Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ooy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ HIS 47.A ND1 no hydrogen 3.258 N/A LEU 5.A N SER 1.A O no hydrogen 3.227 N/A GLN 6.A N MET 2.A O no hydrogen 3.373 N/A GLN 6.A NE2 ASP 10.A OD1 no hydrogen 3.062 N/A ALA 7.A N GLN 3.A O no hydrogen 2.935 N/A LEU 8.A N LYS 4.A O no hydrogen 2.954 N/A LYS 9.A N LEU 5.A O no hydrogen 3.263 N/A LYS 9.A NZ GLU 215.A OE2 no hydrogen 3.215 N/A ASP 10.A N GLN 6.A O no hydrogen 2.988 N/A THR 11.A N ALA 7.A O no hydrogen 2.711 N/A THR 11.A OG1 ALA 7.A O no hydrogen 2.692 N/A ALA 12.A N LEU 8.A O no hydrogen 2.832 N/A ASN 13.A N LYS 9.A O no hydrogen 2.967 N/A ARG 14.A N ASP 10.A O no hydrogen 2.957 N/A ARG 14.A NE GLU 81.A OE2 no hydrogen 2.944 N/A ARG 14.A NH1 SER 273.A O no hydrogen 2.967 N/A ARG 14.A NH2 GLU 81.A OE2 no hydrogen 3.292 N/A LEU 15.A N THR 11.A O no hydrogen 2.814 N/A ARG 16.A N ALA 12.A O no hydrogen 2.937 N/A ARG 16.A NE ARG 239.A O no hydrogen 2.914 N/A ARG 16.A NH1 ASN 13.A OD1 no hydrogen 3.055 N/A ARG 16.A NH1 GLU 39.A OE2 no hydrogen 2.953 N/A ARG 16.A NH2 CYS 35.A O no hydrogen 3.160 N/A ARG 16.A NH2 GLU 39.A OE1 no hydrogen 2.992 N/A ARG 16.A NH2 GLU 39.A OE2 no hydrogen 3.220 N/A ILE 17.A N ASN 13.A O no hydrogen 3.049 N/A SER 18.A N ARG 14.A O no hydrogen 3.001 N/A SER 19.A N LEU 15.A O no hydrogen 3.120 N/A SER 19.A OG LEU 15.A O no hydrogen 2.979 N/A ILE 20.A N ARG 16.A O no hydrogen 3.078 N/A GLN 21.A N ILE 17.A O no hydrogen 2.845 N/A ALA 22.A N SER 18.A O no hydrogen 2.863 N/A THR 23.A N SER 19.A O no hydrogen 3.123 N/A THR 23.A OG1 SER 19.A O no hydrogen 2.708 N/A THR 23.A OG1 ILE 20.A O no hydrogen 3.266 N/A THR 24.A N ILE 20.A O no hydrogen 2.841 N/A THR 24.A OG1 ILE 20.A O no hydrogen 3.132 N/A THR 24.A OG1 LEU 255.A O no hydrogen 2.714 N/A ALA 25.A N GLN 21.A O no hydrogen 2.868 N/A ALA 26.A N ALA 22.A O no hydrogen 2.842 N/A GLY 27.A N THR 23.A O no hydrogen 2.855 N/A GLY 27.A N THR 24.A O no hydrogen 3.267 N/A THR 32.A OG1 TRP 250.A O no hydrogen 3.457 N/A CYS 34.A N HIS 30.A O no hydrogen 3.174 N/A CYS 34.A SG HIS 30.A O no hydrogen 3.456 N/A CYS 34.A SG ALA 71.A O no hydrogen 3.770 N/A CYS 35.A N PRO 31.A O no hydrogen 2.850 N/A CYS 35.A SG PRO 31.A O no hydrogen 3.357 N/A SER 36.A N THR 32.A O no hydrogen 3.402 N/A SER 36.A OG SER 33.A O no hydrogen 3.401 N/A SER 36.A OG ASP 176.A OD1 no hydrogen 3.388 N/A SER 36.A OG ASP 176.A OD2 no hydrogen 2.671 N/A ALA 37.A N CYS 34.A O no hydrogen 2.950 N/A ALA 38.A N CYS 35.A O no hydrogen 3.489 N/A MET 41.A N ALA 37.A O no hydrogen 2.802 N/A ALA 42.A N ALA 38.A O no hydrogen 2.874 N/A VAL 43.A N GLU 39.A O no hydrogen 2.866 N/A LEU 44.A N ILE 40.A O no hydrogen 2.945 N/A PHE 45.A N MET 41.A O no hydrogen 3.012 N/A PHE 46.A N ALA 42.A O no hydrogen 2.918 N/A THR 48.A N VAL 43.A O no hydrogen 2.854 N/A THR 48.A OG1 VAL 43.A O no hydrogen 3.475 N/A MET 49.A N LEU 44.A O no hydrogen 2.815 N/A ARG 50.A N ASP 62.A OD2 no hydrogen 2.748 N/A ARG 50.A NH1 HIS 47.A O no hydrogen 2.689 N/A ARG 50.A NH1 MET 49.A O no hydrogen 3.065 N/A TYR 51.A N THR 280.A O no hydrogen 2.846 N/A TYR 51.A OH PHE 45.A O no hydrogen 2.737 N/A LYS 52.A N ASN 61.A OD1 no hydrogen 2.858 N/A LYS 52.A NZ GLU 284.A OE1 no hydrogen 2.368 N/A ASP 55.A N LYS 52.A O no hydrogen 3.070 N/A ARG 57.A NH2 PRO 106.A O no hydrogen 2.873 N/A ARG 57.A NH2 THR 111.A O no hydrogen 2.742 N/A ASN 58.A N ASP 55.A O no hydrogen 3.047 N/A ASN 58.A ND2 ASP 55.A OD2 no hydrogen 3.061 N/A HIS 60.A N ASN 58.A OD1 no hydrogen 2.910 N/A ASN 61.A N ASN 58.A O no hydrogen 3.056 N/A ASN 61.A ND2 ASP 55.A O no hydrogen 2.963 N/A ASN 61.A ND2 PRO 56.A O no hydrogen 2.922 N/A ASP 62.A N ARG 50.A O no hydrogen 2.862 N/A ARG 63.A N ARG 141.A O no hydrogen 2.903 N/A ARG 63.A NH1 PRO 59.A O no hydrogen 3.093 N/A ARG 63.A NH1 ASN 61.A O no hydrogen 2.775 N/A VAL 65.A N TYR 143.A O no hydrogen 2.789 N/A SER 67.A OG GLU 150.A OE2 no hydrogen 2.436 N/A LYS 68.A N LEU 145.A O no hydrogen 3.182 N/A LYS 68.A NZ SER 33.A O no hydrogen 2.930 N/A LYS 68.A NZ ASP 176.A OD2 no hydrogen 2.563 N/A ALA 71.A N LYS 68.A O no hydrogen 3.040 N/A ALA 72.A N GLY 69.A O no hydrogen 3.103 N/A ILE 74.A N ALA 71.A O no hydrogen 3.019 N/A TYR 76.A N ALA 72.A O no hydrogen 2.892 N/A TYR 76.A OH ASP 101.A O no hydrogen 2.511 N/A ALA 77.A N PRO 73.A O no hydrogen 2.818 N/A VAL 78.A N ILE 74.A O no hydrogen 3.074 N/A TRP 79.A N LEU 75.A O no hydrogen 3.217 N/A ALA 80.A N TYR 76.A O no hydrogen 3.021 N/A GLU 81.A N ALA 77.A O no hydrogen 2.890 N/A ALA 82.A N VAL 78.A O no hydrogen 2.905 N/A GLY 83.A N ALA 80.A O no hydrogen 2.914 N/A PHE 84.A N TRP 79.A O no hydrogen 2.944 N/A LEU 85.A N TRP 79.A O no hydrogen 3.185 N/A GLU 89.A N ALA 86.A O no hydrogen 2.971 N/A LEU 90.A N GLU 87.A O no hydrogen 3.295 N/A LEU 91.A N ALA 88.A O no hydrogen 3.256 N/A ASN 92.A N GLU 89.A O no hydrogen 2.753 N/A ASN 92.A ND2 GLU 89.A OE1 no hydrogen 3.177 N/A LEU 93.A N LEU 90.A O no hydrogen 3.275 N/A ARG 94.A N LEU 100.A O no hydrogen 2.843 N/A ARG 94.A NH1 SER 28.A OG no hydrogen 2.952 N/A LYS 95.A N ASN 92.A O no hydrogen 3.178 N/A LYS 95.A NZ ASN 92.A OD1 no hydrogen 3.101 N/A SER 98.A N LYS 95.A O no hydrogen 3.101 N/A SER 98.A OG GLU 89.A OE2 no hydrogen 2.741 N/A LEU 100.A N SER 98.A OG no hydrogen 3.060 N/A VAL 105.A N GLN 108.A OE1 no hydrogen 3.238 N/A LYS 107.A NZ ASP 99.A OD1 no hydrogen 3.199 N/A LYS 107.A NZ ASP 101.A OD1 no hydrogen 3.101 N/A LYS 107.A NZ ASP 101.A OD2 no hydrogen 3.003 N/A GLN 108.A N VAL 105.A O no hydrogen 2.920 N/A GLN 108.A NE2 TYR 76.A OH no hydrogen 2.998 N/A GLN 108.A NE2 ASP 99.A O no hydrogen 2.798 N/A THR 111.A N GLN 108.A O no hydrogen 2.976 N/A THR 111.A OG1 GLN 108.A OE1 no hydrogen 2.942 N/A ALA 114.A N SER 399.A OG no hydrogen 2.858 N/A THR 115.A OG1 LEU 66.A O no hydrogen 2.707 N/A SER 117.A OG ASP 391.A OD2 no hydrogen 2.421 N/A GLY 119.A N GLU 150.A OE2 no hydrogen 2.687 N/A GLN 120.A NE2 SER 117.A OG no hydrogen 3.254 N/A GLY 121.A N SER 67.A OG no hydrogen 3.137 N/A ALA 124.A N GLN 120.A O no hydrogen 3.399 N/A ALA 125.A N GLY 121.A O no hydrogen 3.007 N/A CYS 126.A N LEU 122.A O no hydrogen 2.820 N/A CYS 126.A SG LEU 122.A O no hydrogen 3.309 N/A CYS 126.A SG ALA 159.A O no hydrogen 3.586 N/A GLY 127.A N GLY 123.A O no hydrogen 3.141 N/A MET 128.A N ALA 124.A O no hydrogen 3.061 N/A ALA 129.A N ALA 125.A O no hydrogen 2.850 N/A TYR 130.A N CYS 126.A O no hydrogen 2.774 N/A THR 131.A N GLY 127.A O no hydrogen 2.879 N/A THR 131.A OG1 GLY 127.A O no hydrogen 2.943 N/A GLY 132.A N MET 128.A O no hydrogen 2.843 N/A LYS 133.A N ALA 129.A O no hydrogen 2.944 N/A LYS 133.A NZ LYS 167.A O no hydrogen 2.723 N/A LYS 133.A NZ ASP 169.A OD1 no hydrogen 2.949 N/A TYR 134.A N TYR 130.A O no hydrogen 2.896 N/A TYR 134.A OH TYR 166.A O no hydrogen 2.549 N/A PHE 135.A N THR 131.A O no hydrogen 2.881 N/A ASP 136.A N.A THR 131.A O no hydrogen 2.970 N/A ASP 136.A N.B THR 131.A O no hydrogen 2.912 N/A LYS 137.A NZ TYR 134.A O no hydrogen 3.167 N/A ALA 138.A N GLY 132.A O no hydrogen 3.114 N/A SER 139.A N ASP 285.A OD1 no hydrogen 3.002 N/A SER 139.A OG ASP 285.A OD1 no hydrogen 3.021 N/A SER 139.A OG ASP 285.A OD2 no hydrogen 2.762 N/A TYR 140.A OH ASP 136.A OD1.A no hydrogen 3.257 N/A TYR 140.A OH ASP 136.A OD2.A no hydrogen 2.741 N/A TYR 140.A OH ASP 136.A OD2.B no hydrogen 2.940 N/A ARG 141.A N ASP 62.A OD1 no hydrogen 2.886 N/A VAL 142.A N ASN 170.A O no hydrogen 2.932 N/A TYR 143.A N ARG 63.A O no hydrogen 2.982 N/A CYS 144.A N VAL 172.A O no hydrogen 2.913 N/A CYS 144.A SG VAL 65.A O no hydrogen 3.724 N/A LEU 145.A N VAL 65.A O no hydrogen 2.949 N/A LEU 146.A N ILE 174.A O no hydrogen 2.913 N/A GLY 147.A N GLU 150.A OE1 no hydrogen 3.017 N/A GLY 149.A N ASP 148.A OD1 no hydrogen 2.996 N/A LEU 151.A N ASP 148.A O no hydrogen 3.064 N/A SER 152.A N GLY 149.A O no hydrogen 3.094 N/A GLU 153.A N GLU 150.A O no hydrogen 3.108 N/A SER 155.A OG GLY 119.A O no hydrogen 2.617 N/A VAL 156.A N GLU 153.A O no hydrogen 3.064 N/A TRP 157.A N GLY 154.A O no hydrogen 2.917 N/A TRP 157.A NE1 LEU 151.A O no hydrogen 2.754 N/A GLU 158.A N GLY 154.A O no hydrogen 3.166 N/A ALA 159.A N SER 155.A O no hydrogen 3.167 N/A MET 160.A N VAL 156.A O no hydrogen 2.865 N/A ALA 161.A N TRP 157.A O no hydrogen 3.012 N/A PHE 162.A N GLU 158.A O no hydrogen 2.867 N/A ALA 163.A N ALA 159.A O no hydrogen 3.007 N/A SER 164.A N MET 160.A O no hydrogen 3.351 N/A SER 164.A OG ALA 161.A O no hydrogen 3.223 N/A SER 164.A OG PHE 202.A O no hydrogen 2.784 N/A ILE 165.A N ALA 161.A O no hydrogen 2.977 N/A TYR 166.A N PHE 162.A O no hydrogen 2.949 N/A TYR 166.A OH GLU 354.A O no hydrogen 2.570 N/A LYS 167.A N SER 164.A O no hydrogen 3.280 N/A LEU 168.A N ALA 163.A O no hydrogen 3.108 N/A ASP 169.A N LYS 167.A O no hydrogen 2.845 N/A ASN 170.A ND2 ALA 129.A O no hydrogen 2.802 N/A LEU 171.A N LEU 168.A O no hydrogen 3.235 N/A VAL 172.A N VAL 142.A O no hydrogen 2.936 N/A ALA 173.A N THR 229.A O no hydrogen 2.979 N/A ILE 174.A N CYS 144.A O no hydrogen 2.770 N/A LEU 175.A N ILE 231.A O no hydrogen 2.868 N/A ASP 176.A N LEU 146.A O no hydrogen 2.692 N/A ILE 177.A N ALA 233.A O no hydrogen 2.844 N/A ASN 178.A N ASP 176.A O no hydrogen 2.978 N/A ASN 178.A ND2 SER 36.A OG no hydrogen 2.909 N/A ARG 179.A N ASP 148.A OD2 no hydrogen 2.840 N/A ARG 179.A NE GLN 189.A OE1 no hydrogen 3.004 N/A ARG 179.A NH1 ASP 246.A OD1 no hydrogen 3.197 N/A ARG 179.A NH2 GLN 189.A OE1 no hydrogen 3.226 N/A LEU 180.A N ASN 178.A OD1 no hydrogen 3.299 N/A GLY 181.A N ASP 184.A O no hydrogen 2.946 N/A ALA 186.A N ARG 179.A O no hydrogen 2.887 N/A GLN 189.A N ALA 186.A O no hydrogen 3.016 N/A HIS 190.A NE2 ILE 177.A O no hydrogen 2.864 N/A GLN 191.A N LEU 188.A O no hydrogen 2.938 N/A GLN 191.A NE2 LEU 188.A O no hydrogen 3.603 N/A MET 192.A N HIS 190.A O no hydrogen 2.944 N/A ILE 194.A N GLN 191.A O no hydrogen 3.097 N/A TYR 195.A N GLN 191.A O no hydrogen 3.523 N/A GLN 196.A N MET 192.A O no hydrogen 2.964 N/A GLN 196.A NE2 ALA 206.A O no hydrogen 2.877 N/A LYS 197.A N ASP 193.A O no hydrogen 2.883 N/A ARG 198.A N ILE 194.A O no hydrogen 2.823 N/A CYS 199.A N TYR 195.A O no hydrogen 3.085 N/A CYS 199.A SG TYR 195.A O no hydrogen 3.246 N/A GLU 200.A N GLN 196.A O no hydrogen 2.975 N/A ALA 201.A N LYS 197.A O no hydrogen 2.964 N/A PHE 202.A N ARG 198.A O no hydrogen 3.167 N/A PHE 202.A N CYS 199.A O no hydrogen 3.092 N/A GLY 203.A N GLU 200.A O no hydrogen 3.187 N/A TRP 204.A N CYS 199.A O no hydrogen 2.983 N/A TRP 204.A NE1 MET 160.A O no hydrogen 2.840 N/A HIS 205.A N PRO 228.A O no hydrogen 2.990 N/A HIS 205.A NE2 GLN 223.A OE1 no hydrogen 3.140 N/A ILE 207.A N ALA 230.A O no hydrogen 2.895 N/A VAL 209.A N ILE 232.A O no hydrogen 2.963 N/A ASP 210.A N GLU 216.A OE1 no hydrogen 2.948 N/A GLY 211.A N LYS 234.A O no hydrogen 2.852 N/A HIS 212.A N ASP 210.A OD1 no hydrogen 2.800 N/A HIS 212.A ND1 GLU 39.A OE1 no hydrogen 2.778 N/A SER 213.A N ASP 210.A O no hydrogen 3.065 N/A SER 213.A OG GLU 215.A OE1 no hydrogen 3.336 N/A GLU 215.A N GLU 215.A OE1 no hydrogen 3.023 N/A GLU 216.A N SER 213.A OG no hydrogen 2.996 N/A LEU 217.A N SER 213.A O no hydrogen 3.070 N/A CYS 218.A N VAL 214.A O no hydrogen 2.954 N/A CYS 218.A SG VAL 214.A O no hydrogen 3.265 N/A LYS 219.A N GLU 215.A O no hydrogen 3.036 N/A ALA 220.A N GLU 216.A O no hydrogen 2.986 N/A PHE 221.A N LEU 217.A O no hydrogen 3.058 N/A GLY 222.A N CYS 218.A O no hydrogen 3.054 N/A GLN 223.A N LYS 219.A O no hydrogen 3.115 N/A GLN 223.A N ALA 220.A O no hydrogen 3.398 N/A THR 229.A N LEU 171.A O no hydrogen 3.204 N/A THR 229.A OG1 GLN 227.A O no hydrogen 3.307 N/A ALA 230.A N HIS 205.A O no hydrogen 2.770 N/A ILE 231.A N ALA 173.A O no hydrogen 2.845 N/A ILE 232.A N ILE 207.A O no hydrogen 2.770 N/A ALA 233.A N LEU 175.A O no hydrogen 3.037 N/A LYS 234.A N VAL 209.A O no hydrogen 2.943 N/A THR 235.A N ILE 177.A O no hydrogen 3.030 N/A THR 235.A OG1 ASP 176.A OD1 no hydrogen 2.611 N/A PHE 236.A N HIS 212.A NE2 no hydrogen 3.008 N/A LYS 237.A NZ GLY 181.A O no hydrogen 2.877 N/A LYS 237.A NZ HIS 251.A ND1 no hydrogen 2.824 N/A GLY 238.A N THR 32.A O no hydrogen 3.056 N/A ARG 239.A NH1 GLU 245.A OE2 no hydrogen 2.934 N/A GLY 240.A N GLU 245.A OE1 no hydrogen 2.922 N/A ILE 241.A N GLY 238.A O no hydrogen 2.974 N/A THR 242.A OG1 GLU 266.A OE1 no hydrogen 2.595 N/A VAL 244.A N ILE 241.A O no hydrogen 3.113 N/A GLU 245.A N ILE 241.A O no hydrogen 2.978 N/A ASP 246.A N LYS 237.A O no hydrogen 2.829 N/A LYS 247.A N VAL 244.A O no hydrogen 2.955 N/A LYS 247.A NZ GLY 243.A O no hydrogen 3.372 N/A LYS 253.A N TRP 250.A O no hydrogen 3.240 N/A ALA 260.A N PRO 256.A O no hydrogen 2.876 N/A GLU 261.A N LYS 257.A O no hydrogen 3.158 N/A GLN 262.A N ASN 258.A O no hydrogen 3.482 N/A ILE 263.A N MET 259.A O no hydrogen 3.036 N/A ILE 264.A N ALA 260.A O no hydrogen 2.780 N/A GLN 265.A N GLU 261.A O no hydrogen 3.002 N/A GLU 266.A N GLN 262.A O no hydrogen 3.171 N/A ILE 267.A N ILE 263.A O no hydrogen 3.083 N/A TYR 268.A N ILE 264.A O no hydrogen 2.870 N/A SER 269.A N GLN 265.A O no hydrogen 2.914 N/A SER 269.A OG GLU 266.A O no hydrogen 2.887 N/A GLN 270.A N ILE 267.A O no hydrogen 2.972 N/A ILE 271.A N TYR 268.A O no hydrogen 2.805 N/A GLN 272.A N ASP 10.A OD1 no hydrogen 3.221 N/A LYS 275.A N SER 273.A OG no hydrogen 3.188 N/A LYS 276.A NZ GLU 81.A OE1 no hydrogen 2.977 N/A ALA 286.A N HIS 60.A ND1 no hydrogen 3.057 N/A ALA 292.A N ASP 290.A OD2 no hydrogen 3.362 N/A ILE 294.A N ASN 456.A OD1 no hydrogen 2.913 N/A MET 296.A N GLU 452.A OE2 no hydrogen 2.728 N/A SER 298.A OG LEU 299.A O no hydrogen 3.233 N/A TYR 302.A N ASN 476.A OD1 no hydrogen 3.216 N/A TYR 302.A OH GLN 316.A OE1 no hydrogen 3.138 N/A GLY 305.A N ILE 472.A O no hydrogen 3.159 N/A ASP 306.A N LYS 303.A O no hydrogen 2.959 N/A ILE 308.A N ASN 470.A O no hydrogen 3.120 N/A ARG 311.A N SER 466.A O no hydrogen 3.237 N/A ARG 311.A NH1 SER 338.A O no hydrogen 2.922 N/A LYS 312.A N ALA 309.A O no hydrogen 3.019 N/A ALA 313.A N ALA 309.A O no hydrogen 3.136 N/A TYR 314.A N THR 310.A O no hydrogen 2.831 N/A GLY 315.A N ARG 311.A O no hydrogen 3.410 N/A GLN 316.A N LYS 312.A O no hydrogen 3.105 N/A ALA 317.A N ALA 313.A O no hydrogen 2.839 N/A LEU 318.A N TYR 314.A O no hydrogen 2.810 N/A ALA 319.A N GLY 315.A O no hydrogen 3.058 N/A LYS 320.A N GLN 316.A O no hydrogen 2.939 N/A LYS 320.A NZ SER 298.A O no hydrogen 3.406 N/A LYS 320.A NZ SER 298.A OG no hydrogen 3.227 N/A LYS 320.A NZ LEU 299.A O no hydrogen 2.769 N/A LYS 320.A NZ GLU 448.A OE2 no hydrogen 2.810 N/A LEU 321.A N ALA 317.A O no hydrogen 2.909 N/A GLY 322.A N LEU 318.A O no hydrogen 3.012 N/A HIS 323.A N LYS 320.A O no hydrogen 3.146 N/A HIS 323.A NE2 GLU 347.A OE2 no hydrogen 3.005 N/A ALA 324.A N LEU 321.A O no hydrogen 2.990 N/A SER 325.A N LEU 321.A O no hydrogen 3.280 N/A ARG 327.A N SER 325.A OG no hydrogen 2.879 N/A ARG 327.A NH1 ALA 292.A O no hydrogen 2.868 N/A ILE 328.A N SER 325.A O no hydrogen 3.508 N/A ILE 329.A N VAL 376.A O no hydrogen 3.248 N/A ALA 330.A N ARG 351.A O no hydrogen 2.949 N/A LEU 331.A N PHE 378.A O no hydrogen 2.865 N/A ASP 332.A N ILE 353.A O no hydrogen 3.271 N/A ASP 334.A N GLU 354.A OE2 no hydrogen 2.797 N/A THR 335.A N ASP 332.A OD1 no hydrogen 2.931 N/A THR 335.A OG1 ASP 332.A OD1 no hydrogen 2.697 N/A LYS 336.A NZ GLU 354.A OE1 no hydrogen 2.900 N/A SER 338.A N THR 335.A O no hydrogen 2.876 N/A THR 339.A N THR 335.A O no hydrogen 2.893 N/A THR 339.A OG1 ASP 332.A OD2 no hydrogen 2.664 N/A THR 339.A OG1 THR 335.A O no hydrogen 3.337 N/A THR 339.A OG1 SER 341.A OG no hydrogen 3.298 N/A SER 341.A N THR 339.A OG1 no hydrogen 3.267 N/A SER 341.A OG ASP 332.A OD2 no hydrogen 2.728 N/A SER 341.A OG THR 339.A OG1 no hydrogen 3.298 N/A GLU 342.A N LYS 336.A O no hydrogen 3.147 N/A ILE 343.A N PHE 340.A O no hydrogen 3.097 N/A LYS 345.A N SER 341.A O no hydrogen 3.079 N/A LYS 346.A N GLU 342.A O no hydrogen 2.966 N/A GLU 347.A N ILE 343.A O no hydrogen 3.257 N/A HIS 348.A N PHE 344.A O no hydrogen 2.713 N/A HIS 348.A NE2 ALA 319.A O no hydrogen 2.732 N/A ARG 351.A N HIS 348.A O no hydrogen 3.101 N/A ARG 351.A NH1 GLY 322.A O no hydrogen 3.348 N/A ARG 351.A NH1 ILE 328.A O no hydrogen 2.792 N/A ARG 351.A NH2 GLY 322.A O no hydrogen 2.956 N/A PHE 352.A N PRO 349.A O no hydrogen 3.224 N/A ILE 353.A N ALA 330.A O no hydrogen 2.786 N/A CYS 355.A N ASP 332.A O no hydrogen 2.918 N/A CYS 355.A SG ILE 353.A O no hydrogen 3.846 N/A TYR 356.A N GLU 354.A OE2 no hydrogen 2.999 N/A ALA 358.A N TYR 356.A O no hydrogen 2.817 N/A GLN 360.A NE2 GLU 158.A OE2 no hydrogen 3.064 N/A ASN 361.A N GLU 158.A OE1 no hydrogen 3.070 N/A MET 362.A N ALA 358.A O no hydrogen 2.955 N/A VAL 363.A N GLU 359.A O no hydrogen 3.200 N/A SER 364.A N GLN 360.A O no hydrogen 3.196 N/A SER 364.A OG GLN 360.A O no hydrogen 3.562 N/A ILE 365.A N ASN 361.A O no hydrogen 2.675 N/A ALA 366.A N MET 362.A O no hydrogen 3.084 N/A VAL 367.A N VAL 363.A O no hydrogen 2.991 N/A GLY 368.A N SER 364.A O no hydrogen 2.965 N/A CYS 369.A N ILE 365.A O no hydrogen 2.846 N/A CYS 369.A SG GLY 127.A O no hydrogen 3.778 N/A CYS 369.A SG THR 131.A OG1 no hydrogen 3.440 N/A CYS 369.A SG ILE 365.A O no hydrogen 3.366 N/A ALA 370.A N ALA 366.A O no hydrogen 2.984 N/A THR 371.A N GLY 368.A O no hydrogen 3.219 N/A THR 371.A OG1 GLY 368.A O no hydrogen 2.722 N/A ARG 372.A NE ASP 112.A OD1 no hydrogen 3.034 N/A ARG 372.A NE ASP 112.A OD2 no hydrogen 3.249 N/A ARG 372.A NH1 ASN 58.A O no hydrogen 2.984 N/A ARG 372.A NH2 ASP 112.A OD2 no hydrogen 2.666 N/A ASN 373.A N ALA 370.A O no hydrogen 3.219 N/A ARG 374.A NE ASP 136.A OD1.B no hydrogen 3.212 N/A ARG 374.A NE ASP 136.A OD2.A no hydrogen 3.478 N/A ARG 374.A NE ASP 136.A OD2.B no hydrogen 3.006 N/A ARG 374.A NH2 ASP 136.A OD1.B no hydrogen 3.006 N/A ARG 374.A NH2 PRO 287.A O no hydrogen 2.736 N/A THR 375.A OG1 CYS 369.A O no hydrogen 2.796 N/A VAL 376.A N ARG 327.A O no hydrogen 2.931 N/A PHE 378.A N ILE 329.A O no hydrogen 2.936 N/A CYS 379.A N ASN 404.A O no hydrogen 2.912 N/A CYS 379.A SG.A MET 362.A O no hydrogen 3.984 N/A CYS 379.A SG.B ASN 404.A O no hydrogen 3.855 N/A SER 380.A N LEU 331.A O no hydrogen 2.927 N/A SER 380.A OG LEU 331.A O no hydrogen 3.481 N/A SER 380.A OG ASP 332.A OD2 no hydrogen 2.410 N/A THR 381.A N CYS 406.A O no hydrogen 3.335 N/A PHE 382.A N THR 381.A OG1 no hydrogen 2.744 N/A ALA 383.A N SER 408.A O no hydrogen 2.758 N/A PHE 385.A N PHE 382.A O no hydrogen 2.908 N/A PHE 386.A N ALA 383.A O no hydrogen 3.220 N/A THR 387.A N ALA 384.A O no hydrogen 3.288 N/A THR 387.A OG1 ALA 384.A O no hydrogen 2.669 N/A ARG 388.A N PHE 385.A O no hydrogen 3.058 N/A ALA 389.A N PHE 386.A O no hydrogen 2.826 N/A GLN 392.A N GLN 392.A OE1 no hydrogen 2.752 N/A GLN 392.A NE2 GLN 360.A OE1 no hydrogen 3.428 N/A ILE 393.A N ALA 389.A O no hydrogen 2.990 N/A ARG 394.A N PHE 390.A O no hydrogen 2.853 N/A ARG 394.A NE ASP 391.A OD1 no hydrogen 2.879 N/A ARG 394.A NH2 ASP 391.A OD1 no hydrogen 2.926 N/A MET 395.A N ASP 391.A O no hydrogen 2.907 N/A ALA 396.A N GLN 392.A O no hydrogen 2.812 N/A ALA 397.A N ILE 393.A O no hydrogen 3.167 N/A ILE 398.A N ARG 394.A O no hydrogen 3.275 N/A SER 399.A N MET 395.A O no hydrogen 2.756 N/A SER 399.A OG MET 395.A O no hydrogen 2.750 N/A GLU 400.A N ALA 397.A O no hydrogen 2.966 N/A SER 401.A N ALA 396.A O no hydrogen 2.975 N/A ASN 404.A N PRO 377.A O no hydrogen 3.144 N/A ASN 404.A ND2 PRO 377.A O no hydrogen 3.158 N/A LEU 405.A N CYS 461.A O no hydrogen 2.659 N/A CYS 406.A N CYS 379.A O no hydrogen 2.807 N/A CYS 406.A SG ILE 463.A O no hydrogen 3.614 N/A GLY 407.A N ILE 463.A O no hydrogen 2.961 N/A SER 408.A N THR 381.A O no hydrogen 2.956 N/A SER 408.A OG HIS 409.A ND1 no hydrogen 2.837 N/A HIS 409.A ND1 SER 408.A OG no hydrogen 2.837 N/A CYS 410.A N THR 465.A O no hydrogen 3.311 N/A CYS 410.A SG TYR 440.A OH no hydrogen 3.678 N/A CYS 410.A SG THR 465.A O no hydrogen 3.336 N/A CYS 410.A SG SER 466.A OG no hydrogen 3.382 N/A GLY 411.A N ALA 423.A O no hydrogen 2.875 N/A VAL 412.A N ASP 554.A OD1 no hydrogen 2.791 N/A SER 413.A N ASP 554.A OD2 no hydrogen 3.046 N/A SER 413.A OG CYS 410.A O no hydrogen 3.502 N/A GLY 415.A N VAL 412.A O no hydrogen 3.119 N/A SER 420.A OG GLN 421.A OE1 no hydrogen 2.759 N/A GLN 421.A N GLY 418.A O no hydrogen 3.250 N/A MET 422.A N PRO 419.A O no hydrogen 3.095 N/A LEU 424.A N GLU 425.A OE2 no hydrogen 2.995 N/A ASP 426.A N ASP 426.A OD1 no hydrogen 2.581 N/A LEU 427.A N HIS 555.A NE2 no hydrogen 3.176 N/A ALA 428.A N HIS 555.A NE2 no hydrogen 3.379 N/A MET 429.A N GLU 425.A O no hydrogen 2.964 N/A PHE 430.A N ASP 426.A O no hydrogen 2.956 N/A ARG 431.A N LEU 427.A O no hydrogen 2.783 N/A ARG 431.A NH1 GLY 559.A O no hydrogen 2.734 N/A SER 432.A N ALA 428.A O no hydrogen 3.212 N/A SER 432.A N MET 429.A O no hydrogen 3.173 N/A SER 432.A OG MET 429.A O no hydrogen 2.610 N/A VAL 433.A N PHE 430.A O no hydrogen 3.158 N/A SER 436.A N VAL 433.A O no hydrogen 3.075 N/A SER 436.A OG PHE 430.A O no hydrogen 2.685 N/A SER 436.A OG VAL 433.A O no hydrogen 3.009 N/A THR 437.A N ILE 460.A O no hydrogen 2.936 N/A VAL 438.A N LYS 531.A O no hydrogen 2.888 N/A PHE 439.A N PHE 462.A O no hydrogen 2.845 N/A TYR 440.A N PHE 528.A O no hydrogen 2.881 N/A SER 442.A OG ASP 526.A OD1 no hydrogen 2.748 N/A SER 442.A OG ASP 526.A OD2 no hydrogen 3.406 N/A VAL 445.A N ASP 443.A OD1.A no hydrogen 2.767 N/A ALA 446.A N ASP 443.A OD1.B no hydrogen 2.838 N/A THR 447.A N ASP 443.A O.A no hydrogen 3.016 N/A THR 447.A N ASP 443.A O.B no hydrogen 2.937 N/A THR 447.A OG1 ASP 443.A O.A no hydrogen 2.612 N/A THR 447.A OG1 ASP 443.A O.B no hydrogen 3.022 N/A GLU 448.A N GLY 444.A O no hydrogen 3.057 N/A LYS 449.A N VAL 445.A O no hydrogen 3.060 N/A ALA 450.A N ALA 446.A O no hydrogen 2.890 N/A VAL 451.A N THR 447.A O no hydrogen 3.032 N/A GLU 452.A N GLU 448.A O no hydrogen 3.177 N/A LEU 453.A N LYS 449.A O no hydrogen 3.035 N/A ALA 454.A N ALA 450.A O no hydrogen 2.875 N/A ALA 455.A N VAL 451.A O no hydrogen 3.221 N/A ASN 456.A N LEU 453.A O no hydrogen 3.030 N/A ASN 456.A ND2 ILE 294.A O no hydrogen 2.772 N/A THR 457.A N ALA 454.A O no hydrogen 3.374 N/A THR 457.A OG1 LEU 453.A O no hydrogen 2.801 N/A GLY 459.A N ASN 402.A OD1 no hydrogen 2.776 N/A ILE 460.A N THR 435.A O no hydrogen 3.342 N/A CYS 461.A N ILE 403.A O no hydrogen 3.055 N/A CYS 461.A SG ALA 454.A O no hydrogen 3.790 N/A PHE 462.A N THR 437.A O no hydrogen 3.026 N/A ILE 463.A N LEU 405.A O no hydrogen 2.776 N/A ARG 464.A N PHE 439.A O no hydrogen 2.980 N/A ARG 464.A NE ASP 426.A OD1 no hydrogen 3.434 N/A ARG 464.A NE ASP 426.A OD2 no hydrogen 2.630 N/A ARG 464.A NH1 ASP 554.A O no hydrogen 3.003 N/A ARG 464.A NH2 ASP 426.A OD1 no hydrogen 2.842 N/A ARG 464.A NH2 ASP 554.A O no hydrogen 2.998 N/A THR 465.A N GLY 407.A O no hydrogen 2.956 N/A SER 466.A N THR 310.A OG1 no hydrogen 2.804 N/A ASN 470.A N ILE 308.A O no hydrogen 3.372 N/A ILE 472.A N ASP 306.A O no hydrogen 2.869 N/A ILE 473.A N ASP 443.A OD2.A no hydrogen 2.652 N/A ILE 473.A N ASP 443.A OD2.B no hydrogen 2.884 N/A TYR 474.A N ASP 443.A OD2.A no hydrogen 2.860 N/A TYR 474.A N ASP 443.A OD2.B no hydrogen 3.024 N/A TYR 474.A OH ASP 526.A OD2 no hydrogen 2.586 N/A ASN 476.A ND2 TYR 302.A O no hydrogen 2.733 N/A GLU 478.A N ASN 475.A O no hydrogen 3.078 N/A GLN 481.A NE2 ASP 479.A OD1 no hydrogen 3.355 N/A GLN 481.A NE2 ASP 479.A OD2 no hydrogen 3.045 N/A GLY 483.A N THR 529.A OG1 no hydrogen 2.957 N/A GLN 484.A N GLN 481.A O no hydrogen 3.144 N/A ALA 485.A N ASP 534.A OD2 no hydrogen 2.984 N/A LYS 486.A N ASP 526.A O no hydrogen 2.820 N/A LYS 486.A NZ GLU 478.A OE2 no hydrogen 2.892 N/A LYS 486.A NZ ASP 479.A O no hydrogen 2.426 N/A LYS 486.A NZ GLN 484.A OE1 no hydrogen 3.379 N/A VAL 488.A N VAL 524.A O no hydrogen 2.918 N/A SER 491.A N ASP 494.A OD2 no hydrogen 2.981 N/A SER 491.A OG ASP 494.A OD1 no hydrogen 2.667 N/A ASP 493.A N SER 491.A OG no hydrogen 3.044 N/A GLN 495.A N ASN 521.A O no hydrogen 2.873 N/A THR 497.A N ARG 548.A O no hydrogen 2.967 N/A THR 497.A OG1 THR 545.A OG1 no hydrogen 2.841 N/A VAL 498.A N ARG 523.A O no hydrogen 2.735 N/A ILE 499.A N LEU 550.A O no hydrogen 2.868 N/A GLY 500.A N LEU 525.A O no hydrogen 3.364 N/A ALA 501.A N THR 504.A OG1 no hydrogen 3.062 N/A GLY 502.A N SER 442.A OG no hydrogen 2.922 N/A THR 504.A N ALA 501.A O no hydrogen 3.018 N/A THR 504.A OG1 ALA 501.A O no hydrogen 3.016 N/A THR 504.A OG1 VAL 552.A O no hydrogen 2.653 N/A LEU 505.A N GLY 502.A O no hydrogen 2.976 N/A HIS 506.A N GLY 502.A O no hydrogen 3.463 N/A HIS 506.A NE2 SER 442.A O no hydrogen 2.948 N/A GLU 507.A N VAL 503.A O no hydrogen 2.989 N/A ALA 508.A N THR 504.A O no hydrogen 3.028 N/A LEU 509.A N LEU 505.A O no hydrogen 2.991 N/A ALA 510.A N HIS 506.A O no hydrogen 2.980 N/A ALA 511.A N GLU 507.A O no hydrogen 2.839 N/A ALA 512.A N ALA 508.A O no hydrogen 2.875 N/A GLU 513.A N LEU 509.A O no hydrogen 3.194 N/A LEU 514.A N ALA 510.A O no hydrogen 3.142 N/A LEU 515.A N ALA 511.A O no hydrogen 2.928 N/A LYS 516.A N ALA 512.A O no hydrogen 2.827 N/A GLU 518.A N LEU 515.A O no hydrogen 2.873 N/A LYS 519.A N LYS 516.A O no hydrogen 3.196 N/A ILE 520.A N LEU 515.A O no hydrogen 3.061 N/A ARG 523.A N VAL 496.A O no hydrogen 2.971 N/A ARG 523.A NE ASP 494.A OD2 no hydrogen 2.845 N/A ARG 523.A NH2 SER 491.A O no hydrogen 2.942 N/A ARG 523.A NH2 ASP 494.A OD2 no hydrogen 3.134 N/A VAL 524.A N LEU 489.A O no hydrogen 3.058 N/A LEU 525.A N VAL 498.A O no hydrogen 2.973 N/A ASP 526.A N LYS 486.A O no hydrogen 2.754 N/A THR 529.A N PRO 527.A O no hydrogen 2.828 N/A THR 529.A OG1 PRO 532.A O no hydrogen 2.571 N/A ILE 530.A N VAL 438.A O no hydrogen 2.818 N/A LYS 531.A NZ ARG 431.A O no hydrogen 2.836 N/A LYS 531.A NZ VAL 433.A O no hydrogen 3.035 N/A LYS 531.A NZ SER 436.A OG no hydrogen 3.294 N/A ARG 535.A NE ALA 568.A O no hydrogen 2.864 N/A ARG 535.A NH2 ALA 568.A O no hydrogen 3.345 N/A ARG 535.A NH2 GLU 572.A OE2 no hydrogen 2.700 N/A LYS 536.A NZ ASP 540.A OD2 no hydrogen 3.297 N/A LEU 537.A N ASP 534.A OD1 no hydrogen 3.029 N/A ILE 538.A N ASP 534.A O no hydrogen 3.235 N/A LEU 539.A N ARG 535.A O no hydrogen 2.899 N/A ASP 540.A N LYS 536.A O no hydrogen 2.799 N/A SER 541.A N LEU 537.A O no hydrogen 2.958 N/A SER 541.A OG LEU 537.A O no hydrogen 2.639 N/A ALA 542.A N ILE 538.A O no hydrogen 2.849 N/A ARG 543.A N LEU 539.A O no hydrogen 3.050 N/A ARG 543.A NH2 GLU 572.A OE1 no hydrogen 3.447 N/A ARG 543.A NH2 PRO 573.A O no hydrogen 3.401 N/A ALA 544.A N ASP 540.A O no hydrogen 3.213 N/A THR 545.A N ALA 542.A O no hydrogen 2.728 N/A THR 545.A OG1 THR 497.A OG1 no hydrogen 2.841 N/A THR 545.A OG1 SER 541.A O no hydrogen 3.393 N/A THR 545.A OG1 ALA 542.A O no hydrogen 3.200 N/A THR 545.A OG1 ARG 548.A O no hydrogen 3.155 N/A GLY 547.A N ALA 542.A O no hydrogen 2.686 N/A ARG 548.A N THR 545.A O no hydrogen 2.971 N/A ARG 548.A NE GLN 495.A O no hydrogen 3.039 N/A ARG 548.A NH2 GLN 495.A O no hydrogen 2.963 N/A ILE 549.A N THR 576.A O no hydrogen 2.961 N/A LEU 550.A N THR 497.A O no hydrogen 2.791 N/A THR 551.A N THR 578.A O no hydrogen 2.955 N/A THR 551.A OG1 HIS 579.A ND1 no hydrogen 2.760 N/A VAL 552.A N ILE 499.A O no hydrogen 2.934 N/A GLU 553.A N LEU 580.A O no hydrogen 2.986 N/A HIS 555.A ND1 TYR 556.A O no hydrogen 2.773 N/A TYR 556.A N LEU 424.A O no hydrogen 2.891 N/A TYR 557.A OH ALA 581.A O no hydrogen 3.381 N/A GLU 558.A N GLU 558.A OE1 no hydrogen 2.863 N/A GLY 559.A N GLU 563.A OE1 no hydrogen 2.933 N/A ILE 561.A N GLU 553.A OE1 no hydrogen 2.774 N/A GLY 562.A N GLU 553.A OE2 no hydrogen 2.775 N/A ALA 564.A N GLY 560.A O no hydrogen 3.091 N/A VAL 565.A N ILE 561.A O no hydrogen 2.922 N/A SER 566.A N GLY 562.A O no hydrogen 3.051 N/A SER 566.A OG GLY 562.A O no hydrogen 3.018 N/A SER 566.A OG HIS 579.A NE2 no hydrogen 2.973 N/A SER 567.A N GLU 563.A O no hydrogen 3.035 N/A SER 567.A OG GLU 563.A O no hydrogen 3.484 N/A SER 567.A OG ALA 564.A O no hydrogen 3.493 N/A ALA 568.A N ALA 564.A O no hydrogen 2.992 N/A VAL 569.A N VAL 565.A O no hydrogen 2.998 N/A VAL 569.A N SER 566.A O no hydrogen 3.242 N/A VAL 570.A N SER 566.A O no hydrogen 2.890 N/A GLU 572.A N VAL 569.A O no hydrogen 3.059 N/A ILE 575.A N GLU 572.A O no hydrogen 3.350 N/A THR 576.A N GLY 547.A O no hydrogen 2.775 N/A THR 578.A N ILE 549.A O no hydrogen 2.981 N/A THR 578.A OG1 ILE 549.A O no hydrogen 3.554 N/A HIS 579.A ND1 THR 551.A OG1 no hydrogen 2.760 N/A LEU 580.A N THR 551.A O no hydrogen 2.755 N/A ALA 581.A N TYR 557.A OH no hydrogen 3.208 N/A VAL 582.A N HIS 555.A O no hydrogen 3.043 N/A ARG 584.A NH1 ASN 583.A OD1 no hydrogen 2.686 N/A ARG 587.A NE SER 588.A O no hydrogen 2.977 N/A ARG 587.A NH2 SER 588.A O no hydrogen 3.038 N/A SER 588.A OG GLU 416.A O no hydrogen 2.726 N/A LYS 590.A N GLU 593.A OE1 no hydrogen 3.056 N/A LEU 594.A N LYS 590.A O no hydrogen 2.931 N/A LEU 595.A N PRO 591.A O no hydrogen 3.096 N/A LYS 596.A N ALA 592.A O no hydrogen 3.119 N/A LYS 596.A NZ ASP 601.A OD2 no hydrogen 3.407 N/A LYS 596.A NZ ASP 603.A OD2 no hydrogen 2.782 N/A MET 597.A N GLU 593.A O no hydrogen 2.835 N/A PHE 598.A N LEU 594.A O no hydrogen 2.858 N/A GLY 599.A N LYS 596.A O no hydrogen 3.102 N/A ILE 600.A N LEU 595.A O no hydrogen 3.004 N/A ARG 602.A N GLU 507.A OE1 no hydrogen 2.861 N/A ARG 602.A NH1 GLU 507.A OE2 no hydrogen 3.061 N/A ASP 603.A N ASP 601.A OD2 no hydrogen 3.390 N/A ALA 604.A N ASP 601.A OD1 no hydrogen 2.905 N/A ILE 605.A N ASP 601.A O no hydrogen 2.937 N/A ALA 606.A N ARG 602.A O no hydrogen 2.832 N/A GLN 607.A N ASP 603.A O no hydrogen 2.935 N/A ALA 608.A N ALA 604.A O no hydrogen 2.943 N/A VAL 609.A N ILE 605.A O no hydrogen 2.875 N/A ARG 610.A N ALA 606.A O no hydrogen 3.037 N/A ARG 610.A NE GLU 518.A OE1 no hydrogen 2.841 N/A ARG 610.A NH2 GLU 518.A OE2 no hydrogen 2.844 N/A GLY 611.A N GLN 607.A O no hydrogen 3.339 N/A LEU 612.A N VAL 609.A O no hydrogen 2.899 N/A ILE 613.A N ARG 610.A O no hydrogen 3.426 N/A