Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xq0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A OG GLU 445.A OE2 no hydrogen 2.325 N/A GLU 7.A N PRO 3.A O no hydrogen 3.022 N/A GLN 8.A N LEU 4.A O no hydrogen 2.618 N/A ARG 9.A N SER 5.A O no hydrogen 3.095 N/A ARG 9.A N ILE 6.A O no hydrogen 2.804 N/A ARG 9.A NH2 GLU 445.A OE1 no hydrogen 3.410 N/A ARG 9.A NH2 GLU 445.A OE2 no hydrogen 3.187 N/A ARG 10.A N ILE 6.A O no hydrogen 3.046 N/A ARG 10.A NH1 ASP 426.A OD2 no hydrogen 3.313 N/A ARG 10.A NH2 ASP 426.A OD1 no hydrogen 2.526 N/A ARG 10.A NH2 ASP 426.A OD2 no hydrogen 2.894 N/A SER 14.A OG ASP 420.A OD2 no hydrogen 2.805 N/A GLU 16.A N ASP 420.A OD2 no hydrogen 2.956 N/A ASP 18.A N TYR 25.A OH no hydrogen 2.913 N/A SER 20.A N ASP 18.A OD1 no hydrogen 2.888 N/A THR 21.A OG1 SER 23.A OG no hydrogen 2.797 N/A THR 21.A OG1 ASP 67.A OD1 no hydrogen 3.248 N/A THR 21.A OG1 ASP 67.A OD2 no hydrogen 2.431 N/A LEU 22.A N ASP 67.A OD1 no hydrogen 2.800 N/A SER 23.A N THR 21.A OG1 no hydrogen 2.962 N/A SER 23.A OG THR 21.A OG1 no hydrogen 2.797 N/A ASN 24.A N HIS 65.A O no hydrogen 3.192 N/A ASN 24.A ND2 GLU 63.A O no hydrogen 2.891 N/A LYS 26.A NZ PRO 15.A O no hydrogen 3.187 N/A ASP 27.A N ASN 24.A O no hydrogen 3.059 N/A PHE 28.A N TYR 25.A O no hydrogen 3.330 N/A ALA 29.A N LYS 55.A O no hydrogen 2.751 N/A LEU 31.A N GLN 53.A O no hydrogen 2.908 N/A HIS 32.A ND1 THR 163.A OG1 no hydrogen 2.773 N/A HIS 32.A NE2 THR 165.A OG1 no hydrogen 2.948 N/A THR 33.A N THR 163.A O no hydrogen 2.974 N/A THR 33.A OG1 SER 162.A OG no hydrogen 2.958 N/A ASP 34.A N THR 51.A O no hydrogen 2.722 N/A LEU 35.A N THR 165.A O no hydrogen 2.932 N/A ASN 36.A N SER 49.A O no hydrogen 2.889 N/A LEU 37.A N SER 167.A O no hydrogen 2.828 N/A SER 38.A N SER 47.A O no hydrogen 2.843 N/A SER 38.A OG GLU 169.A OE1 no hydrogen 3.545 N/A VAL 39.A N GLU 169.A O no hydrogen 2.848 N/A SER 40.A N ALA 45.A O no hydrogen 2.933 N/A LYS 43.A N SER 40.A OG no hydrogen 3.114 N/A LYS 43.A NZ GLU 42.A OE2 no hydrogen 3.434 N/A SER 44.A N PHE 41.A O no hydrogen 3.386 N/A ALA 45.A N SER 40.A O no hydrogen 3.109 N/A ILE 46.A N THR 117.A OG1 no hydrogen 2.826 N/A SER 47.A N SER 38.A O no hydrogen 3.090 N/A GLY 48.A N PHE 115.A O no hydrogen 2.957 N/A SER 49.A N ASN 36.A O no hydrogen 2.906 N/A VAL 50.A N ILE 113.A O no hydrogen 3.008 N/A THR 51.A N ASP 34.A O no hydrogen 2.797 N/A PHE 52.A N LEU 111.A O no hydrogen 2.814 N/A GLN 53.A N HIS 32.A O no hydrogen 2.878 N/A LEU 54.A N PHE 109.A O no hydrogen 2.866 N/A LYS 55.A N ALA 29.A O no hydrogen 2.903 N/A LYS 56.A N ASP 107.A O no hydrogen 2.851 N/A LYS 56.A NZ SER 104.A O no hydrogen 3.415 N/A LYS 56.A NZ SER 104.A OG no hydrogen 3.402 N/A LEU 57.A N ASP 27.A O no hydrogen 2.883 N/A LEU 64.A N ILE 100.A O no hydrogen 2.748 N/A HIS 65.A N ASN 24.A OD1 no hydrogen 2.922 N/A HIS 65.A NE2 GLU 63.A OE2 no hydrogen 3.016 N/A LEU 66.A N LEU 98.A O no hydrogen 2.831 N/A ASP 67.A N CYS 154.A O no hydrogen 2.968 N/A THR 68.A N SER 96.A O no hydrogen 3.250 N/A THR 68.A OG1 SER 96.A O no hydrogen 2.687 N/A SER 69.A N ARG 149.A O no hydrogen 2.813 N/A ASP 72.A N ARG 116.A O no hydrogen 2.987 N/A GLN 74.A N GLN 114.A O no hydrogen 2.856 N/A GLU 75.A N GLN 114.A O no hydrogen 3.418 N/A HIS 77.A N ASN 112.A O no hydrogen 2.833 N/A ILE 78.A N SER 81.A O no hydrogen 2.804 N/A ASP 79.A N THR 110.A O no hydrogen 3.042 N/A SER 81.A N ILE 78.A O no hydrogen 2.982 N/A LYS 82.A NZ VAL 76.A O no hydrogen 3.317 N/A ALA 83.A N VAL 76.A O no hydrogen 2.846 N/A GLN 86.A N VAL 99.A O no hydrogen 2.851 N/A GLU 88.A N ARG 97.A O no hydrogen 2.832 N/A ARG 90.A NE GLU 92.A OE1 no hydrogen 3.410 N/A ARG 90.A NE GLU 92.A OE2 no hydrogen 2.585 N/A ARG 90.A NH1 SER 69.A OG no hydrogen 2.948 N/A ARG 90.A NH2 GLU 92.A OE1 no hydrogen 3.166 N/A LYS 91.A N GLY 95.A O no hydrogen 2.866 N/A LYS 91.A NZ ASP 370.A O no hydrogen 3.315 N/A GLY 95.A N LYS 91.A O no hydrogen 2.861 N/A SER 96.A N THR 68.A O no hydrogen 2.831 N/A ARG 97.A NE LEU 22.A O no hydrogen 2.875 N/A ARG 97.A NH1 GLU 88.A OE1 no hydrogen 2.919 N/A ARG 97.A NH2 LEU 22.A O no hydrogen 3.533 N/A LEU 98.A N LEU 66.A O no hydrogen 2.787 N/A VAL 99.A N GLN 86.A O no hydrogen 2.818 N/A ILE 100.A N LEU 64.A O no hydrogen 2.762 N/A ASN 101.A N ASP 84.A O no hydrogen 2.973 N/A PHE 109.A N LEU 54.A O no hydrogen 3.013 N/A THR 110.A N ASP 79.A OD1 no hydrogen 3.101 N/A THR 110.A OG1 GLN 53.A OE1 no hydrogen 2.733 N/A LEU 111.A N PHE 52.A O no hydrogen 2.829 N/A ASN 112.A N HIS 77.A O no hydrogen 2.822 N/A ASN 112.A ND2 SER 49.A OG no hydrogen 3.300 N/A ASN 112.A ND2 THR 51.A OG1 no hydrogen 2.737 N/A ILE 113.A N VAL 50.A O no hydrogen 2.968 N/A GLN 114.A N GLU 75.A O no hydrogen 2.894 N/A PHE 115.A N GLY 48.A O no hydrogen 2.877 N/A ARG 116.A N ASP 72.A O no hydrogen 3.024 N/A THR 117.A N ILE 46.A O no hydrogen 2.821 N/A THR 117.A OG1 ILE 46.A O no hydrogen 3.337 N/A THR 118.A OG1 TYR 70.A O no hydrogen 2.799 N/A LYS 120.A N THR 118.A OG1 no hydrogen 3.232 N/A CYS 121.A N THR 118.A O no hydrogen 3.015 N/A CYS 121.A SG SER 150.A O no hydrogen 3.348 N/A THR 122.A N SER 150.A OG no hydrogen 2.907 N/A THR 122.A OG1 HIS 147.A ND1 no hydrogen 2.759 N/A GLN 125.A N PHE 140.A O no hydrogen 3.024 N/A GLN 125.A NE2 THR 610.A O no hydrogen 3.656 N/A LEU 127.A N TYR 138.A O no hydrogen 2.673 N/A SER 129.A OG GLY 135.A O no hydrogen 3.511 N/A LYS 130.A N ASN 128.A OD1 no hydrogen 3.148 N/A GLN 131.A N ASN 128.A O no hydrogen 2.893 N/A THR 132.A OG1 LYS 136.A O no hydrogen 2.596 N/A LYS 133.A NZ ASP 262.A OD2 no hydrogen 3.385 N/A GLY 135.A N THR 132.A O no hydrogen 3.302 N/A GLY 135.A N THR 132.A OG1 no hydrogen 3.122 N/A TYR 138.A N LEU 127.A O no hydrogen 2.814 N/A TYR 138.A OH ASN 260.A OD1 no hydrogen 2.622 N/A VAL 139.A N SER 204.A O no hydrogen 2.938 N/A PHE 140.A N GLN 125.A O no hydrogen 3.176 N/A SER 141.A N ILE 202.A O no hydrogen 3.021 N/A SER 141.A OG ILE 202.A O no hydrogen 3.425 N/A GLN 142.A N ALA 123.A O no hydrogen 3.016 N/A GLN 142.A NE2 GLU 144.A O no hydrogen 3.416 N/A HIS 147.A N LEU 143.A O no hydrogen 2.804 N/A HIS 147.A ND1 THR 122.A OG1 no hydrogen 2.759 N/A ARG 149.A N ASP 156.A OD2 no hydrogen 3.088 N/A ARG 149.A NE ASP 156.A OD2 no hydrogen 2.838 N/A ARG 149.A NH1 SER 20.A O no hydrogen 3.029 N/A ARG 149.A NH1 LEU 94.A O no hydrogen 2.848 N/A ARG 149.A NH2 SER 20.A O no hydrogen 3.016 N/A ARG 149.A NH2 ASP 156.A O no hydrogen 2.944 N/A SER 150.A N HIS 147.A O no hydrogen 2.810 N/A SER 150.A OG SER 69.A O no hydrogen 3.039 N/A SER 150.A OG THR 122.A OG1 no hydrogen 3.348 N/A LEU 151.A N ALA 148.A O no hydrogen 2.864 N/A PHE 152.A N ALA 148.A O no hydrogen 2.950 N/A CYS 154.A N ASP 67.A O no hydrogen 3.339 N/A CYS 154.A SG PHE 152.A O no hydrogen 3.451 N/A ASP 156.A N ASP 67.A OD2 no hydrogen 2.918 N/A THR 157.A N PHE 155.A O no hydrogen 2.854 N/A THR 157.A OG1 ASP 18.A OD2 no hydrogen 2.544 N/A SER 159.A N THR 157.A OG1 no hydrogen 3.105 N/A SER 159.A OG CYS 308.A O no hydrogen 2.610 N/A VAL 160.A N THR 157.A O no hydrogen 3.080 N/A LYS 161.A NZ ASN 303.A O no hydrogen 3.414 N/A LYS 161.A NZ LEU 304.A O no hydrogen 2.985 N/A LYS 161.A NZ THR 306.A OG1 no hydrogen 2.758 N/A LYS 161.A NZ LYS 417.A O no hydrogen 2.971 N/A SER 162.A N ILE 195.A O no hydrogen 2.929 N/A SER 162.A OG THR 33.A OG1 no hydrogen 2.958 N/A SER 162.A OG THR 163.A O no hydrogen 2.749 N/A THR 163.A OG1 LEU 31.A O no hydrogen 3.507 N/A THR 163.A OG1 HIS 32.A ND1 no hydrogen 2.773 N/A PHE 164.A N GLN 191.A O no hydrogen 3.099 N/A THR 165.A N THR 33.A O no hydrogen 3.035 N/A THR 165.A OG1 HIS 32.A NE2 no hydrogen 2.948 N/A THR 165.A OG1 ASP 34.A OD1 no hydrogen 2.678 N/A ALA 166.A N PHE 189.A O no hydrogen 3.104 N/A SER 167.A N LEU 35.A O no hydrogen 2.846 N/A ILE 168.A N TYR 187.A O no hydrogen 2.799 N/A GLU 169.A N LEU 37.A O no hydrogen 2.875 N/A SER 170.A N ASN 185.A O no hydrogen 2.971 N/A SER 170.A OG LEU 172.A O no hydrogen 3.104 N/A SER 170.A OG SER 204.A OG no hydrogen 2.851 N/A LEU 172.A N SER 170.A OG no hydrogen 3.246 N/A VAL 175.A N ALA 203.A O no hydrogen 2.925 N/A SER 177.A N GLY 201.A O no hydrogen 3.059 N/A GLY 178.A N PHE 176.A O no hydrogen 2.806 N/A ILE 179.A N GLU 190.A O no hydrogen 2.778 N/A ILE 181.A N ARG 188.A O no hydrogen 2.904 N/A THR 184.A OG1 ILE 186.A O no hydrogen 3.505 N/A ILE 186.A N THR 184.A OG1 no hydrogen 3.120 N/A TYR 187.A N ILE 168.A O no hydrogen 2.854 N/A PHE 189.A N ALA 166.A O no hydrogen 2.873 N/A GLU 190.A N ILE 179.A O no hydrogen 2.846 N/A GLN 191.A N PHE 164.A O no hydrogen 2.811 N/A GLN 191.A NE2 SER 177.A O no hydrogen 3.203 N/A GLN 191.A NE2 ASN 273.A OD1 no hydrogen 2.881 N/A VAL 193.A N GLN 191.A OE1 no hydrogen 3.183 N/A ILE 195.A N SER 162.A O no hydrogen 2.884 N/A LEU 199.A N PRO 196.A O no hydrogen 3.169 N/A ILE 200.A N ALA 197.A O no hydrogen 3.061 N/A GLY 201.A N SER 177.A OG no hydrogen 2.993 N/A ILE 202.A N SER 141.A OG no hydrogen 3.066 N/A ALA 203.A N VAL 175.A O no hydrogen 3.027 N/A SER 204.A N VAL 139.A O no hydrogen 2.924 N/A SER 204.A OG SER 170.A OG no hydrogen 2.851 N/A SER 204.A OG LEU 172.A O no hydrogen 3.186 N/A SER 204.A OG PRO 173.A O no hydrogen 2.805 N/A GLY 205.A N PRO 173.A O no hydrogen 3.092 N/A SER 208.A N THR 220.A O no hydrogen 2.945 N/A ALA 210.A N VAL 218.A O no hydrogen 2.980 N/A ILE 212.A N SER 216.A O no hydrogen 2.863 N/A GLY 213.A N SER 216.A O no hydrogen 3.275 N/A ARG 215.A NE GLU 237.A OE1 no hydrogen 3.224 N/A ARG 215.A NE GLU 237.A OE2 no hydrogen 3.383 N/A ARG 215.A NH1 GLU 244.A OE2 no hydrogen 3.131 N/A ARG 215.A NH2 GLU 237.A OE2 no hydrogen 3.122 N/A ARG 215.A NH2 GLU 244.A OE1 no hydrogen 2.820 N/A SER 216.A N GLY 213.A O no hydrogen 3.271 N/A SER 216.A OG TYR 255.A O no hydrogen 2.775 N/A THR 217.A N ASP 256.A OD1 no hydrogen 2.889 N/A VAL 218.A N ALA 210.A O no hydrogen 2.828 N/A TYR 219.A N ILE 257.A O no hydrogen 2.802 N/A THR 220.A N SER 208.A O no hydrogen 3.069 N/A THR 220.A OG1 VAL 259.A O no hydrogen 2.989 N/A ARG 224.A N GLU 221.A O no hydrogen 2.887 N/A ARG 224.A NH1 ASP 262.A OD1 no hydrogen 3.220 N/A LEU 225.A N PRO 222.A O no hydrogen 3.069 N/A LYS 226.A NZ GLN 229.A OE1 no hydrogen 2.984 N/A CYS 228.A N ARG 224.A O no hydrogen 3.017 N/A CYS 228.A SG ARG 224.A O no hydrogen 3.351 N/A GLN 229.A N LEU 225.A O no hydrogen 2.956 N/A GLN 229.A NE2 PRO 211.A O no hydrogen 2.965 N/A TRP 230.A N LYS 226.A O no hydrogen 3.053 N/A GLU 231.A N ASP 227.A O no hydrogen 3.114 N/A PHE 232.A N CYS 228.A O no hydrogen 3.239 N/A PHE 232.A N GLN 229.A O no hydrogen 3.361 N/A GLU 233.A N GLN 229.A O no hydrogen 2.912 N/A ASN 234.A ND2 ASP 235.A OD2 no hydrogen 2.876 N/A ASP 235.A N PHE 232.A O no hydrogen 3.184 N/A VAL 236.A N PHE 232.A O no hydrogen 3.091 N/A LYS 238.A NZ ASP 235.A OD1 no hydrogen 3.080 N/A PHE 239.A N ASP 235.A O no hydrogen 3.015 N/A ILE 240.A N VAL 236.A O no hydrogen 3.007 N/A GLN 241.A N GLU 237.A O no hydrogen 2.963 N/A GLN 241.A NE2 GLU 237.A OE2 no hydrogen 2.850 N/A THR 242.A N LYS 238.A O no hydrogen 2.927 N/A THR 242.A OG1 LYS 238.A O no hydrogen 2.788 N/A ALA 243.A N PHE 239.A O no hydrogen 2.969 N/A GLU 244.A N ILE 240.A O no hydrogen 2.945 N/A LYS 245.A N GLN 241.A O no hydrogen 3.153 N/A ILE 246.A N THR 242.A O no hydrogen 3.209 N/A ILE 247.A N ALA 243.A O no hydrogen 2.865 N/A TYR 250.A N GLU 244.A OE2 no hydrogen 2.857 N/A TYR 250.A OH THR 254.A O no hydrogen 2.653 N/A TYR 255.A N ARG 215.A O no hydrogen 2.944 N/A TYR 255.A OH THR 275.A OG1 no hydrogen 2.822 N/A ILE 257.A N THR 217.A O no hydrogen 3.060 N/A LEU 258.A N THR 275.A O no hydrogen 2.692 N/A VAL 259.A N TYR 219.A O no hydrogen 2.819 N/A ASN 260.A N ALA 277.A O no hydrogen 2.768 N/A SER 263.A OG GLN 125.A OE1 no hydrogen 2.880 N/A TYR 264.A N VAL 261.A O no hydrogen 3.061 N/A MET 269.A N PHE 276.A O no hydrogen 2.814 N/A GLU 270.A N GLU 270.A OE1 no hydrogen 2.805 N/A SER 271.A OG LEU 199.A O no hydrogen 3.113 N/A ASN 273.A ND2 TRP 252.A O no hydrogen 2.801 N/A ASN 273.A ND2 THR 254.A O no hydrogen 2.940 N/A ASN 273.A ND2 THR 254.A OG1 no hydrogen 3.236 N/A MET 274.A N SER 271.A O no hydrogen 2.987 N/A THR 275.A N ASP 256.A O no hydrogen 3.038 N/A THR 275.A OG1 TYR 255.A OH no hydrogen 2.822 N/A PHE 276.A N MET 269.A O no hydrogen 2.822 N/A ALA 277.A N LEU 258.A O no hydrogen 2.729 N/A THR 278.A N GLY 267.A O no hydrogen 3.119 N/A THR 278.A OG1 THR 280.A OG1 no hydrogen 2.785 N/A THR 280.A N THR 278.A OG1 no hydrogen 3.220 N/A THR 280.A OG1 THR 278.A OG1 no hydrogen 2.785 N/A LEU 281.A N THR 278.A O no hydrogen 3.045 N/A LEU 282.A N PRO 279.A O no hydrogen 2.946 N/A ALA 283.A N GLU 231.A OE2 no hydrogen 3.065 N/A HIS 284.A N GLU 231.A OE1 no hydrogen 2.925 N/A ARG 286.A N GLU 231.A OE2 no hydrogen 2.885 N/A ARG 286.A NE TRP 230.A O no hydrogen 2.905 N/A ARG 286.A NH2 TRP 230.A O no hydrogen 2.675 N/A SER 287.A N ASP 285.A OD1 no hydrogen 2.926 N/A SER 287.A OG ASP 285.A OD1 no hydrogen 2.460 N/A SER 287.A OG ASP 285.A OD2 no hydrogen 2.640 N/A ASN 288.A ND2 THR 280.A O no hydrogen 3.359 N/A ASN 288.A ND2 ASN 549.A OD1 no hydrogen 3.278 N/A ILE 292.A N ILE 289.A O no hydrogen 2.609 N/A ALA 293.A N ILE 289.A O no hydrogen 3.354 N/A HIS 294.A N ASP 290.A O no hydrogen 2.823 N/A HIS 294.A ND1 GLU 324.A OE1 no hydrogen 2.736 N/A GLU 295.A N VAL 291.A O no hydrogen 3.161 N/A LEU 296.A N ILE 292.A O no hydrogen 2.876 N/A ALA 297.A N ALA 293.A O no hydrogen 2.966 N/A HIS 298.A N HIS 294.A O no hydrogen 3.269 N/A HIS 298.A ND1 SER 301.A O no hydrogen 2.923 N/A SER 299.A N LEU 296.A O no hydrogen 3.010 N/A SER 299.A OG LEU 296.A O no hydrogen 2.979 N/A TRP 300.A N ALA 297.A O no hydrogen 2.922 N/A SER 301.A N ALA 297.A O no hydrogen 3.122 N/A SER 301.A OG ALA 297.A O no hydrogen 3.294 N/A SER 301.A OG THR 320.A OG1 no hydrogen 2.831 N/A GLY 302.A N VAL 305.A O no hydrogen 2.763 N/A ASN 303.A N HIS 298.A O no hydrogen 2.952 N/A ASN 303.A ND2 GLU 270.A O no hydrogen 2.909 N/A LEU 304.A N SER 299.A O no hydrogen 3.178 N/A VAL 305.A N TRP 300.A O no hydrogen 3.086 N/A THR 306.A N LYS 417.A O no hydrogen 3.166 N/A THR 306.A OG1 GLY 302.A O no hydrogen 2.691 N/A ASN 307.A N ASN 316.A OD1.A no hydrogen 2.912 N/A CYS 308.A N LEU 419.A O no hydrogen 2.817 N/A CYS 308.A SG GLU 16.A O no hydrogen 3.627 N/A CYS 308.A SG LEU 419.A O no hydrogen 3.438 N/A ASN 311.A N SER 309.A OG no hydrogen 3.131 N/A ASN 311.A ND2 GLU 16.A OE2 no hydrogen 3.441 N/A HIS 312.A N SER 309.A O no hydrogen 3.245 N/A HIS 312.A ND1 THR 421.A OG1 no hydrogen 2.757 N/A HIS 312.A NE2 GLU 16.A OE2 no hydrogen 2.621 N/A TRP 314.A NE1 THR 421.A OG1 no hydrogen 3.027 N/A LEU 315.A N HIS 312.A O no hydrogen 3.042 N/A ASN 316.A N.A PHE 313.A O no hydrogen 3.016 N/A ASN 316.A N.B PHE 313.A O no hydrogen 2.962 N/A GLU 317.A N PHE 313.A O no hydrogen 3.104 N/A GLY 318.A N TRP 314.A O no hydrogen 2.658 N/A THR 320.A N ASN 316.A O.A no hydrogen 2.996 N/A THR 320.A N ASN 316.A O.B no hydrogen 3.241 N/A THR 320.A OG1 SER 301.A OG no hydrogen 2.831 N/A THR 320.A OG1 ASN 316.A O.A no hydrogen 2.897 N/A THR 320.A OG1 ASN 316.A O.B no hydrogen 2.645 N/A VAL 321.A N GLU 317.A O no hydrogen 2.989 N/A TYR 322.A N GLY 318.A O no hydrogen 2.984 N/A TYR 322.A OH GLU 394.A OE1 no hydrogen 2.449 N/A LEU 323.A N TRP 319.A O no hydrogen 2.667 N/A GLU 324.A N THR 320.A O no hydrogen 2.757 N/A ARG 325.A N VAL 321.A O no hydrogen 3.055 N/A ARG 325.A NE SER 340.A OG no hydrogen 2.763 N/A ARG 325.A NH1 GLU 384.A OE1 no hydrogen 2.953 N/A ARG 325.A NH2 GLU 384.A OE1 no hydrogen 3.556 N/A ARG 325.A NH2 GLU 384.A OE2 no hydrogen 2.798 N/A ARG 326.A N TYR 322.A O no hydrogen 2.966 N/A ARG 326.A NH1 TYR 322.A OH no hydrogen 3.124 N/A ARG 326.A NH1 ASP 404.A OD1 no hydrogen 2.652 N/A ARG 326.A NH2 ASP 404.A OD1 no hydrogen 3.226 N/A ARG 326.A NH2 ASP 404.A OD2 no hydrogen 2.775 N/A ILE 327.A N LEU 323.A O no hydrogen 2.972 N/A ILE 328.A N GLU 324.A O no hydrogen 3.087 N/A GLY 329.A N ARG 325.A O no hydrogen 2.949 N/A ALA 330.A N ARG 326.A O no hydrogen 2.855 N/A ILE 331.A N ILE 327.A O no hydrogen 3.090 N/A HIS 332.A N ILE 328.A O no hydrogen 2.817 N/A GLY 333.A N GLY 329.A O no hydrogen 2.705 N/A THR 336.A N GLY 333.A O no hydrogen 3.135 N/A ARG 337.A N GLY 333.A O no hydrogen 3.323 N/A ARG 337.A NE GLU 334.A OE1 no hydrogen 3.180 N/A ARG 337.A NE GLU 334.A OE2 no hydrogen 2.951 N/A ARG 337.A NH1 GLU 394.A OE1 no hydrogen 3.075 N/A ARG 337.A NH2 GLU 334.A OE1 no hydrogen 3.172 N/A ARG 337.A NH2 GLU 334.A OE2 no hydrogen 3.273 N/A ARG 337.A NH2 GLU 394.A OE2 no hydrogen 2.929 N/A HIS 338.A N GLU 334.A O no hydrogen 2.881 N/A PHE 339.A N PRO 335.A O no hydrogen 2.894 N/A SER 340.A N THR 336.A O no hydrogen 3.049 N/A ALA 341.A N ARG 337.A O no hydrogen 3.093 N/A LEU 342.A N HIS 338.A O no hydrogen 2.947 N/A ILE 343.A N PHE 339.A O no hydrogen 3.081 N/A GLY 344.A N SER 340.A O no hydrogen 3.002 N/A TRP 345.A N ALA 341.A O no hydrogen 2.810 N/A SER 346.A N LEU 342.A O no hydrogen 3.318 N/A SER 346.A OG ILE 343.A O no hydrogen 2.988 N/A ASP 347.A N ILE 343.A O no hydrogen 2.970 N/A LEU 348.A N GLY 344.A O no hydrogen 2.838 N/A GLN 349.A N TRP 345.A O no hydrogen 3.009 N/A GLN 349.A NE2 GLN 349.A O no hydrogen 3.463 N/A GLN 349.A NE2 ASP 353.A OD1 no hydrogen 2.799 N/A GLN 349.A NE2 ASP 353.A OD2 no hydrogen 3.351 N/A ASN 350.A N SER 346.A O no hydrogen 3.026 N/A SER 351.A N ASP 347.A O no hydrogen 2.972 N/A ILE 352.A N LEU 348.A O no hydrogen 2.972 N/A ASP 353.A N GLN 349.A O no hydrogen 2.842 N/A SER 354.A N ASN 350.A O no hydrogen 2.878 N/A SER 354.A OG SER 351.A O no hydrogen 3.292 N/A MET 355.A N ILE 352.A O no hydrogen 3.134 N/A ARG 360.A N ASP 357.A O no hydrogen 3.073 N/A ARG 360.A NH1 ASN 367.A O no hydrogen 3.043 N/A ARG 360.A NH1 THR 372.A OG1 no hydrogen 3.174 N/A PHE 361.A N ASP 357.A O no hydrogen 2.883 N/A SER 362.A N PRO 358.A O no hydrogen 2.987 N/A SER 362.A OG PRO 358.A O no hydrogen 2.636 N/A THR 363.A OG1 ARG 360.A O no hydrogen 3.235 N/A THR 363.A OG1 VAL 365.A O no hydrogen 2.814 N/A THR 363.A OG1 GLN 366.A OE1 no hydrogen 3.036 N/A VAL 365.A N LEU 448.A O no hydrogen 3.010 N/A GLN 366.A N ASN 311.A O no hydrogen 2.923 N/A LEU 368.A N ASN 311.A OD1 no hydrogen 2.781 N/A ASN 369.A N THR 372.A OG1 no hydrogen 3.281 N/A THR 372.A OG1 ASN 371.A OD1 no hydrogen 3.197 N/A ASP 375.A N ASP 373.A OD1 no hydrogen 2.884 N/A ASP 376.A N ASP 373.A O no hydrogen 2.845 N/A ALA 377.A N PRO 374.A O no hydrogen 3.062 N/A PHE 378.A N ASP 375.A O no hydrogen 2.782 N/A THR 380.A N SER 351.A OG no hydrogen 3.415 N/A VAL 381.A N SER 379.A OG no hydrogen 2.979 N/A GLU 384.A N THR 380.A O no hydrogen 2.887 N/A LYS 385.A N VAL 381.A O no hydrogen 2.854 N/A LYS 385.A NZ SER 362.A O no hydrogen 2.884 N/A LYS 385.A NZ GLY 452.A O no hydrogen 2.816 N/A GLY 386.A N VAL 381.A O no hydrogen 3.350 N/A PHE 387.A N TYR 383.A O no hydrogen 2.873 N/A ASN 388.A N GLU 384.A O no hydrogen 2.884 N/A ASN 388.A ND2 GLU 384.A O no hydrogen 2.814 N/A LEU 389.A N LYS 385.A O no hydrogen 2.952 N/A LEU 390.A N GLY 386.A O no hydrogen 3.214 N/A PHE 391.A N PHE 387.A O no hydrogen 2.851 N/A HIS 392.A N ASN 388.A O no hydrogen 3.005 N/A LEU 393.A N LEU 389.A O no hydrogen 3.019 N/A GLU 394.A N LEU 390.A O no hydrogen 2.864 N/A THR 395.A N PHE 391.A O no hydrogen 3.060 N/A THR 395.A OG1 PHE 391.A O no hydrogen 2.875 N/A ILE 396.A N HIS 392.A O no hydrogen 2.931 N/A LEU 397.A N LEU 393.A O no hydrogen 3.037 N/A GLY 398.A N THR 395.A O no hydrogen 3.121 N/A GLY 399.A N GLU 394.A O no hydrogen 2.773 N/A LYS 400.A NZ GLU 334.A OE1 no hydrogen 2.850 N/A PHE 403.A N GLY 399.A O no hydrogen 3.056 N/A PHE 403.A N LYS 400.A O no hydrogen 3.183 N/A ASP 404.A N LYS 400.A O no hydrogen 2.868 N/A ILE 407.A N PHE 403.A O no hydrogen 3.051 N/A ARG 408.A N ASP 404.A O no hydrogen 3.051 N/A ARG 408.A NE ILE 246.A O no hydrogen 3.032 N/A ARG 408.A NE ILE 247.A O no hydrogen 3.334 N/A ARG 408.A NH1 LYS 245.A O no hydrogen 3.181 N/A ARG 408.A NH1 ILE 246.A O no hydrogen 3.064 N/A HIS 409.A N PRO 405.A O no hydrogen 3.052 N/A TYR 410.A N PHE 406.A O no hydrogen 2.749 N/A PHE 411.A N ILE 407.A O no hydrogen 3.050 N/A LYS 412.A N ARG 408.A O no hydrogen 3.060 N/A LYS 413.A N HIS 409.A O no hydrogen 2.818 N/A LYS 413.A NZ THR 427.A OG1 no hydrogen 2.681 N/A LYS 413.A NZ GLU 430.A OE1 no hydrogen 3.350 N/A PHE 414.A N TYR 410.A O no hydrogen 3.193 N/A ALA 415.A N LYS 412.A O no hydrogen 3.364 N/A LYS 416.A N LEU 304.A O no hydrogen 2.675 N/A LYS 417.A N PHE 414.A O no hydrogen 2.921 N/A SER 418.A OG PRO 158.A O no hydrogen 2.755 N/A LEU 419.A N THR 306.A O no hydrogen 2.880 N/A ASP 420.A N GLN 423.A OE1 no hydrogen 2.892 N/A THR 421.A N HIS 312.A ND1 no hydrogen 3.339 N/A THR 421.A OG1 HIS 312.A ND1 no hydrogen 2.757 N/A GLN 423.A N ASP 420.A OD1 no hydrogen 2.956 N/A PHE 424.A N ASP 420.A O no hydrogen 3.191 N/A LEU 425.A N THR 421.A O no hydrogen 2.913 N/A ASP 426.A N PHE 422.A O no hydrogen 2.985 N/A THR 427.A N GLN 423.A O no hydrogen 3.082 N/A THR 427.A OG1 GLN 423.A O no hydrogen 2.874 N/A LEU 428.A N PHE 424.A O no hydrogen 3.010 N/A TYR 429.A N LEU 425.A O no hydrogen 2.934 N/A TYR 429.A OH ASP 440.A OD1 no hydrogen 2.746 N/A GLU 430.A N ASP 426.A O no hydrogen 2.821 N/A PHE 431.A N THR 427.A O no hydrogen 2.983 N/A PHE 431.A N LEU 428.A O no hydrogen 3.271 N/A TYR 432.A N LEU 428.A O no hydrogen 3.250 N/A TYR 432.A OH GLU 402.A O no hydrogen 2.797 N/A LYS 435.A N TYR 432.A O no hydrogen 3.002 N/A LYS 435.A NZ GLU 402.A OE2 no hydrogen 3.175 N/A LYS 436.A NZ ASP 440.A OD2 no hydrogen 2.766 N/A LEU 439.A N LYS 435.A O no hydrogen 3.169 N/A ASP 440.A N LYS 436.A O no hydrogen 2.970 N/A SER 441.A N GLU 437.A O no hydrogen 3.145 N/A SER 441.A N ILE 438.A O no hydrogen 3.369 N/A SER 441.A OG ILE 438.A O no hydrogen 2.926 N/A VAL 442.A N LEU 439.A O no hydrogen 3.266 N/A TRP 444.A NE1 LEU 439.A O no hydrogen 2.908 N/A THR 446.A N ASP 443.A O no hydrogen 3.073 N/A THR 446.A N ASP 443.A OD1 no hydrogen 3.337 N/A THR 446.A OG1 ASP 443.A OD2 no hydrogen 2.456 N/A TRP 447.A N ASP 443.A O no hydrogen 3.142 N/A LEU 448.A N TRP 444.A O no hydrogen 2.895 N/A TYR 449.A N GLU 445.A O no hydrogen 3.097 N/A LYS 450.A N THR 446.A O no hydrogen 3.255 N/A GLY 452.A N SER 362.A OG no hydrogen 2.801 N/A ILE 460.A N HIS 338.A ND1 no hydrogen 2.881 N/A THR 461.A OG1 ASP 465.A OD1 no hydrogen 2.927 N/A THR 461.A OG1 ASP 465.A OD2 no hydrogen 3.073 N/A ALA 464.A N THR 461.A O no hydrogen 2.972 N/A ASP 465.A N THR 461.A O no hydrogen 3.094 N/A ASP 465.A N ALA 462.A O no hydrogen 3.444 N/A TYR 468.A N ALA 464.A O no hydrogen 2.813 N/A GLN 469.A N ASP 465.A O no hydrogen 2.864 N/A LEU 470.A N ASN 466.A O no hydrogen 3.109 N/A ALA 471.A N VAL 467.A O no hydrogen 3.079 N/A ASP 472.A N TYR 468.A O no hydrogen 3.010 N/A LYS 473.A N GLN 469.A O no hydrogen 2.891 N/A LYS 473.A NZ GLU 490.A O no hydrogen 3.271 N/A TRP 474.A N LEU 470.A O no hydrogen 2.778 N/A TRP 474.A NE1 TYR 540.A OH no hydrogen 2.986 N/A VAL 475.A N ALA 471.A O no hydrogen 2.912 N/A GLU 476.A N ASP 472.A O no hydrogen 2.979 N/A MET 477.A N LYS 473.A O no hydrogen 2.925 N/A ALA 478.A N TRP 474.A O no hydrogen 3.090 N/A GLN 479.A N GLU 476.A O no hydrogen 3.112 N/A HIS 480.A N MET 477.A O no hydrogen 2.985 N/A LEU 481.A N MET 477.A O no hydrogen 2.755 N/A LYS 482.A N ASP 486.A OD2 no hydrogen 3.267 N/A THR 483.A N ASP 486.A OD2 no hydrogen 3.324 N/A ASP 486.A N THR 483.A OG1 no hydrogen 3.177 N/A PHE 487.A N THR 483.A O no hydrogen 3.228 N/A ARG 488.A N THR 484.A O no hydrogen 2.950 N/A ARG 488.A NE ASP 538.A OD2 no hydrogen 3.493 N/A SER 489.A N GLU 485.A O no hydrogen 3.250 N/A SER 489.A N ASP 486.A O no hydrogen 3.075 N/A SER 489.A OG GLU 485.A O no hydrogen 3.394 N/A GLU 490.A N ASP 486.A O no hydrogen 3.256 N/A GLU 490.A N PHE 487.A O no hydrogen 3.059 N/A PHE 491.A N PHE 487.A O no hydrogen 2.695 N/A ASN 492.A N ASP 495.A OD1 no hydrogen 3.350 N/A ASP 495.A N ASN 492.A O no hydrogen 2.747 N/A ILE 496.A N ALA 493.A O no hydrogen 3.354 N/A LYS 497.A N ILE 494.A O no hydrogen 3.292 N/A PHE 499.A N ILE 496.A O no hydrogen 2.804 N/A ASN 500.A N GLN 503.A OE1 no hydrogen 2.856 N/A GLN 503.A N ASN 500.A OD1 no hydrogen 2.583 N/A GLN 503.A NE2 LEU 463.A O no hydrogen 2.857 N/A LEU 504.A N ASN 500.A O no hydrogen 2.881 N/A VAL 505.A N SER 501.A O no hydrogen 2.790 N/A LEU 506.A N ASN 502.A O no hydrogen 2.896 N/A PHE 507.A N GLN 503.A O no hydrogen 2.708 N/A LEU 508.A N LEU 504.A O no hydrogen 2.905 N/A GLU 509.A N VAL 505.A O no hydrogen 2.869 N/A THR 510.A N LEU 506.A O no hydrogen 2.785 N/A THR 510.A OG1 LEU 506.A O no hydrogen 2.826 N/A LEU 511.A N PHE 507.A O no hydrogen 2.980 N/A THR 512.A N LEU 508.A O no hydrogen 3.355 N/A THR 512.A OG1 GLU 509.A O no hydrogen 2.788 N/A THR 512.A OG1 GLU 509.A OE1 no hydrogen 3.529 N/A GLN 513.A N GLU 509.A O no hydrogen 3.021 N/A ASN 514.A N LEU 511.A O no hydrogen 2.717 N/A GLY 515.A N THR 510.A O no hydrogen 2.804 N/A HIS 516.A N ASP 472.A OD1 no hydrogen 2.752 N/A LYS 519.A N SER 517.A O no hydrogen 2.805 N/A TRP 526.A NE1 LEU 511.A O no hydrogen 3.018 N/A LYS 528.A N ASP 525.A O no hydrogen 3.449 N/A PHE 529.A N TRP 526.A O no hydrogen 3.034 N/A SER 533.A N PHE 529.A O no hydrogen 3.014 N/A SER 533.A OG PRO 530.A O no hydrogen 3.136 N/A ARG 534.A N PRO 530.A O no hydrogen 2.784 N/A ALA 535.A N VAL 531.A O no hydrogen 2.824 N/A LEU 536.A N ALA 532.A O no hydrogen 2.804 N/A LEU 537.A N SER 533.A O no hydrogen 3.281 N/A ASP 538.A N ARG 534.A O no hydrogen 3.028 N/A ILE 539.A N ALA 535.A O no hydrogen 2.813 N/A TYR 540.A N LEU 536.A O no hydrogen 3.032 N/A TYR 540.A OH ASP 495.A OD1 no hydrogen 2.876 N/A TYR 540.A OH ASP 495.A OD2 no hydrogen 2.576 N/A GLN 541.A N ASP 538.A O no hydrogen 3.088 N/A ILE 544.A N TYR 540.A O no hydrogen 2.972 N/A LYS 546.A N GLN 541.A O no hydrogen 2.829 N/A SER 547.A N ILE 544.A O no hydrogen 3.389 N/A ASN 549.A N SER 547.A OG no hydrogen 3.011 N/A ASN 549.A ND2 ASN 288.A OD1 no hydrogen 2.947 N/A GLU 551.A N ASN 549.A OD1 no hydrogen 2.750 N/A VAL 553.A N ASN 549.A O no hydrogen 2.844 N/A PHE 554.A N ALA 550.A O no hydrogen 2.988 N/A LYS 555.A N GLU 551.A O no hydrogen 3.392 N/A LYS 555.A NZ GLU 509.A OE1 no hydrogen 3.437 N/A MET 556.A N VAL 552.A O no hydrogen 2.800 N/A PHE 557.A N VAL 553.A O no hydrogen 2.955 N/A LYS 558.A N PHE 554.A O no hydrogen 2.910 N/A LYS 558.A NZ GLU 509.A OE1 no hydrogen 3.309 N/A PHE 559.A N LYS 555.A O no hydrogen 2.707 N/A GLN 560.A N MET 556.A O no hydrogen 2.971 N/A ILE 561.A N PHE 557.A O no hydrogen 2.893 N/A PHE 562.A N LYS 558.A O no hydrogen 2.825 N/A ALA 563.A N PHE 559.A O no hydrogen 2.923 N/A LYS 564.A N ILE 561.A O no hydrogen 2.670 N/A LEU 565.A N GLN 560.A O no hydrogen 3.027 N/A GLU 567.A N GLU 567.A OE1 no hydrogen 2.709 N/A GLU 568.A N LEU 565.A O no hydrogen 3.124 N/A TYR 569.A N GLN 566.A O no hydrogen 3.214 N/A LYS 570.A NZ ASP 574.A OD1 no hydrogen 3.311 N/A LYS 570.A NZ ASP 574.A OD2 no hydrogen 2.521 N/A HIS 571.A N GLU 568.A O no hydrogen 3.038 N/A LEU 572.A N GLU 568.A O no hydrogen 3.392 N/A ALA 573.A N TYR 569.A O no hydrogen 3.149 N/A ASP 574.A N LYS 570.A O no hydrogen 3.144 N/A TRP 575.A N HIS 571.A O no hydrogen 2.861 N/A LEU 576.A N LEU 572.A O no hydrogen 3.019 N/A GLY 577.A N ASP 574.A O no hydrogen 3.010 N/A THR 578.A N TRP 575.A O no hydrogen 2.742 N/A THR 578.A OG1 TRP 575.A O no hydrogen 2.585 N/A MET 582.A N PRO 265.A O no hydrogen 2.956 N/A LYS 583.A NZ GLU 551.A OE1 no hydrogen 3.489 N/A LYS 583.A NZ GLU 551.A OE2 no hydrogen 2.690 N/A PHE 584.A N ARG 581.A O no hydrogen 2.944 N/A VAL 585.A N ARG 581.A O no hydrogen 3.030 N/A ARG 586.A N MET 582.A O no hydrogen 2.977 N/A ARG 586.A NE ASP 622.A OD2 no hydrogen 3.435 N/A GLY 588.A N PHE 584.A O no hydrogen 2.814 N/A TYR 589.A N VAL 585.A O no hydrogen 2.960 N/A TYR 589.A OH TYR 611.A OH no hydrogen 2.837 N/A ARG 590.A N ARG 586.A O no hydrogen 3.106 N/A ARG 590.A NE ASP 622.A OD2 no hydrogen 3.516 N/A ARG 590.A NH2 ASP 622.A OD1 no hydrogen 3.554 N/A LEU 591.A N PRO 587.A O no hydrogen 2.789 N/A LEU 592.A N GLY 588.A O no hydrogen 2.868 N/A ASN 593.A N TYR 589.A O no hydrogen 3.015 N/A SER 594.A N ARG 590.A O no hydrogen 3.274 N/A SER 594.A N LEU 591.A O no hydrogen 3.089 N/A SER 594.A OG LEU 591.A O no hydrogen 2.850 N/A VAL 595.A N LEU 592.A O no hydrogen 3.374 N/A ASP 596.A N LEU 592.A O no hydrogen 2.892 N/A ARG 597.A NH1 LEU 623.A O no hydrogen 3.359 N/A ARG 597.A NH2 LEU 623.A O no hydrogen 3.563 N/A ARG 598.A NH1 ARG 598.A O no hydrogen 3.085 N/A LEU 599.A N ASP 596.A O no hydrogen 3.234 N/A ALA 600.A N ASP 596.A O no hydrogen 2.900 N/A LEU 601.A N ARG 597.A O no hydrogen 2.941 N/A THR 603.A N LEU 599.A O no hydrogen 2.836 N/A THR 603.A OG1 LEU 599.A O no hydrogen 2.730 N/A PHE 604.A N ALA 600.A O no hydrogen 2.958 N/A ASP 605.A N LEU 601.A O no hydrogen 3.082 N/A LYS 606.A N ALA 602.A O no hydrogen 3.286 N/A LYS 606.A N THR 603.A O no hydrogen 2.763 N/A PHE 607.A N THR 603.A O no hydrogen 3.027 N/A LYS 608.A N PHE 604.A O no hydrogen 2.493 N/A LYS 608.A NZ ASP 605.A O no hydrogen 3.159 N/A LYS 608.A NZ ASP 605.A OD1 no hydrogen 3.409 N/A THR 610.A N PHE 607.A O no hydrogen 2.760 N/A THR 610.A OG1 PHE 607.A O no hydrogen 2.770 N/A TYR 611.A N LYS 608.A O no hydrogen 3.440 N/A TYR 611.A OH LEU 576.A O no hydrogen 2.554 N/A TYR 611.A OH TYR 589.A OH no hydrogen 2.837 N/A ILE 614.A N HIS 612.A ND1 no hydrogen 3.167 N/A CYS 615.A SG GLY 580.A O no hydrogen 3.878 N/A LYS 616.A N HIS 612.A O no hydrogen 2.815 N/A LYS 616.A NZ ASP 609.A OD1 no hydrogen 2.780 N/A ALA 617.A N PRO 613.A O no hydrogen 2.928 N/A LEU 618.A N ILE 614.A O no hydrogen 3.037 N/A VAL 619.A N CYS 615.A O no hydrogen 3.051 N/A LYS 620.A N LYS 616.A O no hydrogen 2.909 N/A GLN 621.A N ALA 617.A O no hydrogen 3.433 N/A ASP 622.A N LEU 618.A O no hydrogen 3.011 N/A LEU 623.A N VAL 619.A O no hydrogen 2.999 N/A LYS 624.A N GLN 621.A O no hydrogen 3.099 N/A