/A ALA 267.A N ASN 256.A O no hydrogen 2.863 N/A GLY 268.A N TYR 295.A O no hydrogen 3.087 N/A VAL 269.A N TRP 254.A O no hydrogen 2.865 N/A ASP 270.A N GLY 293.A O no hydrogen 2.734 N/A TRP 271.A N VAL 252.A O no hydrogen 2.848 N/A GLN 272.A N ASN 291.A O no hydrogen 2.859 N/A LYS 273.A N TYR 250.A O no hydrogen 2.991 N/A GLN 274.A N GLN 289.A O no hydrogen 2.909 N/A GLN 274.A NE2 GLN 249.A OE1 no hydrogen 2.926 N/A THR 275.A N LYS 248.A O no hydrogen 2.844 N/A THR 276.A N TYR 287.A O no hydrogen 2.900 N/A THR 277.A N GLU 246.A O no hydrogen 3.320 N/A THR 277.A OG1 GLU 246.A OE1 no hydrogen 3.164 N/A GLY 279.A N GLU 284.A O no hydrogen 3.190 N/A THR 280.A N THR 277.A O no hydrogen 3.140 N/A THR 280.A OG1 GLU 246.A O no hydrogen 3.443 N/A THR 280.A OG1 THR 277.A O no hydrogen 2.881 N/A GLY 281.A N ASP 245.A OD1 no hydrogen 2.813 N/A VAL 283.A N THR 280.A O no hydrogen 3.393 N/A TYR 287.A N THR 276.A O no hydrogen 3.304 N/A TYR 287.A N THR 276.A OG1 no hydrogen 3.198 N/A GLN 289.A N GLN 274.A O no hydrogen 3.019 N/A ARG 290.A N SER 317.A OG no hydrogen 3.167 N/A ARG 290.A NE ASP 288.A OD1 no hydrogen 3.239 N/A ARG 290.A NH2 ASP 288.A OD2 no hydrogen 2.904 N/A ASN 291.A N GLN 272.A O no hydrogen 2.853 N/A ASN 291.A ND2 ASP 314.A OD2 no hydrogen 2.786 N/A THR 292.A N ASP 315.A O no hydrogen 2.980 N/A GLY 293.A N ASP 270.A O no hydrogen 2.877 N/A ILE 294.A N SER 313.A O no hydrogen 2.992 N/A TYR 295.A N GLY 268.A O no hydrogen 3.074 N/A LEU 296.A N ALA 311.A O no hydrogen 2.799 N/A THR 297.A N GLY 266.A O no hydrogen 2.983 N/A GLY 298.A N GLY 309.A O no hydrogen 3.032 N/A LEU 299.A N SER 264.A O no hydrogen 2.871 N/A GLN 300.A N PHE 307.A O no hydrogen 2.854 N/A GLN 300.A NE2 VAL 260.A O no hydrogen 3.275 N/A GLN 301.A N HIS 262.A O no hydrogen 2.932 N/A VAL 302.A N PHE 305.A O no hydrogen 2.964 N/A PHE 305.A N VAL 302.A O no hydrogen 2.882 N/A THR 306.A N GLY 330.A O no hydrogen 2.786 N/A PHE 307.A N GLN 300.A O no hydrogen 2.893 N/A GLU 308.A N SER 328.A O no hydrogen 2.892 N/A GLY 309.A N GLY 298.A O no hydrogen 2.781 N/A ALA 310.A N GLN 326.A O no hydrogen 3.022 N/A ALA 311.A N LEU 296.A O no hydrogen 2.893 N/A ARG 312.A N THR 324.A O no hydrogen 2.913 N/A ARG 312.A NE ASP 314.A OD1 no hydrogen 2.968 N/A ARG 312.A NE ASP 314.A OD2 no hydrogen 3.221 N/A ARG 312.A NH1 VAL 111.A O no hydrogen 2.882 N/A ARG 312.A NH1 ASP 270.A OD2 no hydrogen 2.962 N/A ARG 312.A NH2 ASP 270.A OD2 no hydrogen 3.520 N/A ARG 312.A NH2 ASP 314.A OD2 no hydrogen 2.885 N/A SER 313.A N ILE 294.A O no hydrogen 2.763 N/A ASP 314.A N HIS 322.A O no hydrogen 2.938 N/A ASP 315.A N THR 292.A O no hydrogen 2.731 N/A ASN 316.A N GLY 320.A O no hydrogen 2.662 N/A ASN 316.A ND2 ASN 291.A OD1 no hydrogen 3.093 N/A SER 317.A N ARG 290.A O no hydrogen 2.930 N/A SER 317.A OG ARG 290.A O no hydrogen 3.522 N/A GLN 318.A N ASN 316.A OD1 no hydrogen 2.802 N/A GLN 318.A NE2 PRO 362.A O no hydrogen 2.988 N/A GLN 318.A NE2 LEU 364.A O no hydrogen 2.901 N/A PHE 319.A N ASN 316.A OD1 no hydrogen 3.027 N/A GLY 320.A N ASN 316.A O no hydrogen 2.756 N/A HIS 322.A N ASP 314.A O no hydrogen 2.946 N/A THR 324.A N ARG 312.A O no hydrogen 2.977 N/A TRP 325.A N THR 345.A OG1 no hydrogen 3.055 N/A GLN 326.A N ALA 310.A O no hydrogen 2.901 N/A GLN 326.A NE2 PRO 107.A O no hydrogen 3.414 N/A THR 327.A N TYR 343.A O no hydrogen 3.034 N/A SER 328.A N GLU 308.A O no hydrogen 2.801 N/A SER 328.A OG SER 342.A OG no hydrogen 2.519 N/A ALA 329.A N ALA 341.A O no hydrogen 3.080 N/A GLY 330.A N THR 306.A O no hydrogen 2.822 N/A TRP 331.A N PHE 339.A O no hydrogen 2.894 N/A GLU 332.A N ASP 304.A O no hydrogen 2.835 N/A GLY 336.A N GLU 332.A OE2 no hydrogen 2.989 N/A TYR 337.A N ILE 334.A O no hydrogen 3.107 N/A ARG 338.A N GLU 377.A O no hydrogen 2.875 N/A ARG 338.A NE GLU 377.A OE1 no hydrogen 3.196 N/A ARG 338.A NH1 SER 14.A O no hydrogen 3.315 N/A ARG 338.A NH2 SER 14.A O no hydrogen 2.819 N/A ARG 338.A NH2 GLU 377.A OE1 no hydrogen 3.105 N/A PHE 339.A N TRP 331.A O no hydrogen 3.127 N/A ILE 340.A N ALA 375.A O no hydrogen 2.865 N/A ALA 341.A N ALA 329.A O no hydrogen 2.885 N/A SER 342.A N GLU 373.A O no hydrogen 2.815 N/A SER 342.A OG SER 328.A OG no hydrogen 2.519 N/A TYR 343.A N THR 327.A O no hydrogen 3.123 N/A GLY 344.A N GLN 371.A O no hydrogen 2.915 N/A THR 345.A N TRP 325.A O no hydrogen 2.884 N/A THR 345.A OG1 TRP 325.A O no hydrogen 3.289 N/A SER 346.A N SER 369.A O no hydrogen 2.944 N/A TYR 347.A N SER 109.A OG no hydrogen 3.203 N/A LYS 348.A N GLU 367.A O no hydrogen 2.773 N/A LYS 348.A NZ SER 68.A O no hydrogen 3.520 N/A LYS 348.A NZ GLY 86.A O no hydrogen 2.822 N/A LYS 348.A NZ ASP 115.A OD1 no hydrogen 2.777 N/A ALA 349.A N SER 114.A OG no hydrogen 2.985 N/A ASN 351.A N GLN 354.A OE1 no hydrogen 2.875 N/A GLN 354.A N ASN 351.A OD1 no hydrogen 2.894 N/A LEU 355.A N ASN 351.A O no hydrogen 2.843 N/A TYR 356.A N LEU 352.A O no hydrogen 2.852 N/A GLY 357.A N GLY 353.A O no hydrogen 3.023 N/A GLY 360.A N GLY 357.A O no hydrogen 2.998 N/A ASN 361.A N GLN 354.A O no hydrogen 2.903 N/A ASN 361.A ND2 TYR 407.A O no hydrogen 2.901 N/A ASN 363.A N ASN 361.A OD1 no hydrogen 3.002 N/A ASP 365.A N ASN 409.A OD1 no hydrogen 2.824 N/A GLU 367.A N LYS 348.A O no hydrogen 2.832 N/A LYS 368.A N SER 395.A O no hydrogen 3.078 N/A SER 369.A N SER 346.A O no hydrogen 2.853 N/A SER 369.A OG ASN 392.A OD1 no hydrogen 2.795 N/A LYS 370.A N ASP 393.A O no hydrogen 2.964 N/A GLN 371.A N GLY 344.A O no hydrogen 2.955 N/A GLN 371.A NE2 ILE 117.A O no hydrogen 2.527 N/A TRP 372.A N ARG 391.A O no hydrogen 2.963 N/A GLU 373.A N SER 342.A O no hydrogen 2.978 N/A GLY 374.A N GLY 389.A O no hydrogen 2.936 N/A ALA 375.A N ILE 340.A O no hydrogen 2.781 N/A PHE 376.A N ILE 387.A O no hydrogen 2.930 N/A GLU 377.A N ARG 338.A O no hydrogen 2.758 N/A GLY 378.A N TRP 385.A O no hydrogen 3.011 N/A LEU 379.A N GLY 336.A O no hydrogen 3.089 N/A THR 380.A N VAL 383.A O no hydrogen 2.730 N/A VAL 383.A N THR 380.A O no hydrogen 2.805 N/A ASN 384.A N ASN 423.A O no hydrogen 3.124 N/A TRP 385.A N GLY 378.A O no hydrogen 2.869 N/A ARG 386.A N THR 421.A O no hydrogen 3.048 N/A ARG 386.A NH1 GLU 377.A OE2 no hydrogen 3.101 N/A ARG 386.A NH2 LEU 17.A O no hydrogen 2.763 N/A ILE 387.A N PHE 376.A O no hydrogen 2.955 N/A SER 388.A N GLU 419.A O no hydrogen 2.850 N/A SER 388.A OG GLU 373.A OE1 no hydrogen 3.220 N/A GLY 389.A N GLY 374.A O no hydrogen 3.000 N/A TYR 390.A N GLY 417.A O no hydrogen 2.995 N/A ARG 391.A N TRP 372.A O no hydrogen 2.791 N/A ASN 392.A N ILE 415.A O no hydrogen 2.787 N/A ASP 393.A N LYS 370.A O no hydrogen 2.905 N/A VAL 394.A N ALA 413.A O no hydrogen 2.750 N/A SER 395.A N LYS 368.A O no hydrogen 2.863 N/A LEU 397.A N GLY 411.A O no hydrogen 3.107 N/A ILE 398.A N GLU 367.A OE2 no hydrogen 2.807 N/A ASP 399.A N TYR 408.A O no hydrogen 2.822 N/A ASP 401.A N LYS 406.A O no hydrogen 2.853 N/A THR 404.A OG1 ASP 401.A OD2 no hydrogen 2.578 N/A THR 404.A OG1 TYR 408.A OH no hydrogen 2.695 N/A TYR 407.A N TYR 359.A O no hydrogen 3.150 N/A TYR 408.A N ASP 399.A O no hydrogen 2.876 N/A TYR 408.A OH THR 404.A OG1 no hydrogen 2.695 N/A ASN 409.A ND2 ASP 365.A O no hydrogen 2.901 N/A ASN 409.A ND2 ASP 396.A O no hydrogen 2.899 N/A GLU 410.A N LEU 397.A O no hydrogen 2.932 N/A GLY 411.A N LEU 397.A O no hydrogen 3.140 N/A ALA 413.A N VAL 394.A O no hydrogen 2.850 N/A ARG 414.A N ARG 441.A O no hydrogen 2.981 N/A ARG 414.A NH2 ASP 446.A OD2 no hydrogen 2.687 N/A ILE 415.A N ASN 392.A O no hydrogen 2.746 N/A LYS 416.A N ASP 439.A O no hydrogen 3.163 N/A GLY 417.A N TYR 390.A O no hydrogen 2.969 N/A VAL 418.A N TYR 437.A O no hydrogen 2.964 N/A GLU 419.A N SER 388.A O no hydrogen 3.045 N/A ALA 420.A N TYR 435.A O no hydrogen 2.817 N/A THR 421.A N ARG 386.A O no hydrogen 3.011 N/A ALA 422.A N VAL 433.A O no hydrogen 2.887 N/A ASN 423.A N ASN 384.A O no hydrogen 2.972 N/A PHE 424.A N HIS 431.A O no hydrogen 3.140 N/A THR 426.A N LEU 429.A O no hydrogen 3.040 N/A THR 426.A OG1 THR 426.A O no hydrogen 2.575 N/A THR 426.A OG1 HIS 431.A NE2 no hydrogen 2.781 N/A LEU 429.A N THR 426.A O no hydrogen 3.117 N/A THR 430.A N ASP 462.A O no hydrogen 2.848 N/A THR 430.A OG1 ASP 425.A OD1 no hydrogen 2.724 N/A HIS 431.A N PHE 424.A O no hydrogen 2.848 N/A HIS 431.A ND1 TYR 459.A OH no hydrogen 2.822 N/A HIS 431.A NE2 THR 426.A OG1 no hydrogen 2.781 N/A THR 432.A N GLN 460.A O no hydrogen 2.975 N/A VAL 433.A N ALA 422.A O no hydrogen 2.902 N/A SER 434.A N LYS 458.A O no hydrogen 2.912 N/A TYR 435.A N ALA 420.A O no hydrogen 2.683 N/A TYR 435.A OH GLN 455.A OE1 no hydrogen 2.402 N/A ASP 436.A N GLN 456.A O no hydrogen 2.963 N/A TYR 437.A N VAL 418.A O no hydrogen 2.758 N/A VAL 438.A N LYS 454.A O no hydrogen 2.920 N/A ASP 439.A N LYS 416.A O no hydrogen 2.905 N/A ARG 441.A N ARG 414.A O no hydrogen 2.969 N/A ARG 441.A NE ASP 439.A OD1 no hydrogen 2.890 N/A ARG 441.A NH1 ASP 446.A O no hydrogen 2.657 N/A ASN 442.A N THR 447.A O no hydrogen 2.996 N/A ALA 443.A N LYS 412.A O no hydrogen 2.983 N/A ILE 444.A N ASN 442.A OD1 no hydrogen 2.970 N/A THR 445.A N ASN 442.A OD1 no hydrogen 3.220 N/A LEU 449.A N ALA 440.A O no hydrogen 2.822 N/A ARG 451.A N TYR 481.A O no hydrogen 2.623 N/A ARG 452.A NE GLY 64.A O no hydrogen 3.048 N/A ARG 452.A NH1 LEU 450.A O no hydrogen 2.880 N/A ARG 452.A NH2 GLY 64.A O no hydrogen 2.919 N/A ARG 452.A NH2 ASN 66.A OD1 no hydrogen 2.651 N/A ALA 453.A N ASP 47.A OD2 no hydrogen 2.904 N/A GLN 456.A N ASP 436.A O no hydrogen 3.069 N/A GLN 456.A NE2 VAL 46.A O no hydrogen 3.322 N/A VAL 457.A N TYR 476.A O no hydrogen 3.181 N/A LYS 458.A N SER 434.A O no hydrogen 3.010 N/A LYS 458.A NZ ARG 41.A O no hydrogen 2.973 N/A LYS 458.A NZ LEU 43.A O no hydrogen 2.631 N/A LYS 458.A NZ VAL 46.A O no hydrogen 2.910 N/A TYR 459.A N TYR 474.A O no hydrogen 2.900 N/A TYR 459.A OH HIS 431.A ND1 no hydrogen 2.822 N/A GLN 460.A N THR 432.A O no hydrogen 2.821 N/A GLN 460.A NE2 ASP 462.A OD1 no hydrogen 2.980 N/A LEU 461.A N ILE 472.A O no hydrogen 3.074 N/A ASP 462.A N THR 430.A O no hydrogen 3.023 N/A TRP 463.A N TRP 470.A O no hydrogen 3.110 N/A GLN 464.A NE2 ASP 469.A OD2 no hydrogen 3.014 N/A LEU 465.A N PHE 468.A O no hydrogen 3.069 N/A ASP 469.A N ALA 506.A O no hydrogen 2.961 N/A TRP 470.A N TRP 463.A O no hydrogen 2.869 N/A GLY 471.A N ALA 504.A O no hydrogen 2.794 N/A ILE 472.A N LEU 461.A O no hydrogen 2.784 N/A THR 473.A N ASP 502.A O no hydrogen 2.923 N/A THR 473.A OG1 GLN 460.A OE1 no hydrogen 2.379 N/A TYR 474.A N TYR 459.A O no hydrogen 2.669 N/A TYR 474.A OH SER 499.A OG no hydrogen 2.587 N/A GLN 475.A N LEU 500.A O no hydrogen 3.017 N/A GLN 475.A NE2 ARG 41.A O no hydrogen 3.478 N/A TYR 476.A N VAL 457.A O no hydrogen 2.764 N/A LEU 477.A N VAL 498.A O no hydrogen 2.858 N/A GLY 478.A N GLN 455.A O no hydrogen 2.898 N/A THR 479.A OG1 MET 495.A O no hydrogen 3.397 N/A ARG 480.A N MET 495.A O no hydrogen 3.110 N/A ARG 480.A NH1 ASP 47.A OD1 no hydrogen 2.921 N/A ARG 480.A NH1 ASP 47.A OD2 no hydrogen 3.130 N/A ARG 480.A NH1 ARG 451.A O no hydrogen 2.942 N/A ARG 480.A NH2 ASP 47.A OD1 no hydrogen 3.440 N/A ASP 482.A N VAL 493.A O no hydrogen 3.044 N/A LYS 483.A N ASP 482.A OD1 no hydrogen 2.853 N/A LYS 483.A NZ TYR 490.A O no hydrogen 2.779 N/A ASP 484.A N GLN 491.A O no hydrogen 3.002 N/A SER 486.A N ASP 484.A OD1 no hydrogen 2.840 N/A SER 486.A OG ASP 484.A OD1 no hydrogen 2.482 N/A SER 486.A OG ASP 484.A OD2 no hydrogen 3.273 N/A SER 487.A OG TYR 488.A O no hydrogen 3.404 N/A VAL 493.A N ASP 482.A O no hydrogen 2.645 N/A MET 495.A N ARG 480.A O no hydrogen 2.593 N/A VAL 498.A N LEU 477.A O no hydrogen 3.026 N/A SER 499.A OG TYR 474.A OH no hydrogen 2.587 N/A LEU 500.A N GLN 475.A O no hydrogen 2.913 N/A ASP 502.A N THR 473.A O no hydrogen 2.851 N/A LEU 503.A N ILE 519.A O no hydrogen 3.141 N/A ALA 504.A N GLY 471.A O no hydrogen 2.928 N/A VAL 505.A N GLY 517.A O no hydrogen 2.833 N/A ALA 506.A N ASP 469.A O no hydrogen 2.925 N/A TYR 507.A N VAL 515.A O no hydrogen 2.792 N/A THR 510.A N LEU 513.A O no hydrogen 3.278 N/A HIS 512.A N THR 510.A OG1 no hydrogen 2.951 N/A LEU 513.A N THR 510.A O no hydrogen 3.309 N/A THR 514.A N SER 545.A O no hydrogen 2.998 N/A VAL 515.A N TYR 507.A O no hydrogen 2.926 N/A ARG 516.A N SER 543.A O no hydrogen 2.816 N/A GLY 517.A N VAL 505.A O no hydrogen 2.791 N/A LYS 518.A N THR 541.A O no hydrogen 2.973 N/A LYS 518.A NZ GLN 32.A O no hydrogen 2.682 N/A ILE 519.A N LEU 503.A O no hydrogen 2.925 N/A ALA 520.A N GLU 539.A O no hydrogen 2.820 N/A ASN 521.A N ASP 502.A OD1 no hydrogen 2.871 N/A ASN 521.A ND2 LYS 525.A O no hydrogen 3.128 N/A LEU 522.A N TRP 501.A O no hydrogen 2.884 N/A ASP 524.A N ASN 521.A O no hydrogen 2.999 N/A LYS 525.A N ASN 521.A OD1 no hydrogen 3.016 N/A THR 529.A OG1 GLN 50.A O no hydrogen 3.414 N/A TYR 531.A N ASP 482.A OD2 no hydrogen 2.891 N/A GLY 532.A N GLU 528.A OE1 no hydrogen 2.959 N/A TYR 533.A N VAL 530.A O no hydrogen 2.940 N/A GLN 534.A NE2 THR 535.A O no hydrogen 2.898 N/A THR 535.A OG1 TYR 527.A O no hydrogen 2.788 N/A ARG 538.A N ASP 524.A OD1 no hydrogen 3.121 N/A ARG 538.A NE LEU 522.A O no hydrogen 2.911 N/A ARG 538.A NH2 LEU 522.A O no hydrogen 3.236 N/A GLU 539.A N ALA 520.A O no hydrogen 2.883 N/A TYR 540.A N SER 140.A OG no hydrogen 3.313 N/A THR 541.A N LYS 518.A O no hydrogen 2.794 N/A LEU 542.A N TRP 138.A O no hydrogen 2.937 N/A SER 543.A N ARG 516.A O no hydrogen 2.886 N/A GLY 544.A N ALA 136.A O no hydrogen 2.711 N/A SER 545.A N THR 514.A O no hydrogen 2.906 N/A TYR 546.A N ILE 134.A O no hydrogen 2.741 N/A THR 547.A N HIS 512.A O no hydrogen 2.772 N/A PHE 548.A N THR 132.A O no hydrogen 3.072 N/A