Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qgd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 27.A OD1 no hydrogen 2.972 N/A SER 1.A OG GLU 202.A OE1 no hydrogen 2.907 N/A SER 3.A N PHE 26.A O no hydrogen 2.939 N/A SER 3.A OG VAL 24.A O no hydrogen 2.648 N/A SER 3.A OG PHE 26.A O no hydrogen 3.180 N/A THR 5.A N TYR 248.A O no hydrogen 2.971 N/A TRP 6.A NE1 THR 25.A OG1 no hydrogen 2.823 N/A THR 7.A N CYS 246.A O no hydrogen 3.049 N/A THR 7.A OG1 ASN 245.A O no hydrogen 2.632 N/A ALA 9.A N THR 7.A OG1 no hydrogen 3.256 N/A THR 12.A OG1 SER 241.A OG no hydrogen 2.618 N/A LEU 19.A N SER 16.A O no hydrogen 3.063 N/A ARG 20.A NE ALA 129.A O no hydrogen 3.459 N/A ARG 20.A NH2 PRO 128.A O no hydrogen 3.538 N/A GLN 21.A N ALA 17.A O no hydrogen 2.891 N/A LYS 22.A N SER 18.A O no hydrogen 3.291 N/A VAL 24.A N ARG 20.A O no hydrogen 3.024 N/A THR 25.A OG1 GLN 21.A O no hydrogen 2.516 N/A PHE 26.A N SER 3.A OG no hydrogen 3.041 N/A ARG 28.A N SER 1.A O no hydrogen 3.193 N/A ARG 28.A NE SER 1.A O no hydrogen 2.910 N/A ARG 28.A NH1 SER 198.A O no hydrogen 2.755 N/A ARG 28.A NH1 VAL 200.A O no hydrogen 2.851 N/A ARG 28.A NH1 ARG 250.A O no hydrogen 3.374 N/A ARG 28.A NH2 SER 1.A O no hydrogen 3.501 N/A ARG 28.A NH2 SER 1.A OG no hydrogen 3.126 N/A ARG 28.A NH2 ARG 250.A O no hydrogen 2.621 N/A GLN 30.A NE2 ASP 204.A OD1 no hydrogen 2.816 N/A GLN 30.A NE2 TYR 318.A O no hydrogen 2.665 N/A VAL 31.A N ARG 317.A O no hydrogen 2.842 N/A TYR 36.A N ASP 33.A OD1 no hydrogen 3.223 N/A ARG 37.A N ASP 33.A O no hydrogen 3.231 N/A ARG 37.A NE ASP 34.A OD1 no hydrogen 3.419 N/A ARG 37.A NH2 ASP 34.A OD1 no hydrogen 2.705 N/A ASP 38.A N ASP 34.A O no hydrogen 2.860 N/A VAL 39.A N HIS 35.A O no hydrogen 3.027 N/A LEU 40.A N TYR 36.A O no hydrogen 2.964 N/A LYS 41.A N ARG 37.A O no hydrogen 3.085 N/A GLU 42.A N ASP 38.A O no hydrogen 3.078 N/A MET 43.A N VAL 39.A O no hydrogen 2.878 N/A LYS 44.A N LEU 40.A O no hydrogen 2.856 N/A ALA 45.A N LYS 41.A O no hydrogen 2.965 N/A LYS 46.A N GLU 42.A O no hydrogen 3.349 N/A LYS 46.A N MET 43.A O no hydrogen 3.131 N/A ALA 47.A N MET 43.A O no hydrogen 2.971 N/A SER 48.A N LYS 44.A O no hydrogen 3.006 N/A SER 48.A OG LYS 44.A O no hydrogen 2.842 N/A THR 49.A N LYS 46.A O no hydrogen 3.237 N/A THR 49.A OG1 LYS 46.A O no hydrogen 2.706 N/A VAL 50.A N ALA 47.A O no hydrogen 2.963 N/A ALA 52.A N ASP 216.A O no hydrogen 2.919 N/A LYS 53.A N ASP 149.A OD2 no hydrogen 2.783 N/A LEU 55.A N MET 145.A O no hydrogen 2.858 N/A SER 56.A N GLU 59.A OE1 no hydrogen 3.019 N/A SER 56.A OG GLU 59.A OE1 no hydrogen 3.293 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.860 N/A GLU 59.A N SER 56.A OG no hydrogen 3.263 N/A ALA 60.A N SER 56.A O no hydrogen 2.983 N/A CYS 61.A N VAL 57.A O no hydrogen 2.781 N/A CYS 61.A SG VAL 57.A O no hydrogen 3.200 N/A LYS 62.A N GLU 58.A O no hydrogen 3.025 N/A LEU 63.A N ALA 60.A O no hydrogen 3.346 N/A THR 64.A N CYS 61.A O no hydrogen 3.084 N/A THR 64.A OG1 ALA 60.A O no hydrogen 3.339 N/A THR 64.A OG1 CYS 61.A O no hydrogen 3.235 N/A SER 68.A N PRO 65.A O no hydrogen 3.102 N/A SER 68.A OG ASP 531.A OD1 no hydrogen 2.553 N/A SER 68.A OG ASP 531.A OD2 no hydrogen 3.018 N/A SER 71.A N TYR 75.A O no hydrogen 2.805 N/A SER 71.A OG ASP 136.A OD1 no hydrogen 3.384 N/A SER 71.A OG ASP 136.A OD2 no hydrogen 2.654 N/A LYS 72.A N ASP 136.A OD1 no hydrogen 2.880 N/A PHE 73.A N SER 71.A OG no hydrogen 2.950 N/A TYR 75.A OH HIS 90.A ND1 no hydrogen 2.651 N/A VAL 80.A N GLY 76.A O no hydrogen 3.153 N/A ARG 81.A N ALA 77.A O no hydrogen 2.956 N/A ARG 81.A NH1 LYS 62.A O no hydrogen 2.889 N/A ARG 81.A NH1 THR 64.A O no hydrogen 2.636 N/A ASN 82.A N LYS 78.A O no hydrogen 2.987 N/A LEU 83.A N VAL 80.A O no hydrogen 3.073 N/A SER 84.A N ASP 79.A O no hydrogen 2.870 N/A LYS 86.A NZ GLY 74.A O no hydrogen 3.026 N/A ALA 87.A N SER 84.A OG no hydrogen 3.317 N/A VAL 88.A N SER 84.A O no hydrogen 2.989 N/A ASN 89.A N SER 85.A O no hydrogen 2.925 N/A HIS 90.A N LYS 86.A O no hydrogen 3.026 N/A HIS 90.A ND1 TYR 75.A OH no hydrogen 2.651 N/A ILE 91.A N ALA 87.A O no hydrogen 2.898 N/A ARG 92.A N VAL 88.A O no hydrogen 2.967 N/A SER 93.A N ASN 89.A O no hydrogen 3.145 N/A SER 93.A OG HIS 90.A O no hydrogen 2.837 N/A VAL 94.A N HIS 90.A O no hydrogen 2.897 N/A TRP 95.A N ILE 91.A O no hydrogen 2.917 N/A TRP 95.A NE1 GLU 220.A OE1 no hydrogen 3.014 N/A LYS 96.A N ARG 92.A O no hydrogen 2.965 N/A ASP 97.A N SER 93.A O no hydrogen 2.965 N/A LEU 98.A N VAL 94.A O no hydrogen 2.999 N/A LEU 99.A N TRP 95.A O no hydrogen 3.131 N/A GLU 100.A N LYS 96.A O no hydrogen 3.069 N/A ASP 101.A N ASP 97.A O no hydrogen 2.761 N/A GLU 103.A N ASP 101.A OD1 no hydrogen 3.012 N/A THR 104.A N ASP 101.A OD1 no hydrogen 2.925 N/A THR 104.A OG1 ASP 101.A OD1 no hydrogen 3.160 N/A THR 104.A OG1 ASP 101.A OD2 no hydrogen 2.600 N/A ILE 106.A N ARG 231.A O no hydrogen 2.817 N/A THR 108.A N PRO 237.A O no hydrogen 3.296 N/A THR 108.A OG1 PRO 237.A O no hydrogen 2.905 N/A THR 109.A N PHE 134.A O no hydrogen 2.849 N/A ILE 110.A N THR 239.A O no hydrogen 2.882 N/A MET 111.A N ILE 132.A O no hydrogen 2.878 N/A LYS 113.A N ARG 130.A O no hydrogen 2.624 N/A LYS 113.A NZ GLU 115.A OE1 no hydrogen 3.555 N/A LYS 123.A N GLN 120.A OE1 no hydrogen 3.059 N/A ALA 129.A N SER 16.A OG no hydrogen 3.006 N/A ILE 132.A N MET 111.A O no hydrogen 2.740 N/A VAL 133.A N SER 254.A OG no hydrogen 3.199 N/A PHE 134.A N THR 109.A O no hydrogen 2.995 N/A GLY 138.A N ASP 136.A OD2 no hydrogen 3.363 N/A ARG 140.A N ASP 136.A O no hydrogen 3.054 N/A ARG 140.A NE ASP 531.A OD2 no hydrogen 2.968 N/A ARG 140.A NH1 PRO 135.A O no hydrogen 2.867 N/A ARG 140.A NH2 SER 68.A OG no hydrogen 2.668 N/A ARG 140.A NH2 ALA 69.A O no hydrogen 2.873 N/A VAL 141.A N LEU 137.A O no hydrogen 3.117 N/A CYS 142.A N GLY 138.A O no hydrogen 3.291 N/A CYS 142.A SG ILE 91.A O no hydrogen 3.585 N/A CYS 142.A SG GLY 138.A O no hydrogen 3.412 N/A GLU 143.A N VAL 139.A O no hydrogen 2.862 N/A LYS 144.A N ARG 140.A O no hydrogen 3.424 N/A LYS 144.A NZ ASP 531.A O no hydrogen 2.886 N/A LYS 144.A NZ ASP 531.A OD2 no hydrogen 3.414 N/A MET 145.A N VAL 141.A O no hydrogen 3.172 N/A ALA 146.A N CYS 142.A O no hydrogen 3.169 N/A LEU 147.A N GLU 143.A O no hydrogen 2.753 N/A TYR 148.A N LYS 144.A O no hydrogen 2.863 N/A VAL 151.A N LEU 147.A O no hydrogen 2.859 N/A SER 152.A N TYR 148.A O no hydrogen 3.123 N/A SER 152.A OG TYR 148.A O no hydrogen 2.648 N/A SER 152.A OG TYR 527.A OH no hydrogen 2.595 N/A THR 153.A N ASP 149.A O no hydrogen 3.085 N/A THR 153.A N VAL 150.A O no hydrogen 3.157 N/A THR 153.A OG1 ASP 149.A O no hydrogen 3.118 N/A THR 153.A OG1 ASP 149.A OD1 no hydrogen 3.261 N/A LEU 154.A N VAL 150.A O no hydrogen 2.814 N/A ALA 157.A N THR 153.A O no hydrogen 3.429 N/A VAL 158.A N LEU 154.A O no hydrogen 2.942 N/A MET 159.A N PRO 155.A O no hydrogen 2.838 N/A GLY 160.A N GLN 156.A O no hydrogen 2.824 N/A SER 162.A N MET 159.A O no hydrogen 3.181 N/A SER 162.A OG MET 285.A O no hydrogen 2.950 N/A TYR 163.A N GLY 160.A O no hydrogen 3.117 N/A GLY 164.A N VAL 287.A O no hydrogen 2.892 N/A GLN 166.A NE2 GLY 160.A O no hydrogen 2.753 N/A GLN 166.A NE2 TYR 163.A O no hydrogen 2.766 N/A TYR 167.A N GLY 164.A O no hydrogen 3.310 N/A TYR 167.A OH SER 161.A O no hydrogen 2.599 N/A SER 168.A N GLN 171.A OE1 no hydrogen 2.890 N/A GLN 171.A N SER 168.A OG no hydrogen 3.245 N/A ARG 172.A N SER 168.A O no hydrogen 2.938 N/A ARG 172.A NH2 SER 337.A OG no hydrogen 2.746 N/A VAL 173.A N PRO 169.A O no hydrogen 3.038 N/A GLU 174.A N GLY 170.A O no hydrogen 2.960 N/A PHE 175.A N GLN 171.A O no hydrogen 2.878 N/A LEU 176.A N ARG 172.A O no hydrogen 3.103 N/A VAL 177.A N VAL 173.A O no hydrogen 2.882 N/A ASN 178.A N GLU 174.A O no hydrogen 2.904 N/A ALA 179.A N PHE 175.A O no hydrogen 2.962 N/A TRP 180.A N LEU 176.A O no hydrogen 2.978 N/A LYS 181.A N VAL 177.A O no hydrogen 2.896 N/A LYS 181.A NZ ASN 178.A O no hydrogen 2.970 N/A ALA 182.A N ASN 178.A O no hydrogen 2.987 N/A LYS 183.A N TRP 180.A O no hydrogen 3.430 N/A LYS 183.A NZ ASP 282.A O no hydrogen 2.669 N/A LYS 183.A NZ THR 284.A OG1 no hydrogen 2.848 N/A LYS 184.A N GLU 297.A OE1 no hydrogen 2.963 N/A CYS 185.A N GLU 297.A OE2 no hydrogen 3.103 N/A MET 187.A N CYS 296.A O no hydrogen 2.954 N/A GLY 188.A N GLU 329.A O no hydrogen 3.083 N/A PHE 189.A N VAL 294.A O no hydrogen 2.930 N/A TYR 191.A N LEU 292.A O no hydrogen 3.028 N/A TYR 191.A OH ALA 320.A O no hydrogen 2.751 N/A ARG 194.A N PRO 321.A O no hydrogen 2.968 N/A ARG 194.A NH1 LYS 23.A O no hydrogen 3.419 N/A CYS 195.A SG LYS 23.A O no hydrogen 4.048 N/A SER 198.A N CYS 195.A O no hydrogen 3.041 N/A SER 198.A OG VAL 24.A O no hydrogen 2.872 N/A THR 199.A N CYS 195.A O no hydrogen 3.220 N/A THR 199.A N PHE 196.A O no hydrogen 2.894 N/A THR 199.A OG1 PHE 196.A O no hydrogen 2.560 N/A THR 199.A OG1 SER 319.A O no hydrogen 3.369 N/A VAL 200.A N ASP 197.A O no hydrogen 3.382 N/A THR 201.A N ASP 204.A OD2 no hydrogen 3.070 N/A THR 201.A OG1 GLN 30.A OE1 no hydrogen 2.771 N/A ASP 204.A N THR 201.A OG1 no hydrogen 3.151 N/A ILE 205.A N THR 201.A O no hydrogen 3.177 N/A ARG 206.A N GLU 202.A O no hydrogen 3.042 N/A ARG 206.A NH1 GLU 230.A OE1 no hydrogen 2.995 N/A VAL 207.A N ASN 203.A O no hydrogen 2.793 N/A GLU 208.A N ASP 204.A O no hydrogen 3.009 N/A GLU 209.A N ILE 205.A O no hydrogen 3.037 N/A SER 210.A N ARG 206.A O no hydrogen 2.837 N/A SER 210.A OG VAL 207.A O no hydrogen 2.500 N/A ILE 211.A N VAL 207.A O no hydrogen 3.185 N/A ILE 211.A N GLU 208.A O no hydrogen 3.052 N/A TYR 212.A N GLU 208.A O no hydrogen 3.096 N/A TYR 212.A OH GLU 208.A OE1 no hydrogen 2.626 N/A GLN 213.A N GLU 209.A O no hydrogen 2.799 N/A GLN 213.A NE2 GLU 209.A OE2 no hydrogen 2.828 N/A GLN 213.A NE2 ARG 222.A O no hydrogen 3.607 N/A CYS 214.A N ILE 211.A O no hydrogen 3.140 N/A CYS 214.A SG LYS 44.A O no hydrogen 3.868 N/A CYS 214.A SG SER 210.A O no hydrogen 3.347 N/A CYS 215.A N TYR 212.A O no hydrogen 3.094 N/A CYS 215.A SG TYR 212.A O no hydrogen 3.363 N/A ASP 216.A N VAL 50.A O no hydrogen 2.839 N/A ARG 222.A N ALA 218.A O no hydrogen 2.989 N/A ARG 222.A NH1 GLN 213.A O no hydrogen 2.886 N/A ARG 222.A NH1 GLN 213.A OE1 no hydrogen 3.063 N/A ARG 222.A NH2 CYS 215.A O no hydrogen 3.134 N/A GLN 223.A N PRO 219.A O no hydrogen 2.971 N/A GLN 223.A NE2 GLN 223.A O no hydrogen 3.121 N/A GLN 223.A NE2 SER 227.A OG no hydrogen 3.089 N/A ALA 224.A N GLU 220.A O no hydrogen 2.835 N/A ILE 225.A N ALA 221.A O no hydrogen 2.886 N/A ARG 226.A N ARG 222.A O no hydrogen 3.126 N/A ARG 226.A NE GLU 209.A OE1 no hydrogen 3.304 N/A ARG 226.A NE GLU 209.A OE2 no hydrogen 2.852 N/A ARG 226.A NH2 GLU 209.A OE1 no hydrogen 2.822 N/A ARG 226.A NH2 GLU 230.A OE2 no hydrogen 2.799 N/A SER 227.A N GLN 223.A O no hydrogen 2.843 N/A SER 227.A OG LEU 98.A O no hydrogen 2.692 N/A SER 227.A OG ASP 101.A O no hydrogen 3.457 N/A SER 227.A OG GLN 223.A O no hydrogen 3.239 N/A LEU 228.A N ALA 224.A O no hydrogen 2.794 N/A THR 229.A N ILE 225.A O no hydrogen 3.021 N/A THR 229.A OG1 ILE 225.A O no hydrogen 2.735 N/A GLU 230.A N ARG 226.A O no hydrogen 3.257 N/A ARG 231.A N SER 227.A O no hydrogen 2.876 N/A ARG 231.A NE THR 104.A O no hydrogen 2.576 N/A ARG 231.A NH1 ASP 97.A O no hydrogen 3.131 N/A ARG 231.A NH1 ASP 97.A OD2 no hydrogen 2.958 N/A ARG 231.A NH1 ASP 101.A O no hydrogen 2.867 N/A ARG 231.A NH2 ASP 97.A OD2 no hydrogen 2.804 N/A ARG 231.A NH2 THR 104.A O no hydrogen 3.517 N/A LEU 232.A N LEU 228.A O no hydrogen 2.889 N/A TYR 233.A N LEU 228.A O no hydrogen 2.832 N/A TYR 233.A OH GLU 143.A OE1 no hydrogen 2.669 N/A ILE 234.A N THR 229.A O no hydrogen 2.921 N/A GLY 236.A N ARG 249.A O no hydrogen 3.031 N/A LEU 238.A N GLY 247.A O no hydrogen 3.058 N/A THR 239.A N THR 108.A O no hydrogen 2.848 N/A THR 239.A OG1 ASP 107.A OD1 no hydrogen 2.684 N/A THR 239.A OG1 ASP 107.A OD2 no hydrogen 3.171 N/A ASN 240.A N GLN 244.A O no hydrogen 3.023 N/A ASN 240.A ND2 LEU 10.A O no hydrogen 2.710 N/A ASN 240.A ND2 GLN 244.A OE1 no hydrogen 2.955 N/A SER 241.A OG THR 12.A O no hydrogen 3.206 N/A SER 241.A OG THR 12.A OG1 no hydrogen 2.618 N/A SER 241.A OG PRO 13.A O no hydrogen 2.758 N/A GLY 243.A N ASN 240.A O no hydrogen 2.990 N/A GLN 244.A N ASN 240.A OD1 no hydrogen 3.041 N/A CYS 246.A N LEU 238.A O no hydrogen 2.904 N/A CYS 246.A SG ALA 9.A O no hydrogen 3.622 N/A CYS 246.A SG LEU 10.A O no hydrogen 3.608 N/A TYR 248.A N THR 5.A O no hydrogen 2.797 N/A ARG 249.A N GLY 236.A O no hydrogen 2.927 N/A ARG 249.A NH1 LEU 232.A O no hydrogen 3.347 N/A ARG 249.A NH1 TYR 233.A O no hydrogen 3.199 N/A ARG 249.A NH1 CYS 251.A O no hydrogen 2.800 N/A ARG 249.A NH2 LEU 232.A O no hydrogen 2.667 N/A ARG 250.A N SER 3.A O no hydrogen 2.755 N/A ARG 250.A NE GLU 202.A OE2 no hydrogen 3.171 N/A CYS 251.A SG SER 3.A O no hydrogen 3.629 N/A CYS 251.A SG ARG 252.A O no hydrogen 3.864 N/A ARG 252.A N ASP 197.A O no hydrogen 3.131 N/A ARG 252.A NE ASN 263.A OD1 no hydrogen 2.737 N/A ARG 252.A NH1 GLU 208.A OE1 no hydrogen 3.401 N/A ARG 252.A NH1 GLU 208.A OE2 no hydrogen 2.753 N/A ARG 252.A NH2 GLU 208.A OE2 no hydrogen 2.956 N/A ARG 252.A NH2 ASN 263.A OD1 no hydrogen 3.455 N/A SER 254.A OG LEU 131.A O no hydrogen 3.377 N/A GLY 255.A N VAL 133.A O no hydrogen 2.772 N/A VAL 256.A N THR 259.A OG1 no hydrogen 3.314 N/A LEU 257.A N GLU 143.A OE1 no hydrogen 2.840 N/A THR 259.A N VAL 256.A O no hydrogen 3.266 N/A THR 259.A OG1 ALA 253.A O no hydrogen 2.659 N/A THR 259.A OG1 VAL 256.A O no hydrogen 2.949 N/A CYS 261.A SG TYR 212.A OH no hydrogen 3.752 N/A GLY 262.A N THR 258.A O no hydrogen 2.709 N/A ASN 263.A N THR 259.A O no hydrogen 2.881 N/A ASN 263.A ND2 ASP 197.A OD1 no hydrogen 2.939 N/A THR 264.A N SER 260.A O no hydrogen 2.902 N/A THR 264.A OG1 SER 260.A O no hydrogen 2.679 N/A LEU 265.A N CYS 261.A O no hydrogen 2.954 N/A THR 266.A N GLY 262.A O no hydrogen 2.938 N/A THR 266.A OG1 GLY 262.A O no hydrogen 2.792 N/A CYS 267.A N ASN 263.A O no hydrogen 2.916 N/A TYR 268.A N THR 264.A O no hydrogen 2.870 N/A LEU 269.A N LEU 265.A O no hydrogen 2.874 N/A LYS 270.A N THR 266.A O no hydrogen 3.054 N/A LYS 270.A NZ ASP 204.A OD2 no hydrogen 2.716 N/A LYS 270.A NZ TYR 318.A O no hydrogen 3.049 N/A LYS 270.A NZ SER 319.A O no hydrogen 3.082 N/A ALA 271.A N CYS 267.A O no hydrogen 2.871 N/A ALA 272.A N TYR 268.A O no hydrogen 2.780 N/A ALA 273.A N LEU 269.A O no hydrogen 3.140 N/A ALA 274.A N LYS 270.A O no hydrogen 2.860 N/A CYS 275.A N ALA 271.A O no hydrogen 2.899 N/A CYS 275.A SG ALA 271.A O no hydrogen 3.285 N/A ARG 276.A N ALA 272.A O no hydrogen 3.424 N/A ARG 276.A NH1 GLU 42.A OE2 no hydrogen 3.185 N/A ARG 276.A NH2 GLU 42.A OE1 no hydrogen 2.789 N/A ARG 276.A NH2 GLU 42.A OE2 no hydrogen 3.217 N/A ALA 277.A N ALA 273.A O no hydrogen 3.142 N/A ALA 278.A N ALA 274.A O no hydrogen 2.928 N/A LYS 279.A N ARG 276.A O no hydrogen 3.238 N/A LEU 280.A N CYS 275.A O no hydrogen 3.130 N/A THR 284.A N ILE 295.A O no hydrogen 2.729 N/A LEU 286.A N VAL 293.A O no hydrogen 2.921 N/A VAL 287.A N SER 162.A O no hydrogen 2.912 N/A CYS 288.A N ASP 291.A O no hydrogen 2.837 N/A GLY 289.A N THR 264.A OG1 no hydrogen 2.907 N/A ASP 291.A N CYS 288.A O no hydrogen 2.888 N/A VAL 293.A N LEU 286.A O no hydrogen 2.947 N/A VAL 294.A N PHE 189.A O no hydrogen 2.863 N/A ILE 295.A N THR 284.A O no hydrogen 2.778 N/A CYS 296.A N MET 187.A O no hydrogen 2.742 N/A CYS 296.A SG MET 187.A O no hydrogen 3.752 N/A GLU 297.A N GLN 281.A O no hydrogen 2.872 N/A SER 298.A N CYS 185.A O no hydrogen 2.736 N/A SER 298.A OG ASP 304.A OD2 no hydrogen 2.555 N/A ALA 299.A N ASP 304.A OD1 no hydrogen 2.881 N/A GLY 300.A N SER 298.A OG no hydrogen 3.206 N/A GLU 303.A N GLU 303.A OE1 no hydrogen 2.801 N/A ASP 304.A N GLY 300.A O no hydrogen 2.837 N/A GLU 305.A N THR 301.A O no hydrogen 3.223 N/A ALA 306.A N GLN 302.A O no hydrogen 3.080 N/A SER 307.A N GLU 303.A O no hydrogen 2.810 N/A SER 307.A OG GLU 303.A O no hydrogen 2.790 N/A LEU 308.A N ASP 304.A O no hydrogen 3.112 N/A ARG 309.A N GLU 305.A O no hydrogen 3.214 N/A ALA 310.A N ALA 306.A O no hydrogen 3.032 N/A PHE 311.A N SER 307.A O no hydrogen 2.895 N/A THR 312.A N LEU 308.A O no hydrogen 2.938 N/A THR 312.A OG1 LEU 308.A O no hydrogen 2.822 N/A GLU 313.A N ARG 309.A O no hydrogen 2.918 N/A ALA 314.A N ALA 310.A O no hydrogen 3.101 N/A MET 315.A N PHE 311.A O no hydrogen 2.933 N/A THR 316.A N THR 312.A O no hydrogen 2.901 N/A THR 316.A OG1 THR 312.A O no hydrogen 2.721 N/A ARG 317.A N GLU 313.A O no hydrogen 3.053 N/A TYR 318.A N ALA 314.A O no hydrogen 3.060 N/A TYR 318.A OH ASP 33.A OD1 no hydrogen 2.654 N/A TYR 318.A OH ASP 33.A OD2 no hydrogen 3.136 N/A SER 319.A N THR 316.A O no hydrogen 2.990 N/A SER 319.A OG THR 199.A O no hydrogen 2.730 N/A ALA 320.A N MET 315.A O no hydrogen 2.840 N/A GLY 323.A N ASP 192.A O no hydrogen 2.844 N/A ASP 324.A N ASP 192.A OD2 no hydrogen 3.203 N/A GLU 329.A N GLY 188.A O no hydrogen 2.833 N/A TYR 330.A OH ASP 304.A OD2 no hydrogen 2.760 N/A LEU 334.A N ASP 331.A O no hydrogen 3.270 N/A ILE 335.A N LEU 332.A O no hydrogen 3.248 N/A SER 337.A N SER 340.A O no hydrogen 2.884 N/A CYS 338.A N ASP 291.A OD1 no hydrogen 2.888 N/A SER 340.A N SER 337.A O no hydrogen 3.061 N/A SER 340.A OG CYS 338.A O no hydrogen 3.086 N/A SER 340.A OG TYR 387.A OH no hydrogen 2.565 N/A ASN 341.A N THR 357.A O no hydrogen 2.906 N/A ASN 341.A ND2 VAL 342.A O no hydrogen 3.143 N/A SER 343.A N TYR 355.A O no hydrogen 2.878 N/A ALA 345.A N VAL 353.A O no hydrogen 2.820 N/A HIS 346.A N HIS 447.A O no hydrogen 2.866 N/A ASP 347.A N LYS 351.A O no hydrogen 2.868 N/A ALA 348.A N SER 445.A OG no hydrogen 3.161 N/A SER 349.A N ASP 347.A OD1 no hydrogen 3.005 N/A SER 349.A OG ASP 347.A OD1 no hydrogen 3.136 N/A GLY 350.A N ASP 347.A O no hydrogen 3.106 N/A LYS 351.A N ASP 347.A OD1 no hydrogen 3.041 N/A VAL 353.A N ALA 345.A O no hydrogen 2.847 N/A TYR 355.A N SER 343.A O no hydrogen 2.911 N/A THR 357.A N ASN 341.A O no hydrogen 3.011 N/A THR 357.A OG1 GLU 453.A OE2 no hydrogen 2.720 N/A ARG 358.A NE ASP 359.A O no hydrogen 2.890 N/A THR 361.A N ASP 359.A OD2 no hydrogen 3.037 N/A THR 361.A OG1 ASP 359.A OD2 no hydrogen 2.646 N/A LEU 364.A N PRO 360.A O no hydrogen 2.903 N/A ALA 365.A N THR 361.A O no hydrogen 2.941 N/A ARG 366.A N THR 362.A O no hydrogen 2.975 N/A ARG 366.A NE VAL 116.A O no hydrogen 2.694 N/A ARG 366.A NH2 VAL 116.A O no hydrogen 3.190 N/A ALA 367.A N PRO 363.A O no hydrogen 3.034 N/A ALA 368.A N LEU 364.A O no hydrogen 2.833 N/A TRP 369.A N ALA 365.A O no hydrogen 3.027 N/A GLU 370.A N ARG 366.A O no hydrogen 2.989 N/A THR 371.A N ALA 367.A O no hydrogen 2.828 N/A THR 371.A OG1 ALA 367.A O no hydrogen 3.172 N/A THR 371.A OG1 ALA 368.A O no hydrogen 2.875 N/A ALA 372.A N ALA 368.A O no hydrogen 3.124 N/A ARG 373.A N TRP 369.A O no hydrogen 2.896 N/A THR 375.A OG1 VAL 377.A O no hydrogen 2.932 N/A ASN 378.A N ASP 416.A O no hydrogen 3.029 N/A SER 379.A N GLU 370.A OE2 no hydrogen 2.973 N/A SER 379.A OG GLU 370.A OE1 no hydrogen 3.234 N/A SER 379.A OG GLU 370.A OE2 no hydrogen 2.737 N/A TRP 380.A N GLU 370.A OE1 no hydrogen 3.064 N/A LEU 381.A N ASN 378.A O no hydrogen 3.138 N/A GLY 382.A N ASN 378.A O no hydrogen 3.460 N/A ASN 383.A N SER 379.A O no hydrogen 2.834 N/A ILE 384.A N TRP 380.A O no hydrogen 2.978 N/A ILE 385.A N LEU 381.A O no hydrogen 3.105 N/A MET 386.A N GLY 382.A O no hydrogen 2.873 N/A TYR 387.A N ASN 383.A O no hydrogen 2.830 N/A TYR 387.A OH SER 340.A OG no hydrogen 2.565 N/A THR 390.A N TYR 387.A O no hydrogen 2.920 N/A THR 390.A OG1 TYR 387.A O no hydrogen 2.753 N/A TRP 392.A NE1 THR 357.A OG1 no hydrogen 3.219 N/A ALA 393.A N THR 390.A OG1 no hydrogen 3.078 N/A ARG 394.A N THR 390.A O no hydrogen 3.187 N/A ARG 394.A NH1 LEU 446.A O no hydrogen 2.884 N/A ARG 394.A NH1 TYR 449.A OH no hydrogen 2.928 N/A MET 395.A N LEU 391.A O no hydrogen 3.044 N/A ILE 396.A N TRP 392.A O no hydrogen 3.070 N/A LEU 397.A N TRP 392.A O no hydrogen 3.342 N/A MET 398.A N ALA 393.A O no hydrogen 2.893 N/A THR 399.A OG1 MET 395.A O no hydrogen 2.737 N/A HIS 400.A N ILE 396.A O no hydrogen 2.903 N/A PHE 401.A N LEU 397.A O no hydrogen 3.123 N/A PHE 402.A N MET 398.A O no hydrogen 2.978 N/A SER 403.A N THR 399.A O no hydrogen 3.172 N/A SER 403.A OG THR 399.A O no hydrogen 3.369 N/A SER 403.A OG HIS 400.A O no hydrogen 2.623 N/A ILE 404.A N HIS 400.A O no hydrogen 3.222 N/A LEU 405.A N PHE 401.A O no hydrogen 2.934 N/A LEU 406.A N PHE 402.A O no hydrogen 2.940 N/A ALA 407.A N SER 403.A O no hydrogen 3.143 N/A GLN 408.A N ILE 404.A O no hydrogen 2.863 N/A GLU 409.A N LEU 406.A O no hydrogen 3.253 N/A GLN 410.A N LEU 405.A O no hydrogen 3.011 N/A GLN 410.A NE2 GLU 409.A O no hydrogen 2.846 N/A LYS 413.A N GLN 410.A O no hydrogen 3.280 N/A LYS 413.A NZ GLN 410.A OE1 no hydrogen 3.389 N/A LEU 415.A N ILE 426.A O no hydrogen 2.808 N/A CYS 417.A N TYR 424.A O no hydrogen 2.847 N/A CYS 417.A SG TYR 424.A O no hydrogen 4.035 N/A ILE 419.A N ALA 422.A O no hydrogen 2.829 N/A ALA 422.A N ILE 419.A O no hydrogen 3.176 N/A CYS 423.A N ILE 532.A O no hydrogen 2.843 N/A CYS 423.A SG CYS 417.A O no hydrogen 4.028 N/A TYR 424.A N CYS 417.A O no hydrogen 2.772 N/A SER 425.A N HIS 534.A O no hydrogen 2.975 N/A ILE 426.A N LEU 415.A O no hydrogen 2.743 N/A ASP 430.A N GLU 427.A O no hydrogen 2.895 N/A LEU 431.A N PRO 428.A O no hydrogen 3.023 N/A ILE 434.A N ASP 430.A O no hydrogen 3.051 N/A ILE 435.A N LEU 431.A O no hydrogen 2.874 N/A GLN 436.A N PRO 432.A O no hydrogen 2.982 N/A GLN 436.A NE2 ILE 511.A O no hydrogen 3.578 N/A ARG 437.A N GLN 433.A O no hydrogen 3.087 N/A ARG 437.A NH1 ALA 514.A O no hydrogen 2.868 N/A ARG 437.A NH1 LEU 517.A O no hydrogen 2.819 N/A LEU 438.A N ILE 434.A O no hydrogen 2.951 N/A HIS 439.A N ILE 435.A O no hydrogen 2.784 N/A HIS 439.A NE2 ILE 385.A O no hydrogen 2.652 N/A GLY 440.A N GLN 436.A O no hydrogen 2.826 N/A ALA 443.A N GLY 440.A O no hydrogen 3.163 N/A PHE 444.A N LEU 441.A O no hydrogen 3.183 N/A SER 445.A N SER 442.A O no hydrogen 2.935 N/A SER 445.A OG SER 442.A O no hydrogen 3.375 N/A HIS 447.A N HIS 346.A O no hydrogen 2.936 N/A HIS 447.A NE2 ASP 347.A O no hydrogen 2.870 N/A SER 448.A OG HIS 346.A ND1 no hydrogen 3.287 N/A SER 448.A OG HIS 447.A ND1 no hydrogen 2.929 N/A TYR 449.A OH PRO 389.A O no hydrogen 2.535 N/A GLU 453.A N SER 450.A OG no hydrogen 3.122 N/A ILE 454.A N SER 450.A O no hydrogen 2.952 N/A ASN 455.A N PRO 451.A O no hydrogen 2.875 N/A ARG 456.A N GLY 452.A O no hydrogen 2.992 N/A ARG 456.A NH1 ASN 341.A OD1 no hydrogen 3.508 N/A ARG 456.A NH2 ASN 341.A OD1 no hydrogen 2.947 N/A ARG 456.A NH2 GLU 453.A OE1 no hydrogen 2.963 N/A VAL 457.A N GLU 453.A O no hydrogen 3.072 N/A ALA 458.A N ILE 454.A O no hydrogen 2.972 N/A SER 459.A N ASN 455.A O no hydrogen 2.960 N/A SER 459.A OG ASN 455.A O no hydrogen 2.950 N/A CYS 460.A N ARG 456.A O no hydrogen 3.144 N/A CYS 460.A SG THR 361.A OG1 no hydrogen 3.535 N/A LEU 461.A N VAL 457.A O no hydrogen 3.070 N/A ARG 462.A N ALA 458.A O no hydrogen 3.227 N/A LYS 463.A N SER 459.A O no hydrogen 3.036 N/A LYS 463.A NZ THR 361.A OG1 no hydrogen 2.818 N/A LEU 464.A N CYS 460.A O no hydrogen 3.069 N/A GLY 465.A N ARG 462.A O no hydrogen 3.284 N/A VAL 466.A N LEU 461.A O no hydrogen 2.847 N/A VAL 471.A N PRO 468.A O no hydrogen 2.998 N/A TRP 472.A NE1 PRO 467.A O no hydrogen 2.930 N/A ARG 473.A N LEU 469.A O no hydrogen 3.062 N/A ARG 473.A NE ALA 501.A O no hydrogen 2.997 N/A HIS 474.A N ARG 470.A O no hydrogen 3.330 N/A ARG 475.A N VAL 471.A O no hydrogen 2.961 N/A ALA 476.A N TRP 472.A O no hydrogen 2.819 N/A ARG 477.A N ARG 473.A O no hydrogen 3.278 N/A VAL 479.A N ARG 475.A O no hydrogen 3.135 N/A ARG 480.A N ALA 476.A O no hydrogen 2.741 N/A ALA 481.A N ARG 477.A O no hydrogen 3.029 N/A ARG 482.A N SER 478.A O no hydrogen 3.075 N/A ARG 482.A NE SER 478.A O no hydrogen 3.433 N/A LEU 483.A N VAL 479.A O no hydrogen 2.984 N/A LEU 484.A N ARG 480.A O no hydrogen 2.886 N/A SER 485.A N ALA 481.A O no hydrogen 3.161 N/A SER 485.A OG ARG 482.A O no hydrogen 2.754 N/A GLN 486.A N LEU 483.A O no hydrogen 3.101 N/A GLY 487.A N LEU 484.A O no hydrogen 3.396 N/A ARG 489.A NH1 GLU 427.A OE1 no hydrogen 2.860 N/A ARG 489.A NH1 ASP 430.A OD1 no hydrogen 2.839 N/A ARG 489.A NH2 GLU 427.A OE1 no hydrogen 3.019 N/A ALA 491.A N GLY 487.A O no hydrogen 3.096 N/A THR 492.A N GLY 488.A O no hydrogen 3.223 N/A THR 492.A OG1 GLY 488.A O no hydrogen 3.390 N/A CYS 493.A N ARG 489.A O no hydrogen 3.031 N/A CYS 493.A SG PRO 428.A O no hydrogen 3.951 N/A CYS 493.A SG LEU 429.A O no hydrogen 3.874 N/A CYS 493.A SG ARG 489.A O no hydrogen 3.486 N/A GLY 494.A N ALA 490.A O no hydrogen 3.179 N/A LYS 495.A N ALA 491.A O no hydrogen 2.834 N/A TYR 496.A N THR 492.A O no hydrogen 2.892 N/A TYR 496.A OH THR 509.A O no hydrogen 2.527 N/A LEU 497.A N CYS 493.A O no hydrogen 2.984 N/A PHE 498.A N GLY 494.A O no hydrogen 3.322 N/A ASN 499.A ND2 LEU 506.A O no hydrogen 3.288 N/A ALA 501.A N PHE 498.A O no hydrogen 3.204 N/A LYS 505.A NZ TRP 500.A O no hydrogen 2.772 N/A LYS 505.A NZ VAL 502.A O no hydrogen 3.321 N/A LEU 506.A N ASN 499.A OD1 no hydrogen 2.943 N/A ILE 511.A N GLN 436.A OE1 no hydrogen 2.666 N/A ALA 514.A N ILE 511.A O no hydrogen 3.229 N/A SER 515.A OG PRO 512.A O no hydrogen 3.348 N/A GLN 516.A N ALA 513.A O no hydrogen 3.103 N/A GLN 516.A NE2 ARG 538.A O no hydrogen 3.078 N/A LEU 517.A N ALA 514.A O no hydrogen 3.399 N/A ASP 518.A N SER 537.A O no hydrogen 2.755 N/A SER 520.A N ASP 518.A OD1 no hydrogen 3.347 N/A SER 520.A OG ASP 518.A OD1 no hydrogen 2.666 N/A TRP 522.A N LEU 519.A O no hydrogen 3.218 N/A GLY 526.A N TYR 163.A OH no hydrogen 2.933 N/A TYR 527.A OH SER 152.A OG no hydrogen 2.595 N/A GLY 530.A N TYR 527.A O no hydrogen 2.673 N/A TYR 533.A N LEU 63.A O no hydrogen 2.856 N/A HIS 534.A N CYS 423.A O no hydrogen 2.890 N/A LEU 536.A N SER 425.A O no hydrogen 3.200 N/A