Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kom_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NH1 HIS 207.A O no hydrogen 3.040 N/A ARG 5.A NH2 HIS 207.A O no hydrogen 3.232 N/A PHE 7.A N PRO 4.A O no hydrogen 3.046 N/A SER 8.A OG.A ARG 5.A O no hydrogen 2.915 N/A SER 8.A OG.A ASP 32.A OD1 no hydrogen 2.746 N/A SER 8.A OG.B ASP 32.A OD1 no hydrogen 2.740 N/A SER 8.A OG.B THR 35.A OG1 no hydrogen 3.278 N/A ASN 9.A N ARG 5.A O no hydrogen 2.806 N/A ILE 11.A N SER 8.A O no hydrogen 3.021 N/A ARG 12.A N SER 8.A O no hydrogen 3.490 N/A ARG 12.A NH1 ASP 32.A OD1 no hydrogen 3.007 N/A ARG 12.A NH2 ASP 32.A OD1 no hydrogen 3.337 N/A ARG 12.A NH2 ASP 32.A OD2 no hydrogen 2.930 N/A PHE 13.A N ASN 9.A O no hydrogen 2.855 N/A LEU 14.A N ALA 10.A O no hydrogen 3.041 N/A SER 15.A N ILE 11.A O no hydrogen 3.018 N/A SER 15.A OG ILE 11.A O no hydrogen 2.817 N/A ILE 16.A N ARG 12.A O no hydrogen 2.866 N/A ASP 17.A N PHE 13.A O no hydrogen 2.792 N/A ALA 18.A N LEU 14.A O no hydrogen 2.966 N/A THR 19.A N SER 15.A O no hydrogen 3.138 N/A THR 19.A OG1 SER 15.A O no hydrogen 2.875 N/A THR 19.A OG1 ILE 16.A O no hydrogen 3.017 N/A LEU 20.A N ILE 16.A O no hydrogen 3.026 N/A LYS 21.A N ASP 17.A O no hydrogen 3.107 N/A LYS 21.A NZ LYS 84.A O no hydrogen 2.716 N/A ALA 22.A N ALA 18.A O no hydrogen 3.043 N/A LYS 23.A N LEU 20.A O no hydrogen 3.330 N/A SER 24.A N THR 19.A O no hydrogen 3.461 N/A HIS 26.A ND1 GLY 250.A O no hydrogen 2.622 N/A GLY 28.A N VAL 248.A O no hydrogen 3.099 N/A THR 35.A N ALA 31.A O no hydrogen 2.903 N/A THR 35.A OG1 SER 8.A OG.B no hydrogen 3.278 N/A THR 35.A OG1 ALA 31.A O no hydrogen 2.768 N/A VAL 36.A N ASP 32.A O no hydrogen 3.058 N/A LEU 37.A N ILE 33.A O no hydrogen 3.007 N/A TRP 38.A N ALA 34.A O no hydrogen 2.851 N/A THR 39.A N THR 35.A O no hydrogen 2.970 N/A THR 39.A OG1 THR 35.A O no hydrogen 2.692 N/A THR 39.A OG1 TYR 281.A OH no hydrogen 2.717 N/A LYS 40.A N VAL 36.A O no hydrogen 2.966 N/A LYS 40.A NZ LEU 1.A O no hydrogen 3.244 N/A PHE 41.A N LEU 37.A O no hydrogen 3.131 N/A LEU 42.A N LEU 37.A O no hydrogen 2.887 N/A LYS 43.A N ASP 55.A OD2 no hydrogen 2.817 N/A ASN 45.A ND2 GLU 292.A OE1 no hydrogen 2.709 N/A ASN 47.A N ASN 45.A OD1 no hydrogen 3.049 N/A ASN 47.A ND2.B ASN 45.A OD1 no hydrogen 2.819 N/A ASN 47.A ND2.B ARG 285.A O no hydrogen 2.977 N/A ASN 48.A N ASN 45.A O no hydrogen 2.861 N/A ASN 48.A ND2 GLU 292.A OE1 no hydrogen 3.274 N/A ASN 48.A ND2 GLU 292.A OE2 no hydrogen 3.104 N/A HIS 50.A N ASN 48.A OD1 no hydrogen 3.022 N/A TRP 51.A N ASN 48.A O no hydrogen 3.076 N/A ARG 54.A N TRP 51.A O no hydrogen 3.178 N/A ARG 54.A NE GLU 106.A OE2 no hydrogen 2.841 N/A ARG 54.A NH1 TRP 51.A O no hydrogen 2.929 N/A ARG 54.A NH2 GLU 106.A OE1 no hydrogen 2.855 N/A ASP 55.A N LYS 43.A O no hydrogen 2.922 N/A ARG 56.A N HIS 143.A O no hydrogen 3.118 N/A ARG 56.A NH1 ILE 52.A O no hydrogen 3.024 N/A ARG 56.A NH1 ARG 54.A O no hydrogen 2.890 N/A ARG 56.A NH2 TYR 404.A O no hydrogen 3.071 N/A VAL 58.A N TYR 145.A O no hydrogen 2.877 N/A SER 60.A N PHE 147.A O no hydrogen 2.919 N/A ASN 61.A N ASN 61.A OD1 no hydrogen 2.682 N/A SER 65.A OG.A GLY 95.A O no hydrogen 2.483 N/A SER 65.A OG.B GLY 95.A O no hydrogen 2.965 N/A LEU 67.A N SER 65.A O no hydrogen 3.033 N/A TYR 68.A N SER 65.A O no hydrogen 3.134 N/A TYR 68.A OH PRO 94.A O no hydrogen 2.719 N/A LEU 70.A N LEU 66.A O no hydrogen 3.059 N/A LEU 71.A N LEU 67.A O no hydrogen 2.952 N/A HIS 72.A N TYR 68.A O no hydrogen 2.921 N/A LEU 73.A N SER 69.A O no hydrogen 2.910 N/A THR 74.A N LEU 70.A O no hydrogen 3.071 N/A THR 74.A OG1 LEU 70.A O no hydrogen 2.873 N/A THR 74.A OG1 LEU 71.A O no hydrogen 3.545 N/A GLY 75.A N LEU 71.A O no hydrogen 3.254 N/A GLY 75.A N HIS 72.A O no hydrogen 3.161 N/A TYR 76.A N LEU 71.A O no hydrogen 2.949 N/A LEU 78.A N TYR 76.A O no hydrogen 2.773 N/A SER 79.A N ASP 82.A OD2 no hydrogen 2.966 N/A SER 79.A OG GLU 81.A OE1.A no hydrogen 3.380 N/A GLU 81.A N GLU 81.A OE1.A no hydrogen 2.925 N/A ASP 82.A N SER 79.A OG no hydrogen 2.932 N/A ILE 83.A N SER 79.A O no hydrogen 3.040 N/A LYS 84.A N ILE 80.A O no hydrogen 2.865 N/A LYS 84.A NZ GLU 81.A OE2.B no hydrogen 3.524 N/A ASN 85.A N ASP 82.A O no hydrogen 2.935 N/A PHE 86.A N ILE 83.A O no hydrogen 3.242 N/A ARG 87.A N THR 93.A O no hydrogen 2.801 N/A ARG 87.A NH1 GLY 95.A O no hydrogen 3.326 N/A ARG 87.A NH2 SER 24.A OG no hydrogen 3.031 N/A GLN 88.A N ASN 85.A O no hydrogen 3.027 N/A SER 91.A OG ASN 85.A O no hydrogen 3.507 N/A SER 91.A OG GLN 88.A O no hydrogen 3.302 N/A SER 91.A OG THR 93.A OG1 no hydrogen 3.162 N/A LYS 92.A NZ ASP 77.A O no hydrogen 2.853 N/A THR 93.A N SER 91.A OG no hydrogen 2.998 N/A THR 93.A OG1 ASP 82.A O no hydrogen 2.705 N/A THR 93.A OG1 SER 91.A OG no hydrogen 3.162 N/A TYR 99.A N THR 108.A OG1 no hydrogen 2.832 N/A THR 102.A OG1 LYS 92.A O no hydrogen 2.812 N/A VAL 105.A N THR 102.A O no hydrogen 3.368 N/A THR 109.A N PRO 97.A O no hydrogen 3.319 N/A THR 109.A OG1 LEU 59.A O no hydrogen 3.278 N/A ALA 117.A N GLY 113.A O no hydrogen 3.479 N/A ASN 118.A N GLN 114.A O no hydrogen 2.797 N/A ALA 119.A N GLY 115.A O no hydrogen 2.918 N/A VAL 120.A N VAL 116.A O no hydrogen 2.973 N/A GLY 121.A N ALA 117.A O no hydrogen 2.990 N/A LEU 123.A N VAL 120.A O no hydrogen 2.861 N/A GLY 124.A N GLY 121.A O no hydrogen 2.888 N/A LYS 126.A N ALA 122.A O no hydrogen 3.158 N/A LYS 126.A NZ.B LEU 166.A O no hydrogen 3.008 N/A LYS 126.A NZ.B GLY 167.A O no hydrogen 2.816 N/A LEU 127.A N LEU 123.A O no hydrogen 2.871 N/A LEU 128.A N GLY 124.A O no hydrogen 2.864 N/A SER 129.A N GLU 125.A O no hydrogen 2.918 N/A SER 129.A OG GLU 125.A O no hydrogen 2.858 N/A SER 129.A OG LYS 126.A O no hydrogen 2.937 N/A ASP 130.A N LYS 126.A O no hydrogen 3.036 N/A ARG 131.A N LEU 127.A O no hydrogen 3.017 N/A ARG 131.A NH1.A GLY 406.A O no hydrogen 3.127 N/A ARG 131.A NH2.A TYR 132.A OH no hydrogen 2.923 N/A ARG 131.A NH2.A GLY 406.A O no hydrogen 3.041 N/A ARG 131.A NH2.B ALA 384.A O no hydrogen 2.229 N/A TYR 132.A N LEU 128.A O no hydrogen 2.968 N/A TYR 132.A OH GLU 310.A OE2 no hydrogen 2.624 N/A ASN 133.A N SER 129.A O no hydrogen 2.844 N/A THR 134.A N LEU 137.A O no hydrogen 2.973 N/A ASP 136.A N THR 134.A OG1 no hydrogen 3.234 N/A LEU 137.A N THR 134.A O no hydrogen 3.098 N/A HIS 142.A N GLU 125.A OE2 no hydrogen 3.073 N/A HIS 142.A ND1 HIS 143.A O no hydrogen 3.021 N/A HIS 142.A NE2 TYR 404.A OH no hydrogen 2.722 N/A HIS 143.A N ASP 55.A OD1 no hydrogen 2.912 N/A THR 144.A N LYS 170.A O no hydrogen 3.011 N/A TYR 145.A N ARG 56.A O no hydrogen 2.817 N/A TYR 145.A OH HIS 220.A NE2 no hydrogen 2.721 N/A VAL 146.A N VAL 172.A O no hydrogen 3.064 N/A PHE 147.A N VAL 58.A O no hydrogen 2.960 N/A LEU 148.A N PHE 174.A O no hydrogen 2.904 N/A SER 156.A N GLU 153.A O no hydrogen 3.036 N/A SER 156.A OG LEU 152.A O no hydrogen 3.252 N/A SER 156.A OG GLU 153.A O no hydrogen 2.785 N/A GLU 158.A N GLY 154.A O no hydrogen 3.163 N/A ALA 159.A N VAL 155.A O no hydrogen 2.940 N/A CYS 160.A N SER 156.A O no hydrogen 2.896 N/A SER 161.A N HIS 157.A O no hydrogen 3.014 N/A LEU 162.A N GLU 158.A O no hydrogen 3.181 N/A ALA 163.A N ALA 159.A O no hydrogen 2.893 N/A GLY 164.A N CYS 160.A O no hydrogen 3.089 N/A THR 165.A N SER 161.A O no hydrogen 3.136 N/A THR 165.A OG1 SER 161.A O no hydrogen 3.266 N/A LEU 166.A N LEU 162.A O no hydrogen 2.974 N/A GLY 167.A N GLY 164.A O no hydrogen 3.251 N/A LEU 168.A N ALA 163.A O no hydrogen 3.439 N/A ASN 169.A ND2 GLY 167.A O no hydrogen 3.622 N/A LYS 170.A NZ GLU 125.A OE2 no hydrogen 2.811 N/A LYS 170.A NZ ASP 141.A OD1 no hydrogen 2.896 N/A LEU 171.A N LEU 168.A O no hydrogen 3.097 N/A VAL 172.A N THR 144.A O no hydrogen 2.913 N/A ALA 173.A N THR 227.A O no hydrogen 2.801 N/A PHE 174.A N VAL 146.A O no hydrogen 2.849 N/A TRP 175.A N ILE 229.A O no hydrogen 2.900 N/A TRP 175.A NE1 ASP 150.A OD1 no hydrogen 2.863 N/A ASP 176.A N LEU 148.A O no hydrogen 2.960 N/A ASP 177.A N CYS 231.A O no hydrogen 2.881 N/A ASN 179.A ND2 ASP 150.A OD2 no hydrogen 3.125 N/A ASN 179.A ND2 ASN 178.A OD1 no hydrogen 2.861 N/A THR 181.A N ASN 179.A OD1 no hydrogen 3.483 N/A GLY 183.A N ASP 180.A O no hydrogen 3.185 N/A TRP 184.A N THR 181.A O no hydrogen 2.938 N/A PHE 185.A N THR 181.A O no hydrogen 2.494 N/A GLU 191.A N ASN 188.A OD1 no hydrogen 3.061 N/A ARG 192.A N ASN 188.A O no hydrogen 3.006 N/A ARG 192.A NE TYR 196.A OH no hydrogen 2.854 N/A ARG 192.A NH1 LEU 152.A O no hydrogen 2.896 N/A ARG 192.A NH2 SER 156.A OG no hydrogen 2.992 N/A ARG 192.A NH2 TYR 196.A OH no hydrogen 3.144 N/A PHE 193.A N THR 189.A O no hydrogen 2.916 N/A ARG 194.A N PRO 190.A O no hydrogen 2.971 N/A ARG 194.A NH1 GLU 202.A OE2 no hydrogen 3.001 N/A ARG 194.A NH2 VAL 200.A O no hydrogen 3.171 N/A ARG 194.A NH2 GLU 202.A OE2 no hydrogen 2.851 N/A ALA 195.A N GLU 191.A O no hydrogen 3.028 N/A TYR 196.A N ARG 192.A O no hydrogen 3.260 N/A TYR 196.A N PHE 193.A O no hydrogen 3.044 N/A GLY 197.A N ARG 194.A O no hydrogen 2.856 N/A TRP 198.A N PHE 193.A O no hydrogen 3.084 N/A TRP 198.A NE1 CYS 160.A O no hydrogen 2.889 N/A HIS 199.A N PRO 226.A O no hydrogen 2.838 N/A HIS 199.A NE2 GLU 218.A OE2 no hydrogen 2.757 N/A ILE 201.A N LEU 228.A O no hydrogen 2.880 N/A VAL 204.A N CYS 230.A O no hydrogen 3.071 N/A GLY 206.A N LYS 232.A O no hydrogen 2.894 N/A HIS 207.A N ASP 205.A OD1 no hydrogen 2.923 N/A HIS 207.A ND1 ASP 32.A OD2 no hydrogen 2.880 N/A ASP 208.A N ASP 205.A O no hydrogen 3.132 N/A ALA 211.A N ASP 208.A OD1 no hydrogen 3.180 N/A ILE 212.A N ASP 208.A O no hydrogen 3.046 N/A GLU 213.A N PHE 209.A O no hydrogen 3.074 N/A LYS 214.A N VAL 210.A O no hydrogen 3.026 N/A ALA 215.A N ALA 211.A O no hydrogen 3.101 N/A ILE 216.A N ILE 212.A O no hydrogen 3.006 N/A ASN 217.A N GLU 213.A O no hydrogen 2.982 N/A GLU 218.A N LYS 214.A O no hydrogen 2.970 N/A ALA 219.A N ALA 215.A O no hydrogen 2.875 N/A HIS 220.A N ILE 216.A O no hydrogen 2.857 N/A HIS 220.A NE2 TYR 145.A OH no hydrogen 2.721 N/A SER 221.A N ASN 217.A O no hydrogen 3.213 N/A SER 221.A N GLU 218.A O no hydrogen 3.097 N/A SER 221.A OG GLU 218.A O no hydrogen 2.802 N/A GLN 222.A N ALA 219.A O no hydrogen 3.143 N/A GLN 222.A NE2 GLU 218.A O no hydrogen 3.209 N/A GLN 223.A NE2 SER 221.A O no hydrogen 3.159 N/A THR 227.A N LEU 171.A O no hydrogen 3.032 N/A LEU 228.A N HIS 199.A O no hydrogen 2.888 N/A ILE 229.A N ALA 173.A O no hydrogen 2.739 N/A CYS 230.A N ILE 201.A O no hydrogen 2.907 N/A CYS 231.A N TRP 175.A O no hydrogen 2.945 N/A CYS 231.A SG ILE 229.A O no hydrogen 3.709 N/A LYS 232.A N VAL 204.A O no hydrogen 2.854 N/A LYS 232.A NZ ASP 177.A OD2 no hydrogen 2.909 N/A THR 233.A N ASP 177.A O no hydrogen 3.121 N/A THR 233.A OG1 ASP 176.A OD1 no hydrogen 2.515 N/A VAL 234.A N HIS 207.A NE2 no hydrogen 2.928 N/A GLY 236.A N GLY 28.A O no hydrogen 3.123 N/A PHE 237.A N VAL 234.A O no hydrogen 3.121 N/A SER 239.A N GLY 236.A O no hydrogen 3.080 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 3.050 N/A LYS 242.A N SER 239.A OG no hydrogen 2.907 N/A ALA 243.A N SER 239.A O no hydrogen 2.856 N/A GLY 244.A N ILE 235.A O no hydrogen 2.661 N/A THR 245.A N LYS 242.A O no hydrogen 3.308 N/A THR 245.A OG1 LYS 242.A O no hydrogen 2.922 N/A THR 245.A OG1 SER 247.A OG no hydrogen 2.998 N/A SER 247.A OG THR 245.A OG1 no hydrogen 2.998 N/A GLY 250.A N SER 247.A O no hydrogen 2.911 N/A SER 254.A N GLU 257.A OE1 no hydrogen 3.015 N/A SER 254.A OG GLN 256.A OE1 no hydrogen 3.328 N/A GLU 257.A N SER 254.A OG no hydrogen 3.094 N/A ARG 258.A N SER 254.A O no hydrogen 3.158 N/A ARG 258.A NE ASP 17.A OD1 no hydrogen 2.805 N/A ARG 258.A NH1 TYR 269.A O no hydrogen 3.033 N/A ARG 258.A NH2 ASP 17.A OD2 no hydrogen 2.971 N/A ARG 258.A NH2 TYR 269.A O no hydrogen 3.019 N/A ALA 259.A N ASP 255.A O no hydrogen 3.258 N/A SER 260.A N GLN 256.A O no hydrogen 3.020 N/A SER 260.A OG GLU 241.A OE1 no hydrogen 2.961 N/A SER 260.A OG GLU 241.A OE2 no hydrogen 3.094 N/A ALA 261.A N GLU 257.A O no hydrogen 2.859 N/A ALA 262.A N ARG 258.A O no hydrogen 2.924 N/A LYS 263.A N ALA 259.A O no hydrogen 2.997 N/A GLU 264.A N SER 260.A O no hydrogen 2.982 N/A LEU 265.A N ALA 261.A O no hydrogen 3.083 N/A ASN 266.A N LYS 263.A O no hydrogen 3.211 N/A TRP 267.A N ALA 262.A O no hydrogen 2.822 N/A GLN 270.A N GLU 273.A OE1 no hydrogen 3.109 N/A PHE 272.A N ASP 17.A OD2 no hydrogen 3.134 N/A GLU 273.A N GLN 270.A O no hydrogen 2.991 N/A VAL 278.A N PRO 275.A O no hydrogen 2.941 N/A TYR 279.A N PRO 275.A O no hydrogen 3.208 N/A LYS 280.A N GLN 276.A O no hydrogen 2.817 N/A TYR 281.A N ASP 277.A O no hydrogen 3.265 N/A TYR 281.A OH THR 39.A OG1 no hydrogen 2.717 N/A TRP 282.A N VAL 278.A O no hydrogen 3.052 N/A TRP 282.A NE1 PHE 7.A O no hydrogen 2.853 N/A ASP 283.A N TYR 279.A O no hydrogen 2.851 N/A ALA 284.A N THR 74.A O no hydrogen 2.913 N/A ARG 285.A N ASP 283.A OD2 no hydrogen 3.004 N/A ARG 285.A NE.A GLY 75.A O no hydrogen 2.695 N/A ARG 285.A NE.B ASP 283.A OD2 no hydrogen 3.156 N/A ARG 285.A NH1.A ASN 47.A OD1.A no hydrogen 2.884 N/A ARG 285.A NH2.A GLY 75.A O no hydrogen 3.052 N/A GLY 288.A N ALA 284.A O no hydrogen 2.885 N/A GLN 289.A N ARG 285.A O no hydrogen 3.014 N/A ALA 290.A N GLU 286.A O no hydrogen 3.117 N/A LEU 291.A N LYS 287.A O no hydrogen 2.906 N/A GLU 292.A N GLY 288.A O no hydrogen 3.015 N/A ALA 293.A N GLN 289.A O no hydrogen 2.892 N/A ASN 294.A N ALA 290.A O no hydrogen 2.876 N/A TRP 295.A N LEU 291.A O no hydrogen 3.123 N/A TRP 295.A NE1 VAL 139.A O no hydrogen 2.720 N/A GLN 296.A N GLU 292.A O no hydrogen 2.810 N/A GLN 296.A NE2 ASN 300.A OD1 no hydrogen 3.119 N/A GLY 297.A N ALA 293.A O no hydrogen 3.384 N/A GLY 297.A N ASN 294.A O no hydrogen 3.097 N/A ARG 299.A N TRP 295.A O no hydrogen 2.992 N/A ARG 299.A NH2 GLU 312.A OE2 no hydrogen 2.646 N/A ASN 300.A N GLN 296.A O no hydrogen 2.838 N/A LEU 301.A N GLY 297.A O no hydrogen 3.135 N/A PHE 302.A N GLN 298.A O no hydrogen 3.198 N/A PHE 302.A N ARG 299.A O no hydrogen 3.017 N/A LYS 303.A N ASN 300.A O no hydrogen 3.181 N/A SER 305.A N PHE 302.A O no hydrogen 3.060 N/A SER 305.A OG PHE 302.A O no hydrogen 2.725 N/A LYS 307.A NZ ARG 131.A O no hydrogen 2.740 N/A PHE 308.A N SER 305.A O no hydrogen 3.056 N/A PHE 311.A N LYS 307.A O no hydrogen 2.948 N/A GLU 312.A N PHE 308.A O no hydrogen 3.009 N/A ARG 313.A N ASP 309.A O no hydrogen 2.943 N/A ARG 313.A NH1 GLU 318.A O no hydrogen 2.805 N/A ARG 313.A NH1 GLU 358.A OE2 no hydrogen 2.782 N/A ARG 313.A NH2 GLU 358.A OE1 no hydrogen 2.924 N/A VAL 314.A N GLU 310.A O no hydrogen 2.851 N/A LEU 315.A N PHE 311.A O no hydrogen 3.100 N/A SER 316.A N GLU 312.A O no hydrogen 3.024 N/A SER 316.A OG ARG 313.A O no hydrogen 2.674 N/A LYS 317.A N VAL 314.A O no hydrogen 3.191 N/A GLU 318.A N SER 316.A OG no hydrogen 3.134 N/A LEU 323.A N PRO 320.A O no hydrogen 3.157 N/A ALA 326.A N GLY 322.A O no hydrogen 3.219 N/A ILE 327.A N LEU 323.A O no hydrogen 2.908 N/A ASN 328.A N GLU 324.A O no hydrogen 2.933 N/A ASN 328.A ND2 GLU 324.A OE2 no hydrogen 3.379 N/A ASP 329.A N SER 325.A O no hydrogen 2.893 N/A TYR 330.A N ALA 326.A O no hydrogen 3.032 N/A ILE 331.A N ILE 327.A O no hydrogen 3.008 N/A ALA 332.A N ASN 328.A O no hydrogen 2.875 N/A SER 333.A N ASP 329.A O no hydrogen 3.012 N/A SER 333.A OG.B ASP 329.A O no hydrogen 3.531 N/A SER 333.A OG.B TYR 330.A O no hydrogen 2.577 N/A GLN 334.A N TYR 330.A O no hydrogen 2.982 N/A LEU 335.A N ILE 331.A O no hydrogen 2.961 N/A SER 336.A N ALA 332.A O no hydrogen 3.059 N/A ASN 337.A N SER 333.A O no hydrogen 2.973 N/A THR 343.A N THR 494.A OG1 no hydrogen 2.978 N/A ARG 344.A N THR 494.A O no hydrogen 3.422 N/A ARG 344.A NH1 ASN 367.A OD1 no hydrogen 3.515 N/A LYS 345.A NZ GLN 348.A OE1 no hydrogen 3.387 N/A ALA 346.A N ALA 342.A O no hydrogen 2.979 N/A SER 347.A N THR 343.A O no hydrogen 2.852 N/A GLN 348.A N ARG 344.A O no hydrogen 3.172 N/A GLN 348.A NE2 ASN 370.A O no hydrogen 3.068 N/A GLN 348.A NE2 ASN 370.A OD1 no hydrogen 3.216 N/A LEU 350.A N SER 347.A O no hydrogen 2.909 N/A GLU 351.A N GLN 348.A O no hydrogen 3.117 N/A LEU 353.A N VAL 349.A O no hydrogen 2.974 N/A CYS 354.A N LEU 350.A O no hydrogen 2.847 N/A CYS 354.A SG TYR 410.A OH no hydrogen 3.900 N/A LYS 355.A N GLU 351.A O no hydrogen 3.296 N/A ASN 356.A N LEU 353.A O no hydrogen 3.044 N/A ASN 356.A ND2 VAL 352.A O no hydrogen 2.863 N/A GLU 358.A N GLU 358.A OE1 no hydrogen 2.630 N/A GLY 360.A N ASN 385.A O no hydrogen 3.083 N/A SER 362.A N LEU 387.A O no hydrogen 3.267 N/A SER 362.A OG.A ASP 364.A OD1 no hydrogen 3.184 N/A SER 362.A OG.A ASP 364.A OD2 no hydrogen 3.455 N/A SER 362.A OG.A GLY 412.A O no hydrogen 3.376 N/A SER 362.A OG.B SER 366.A OG no hydrogen 3.264 N/A SER 362.A OG.B TYR 386.A OH no hydrogen 2.851 N/A ALA 363.A N GLY 412.A O no hydrogen 2.975 N/A SER 366.A OG SER 362.A OG.B no hydrogen 3.264 N/A ASN 368.A N SER 366.A O no hydrogen 2.772 N/A ASN 368.A ND2 GLN 348.A OE1 no hydrogen 3.105 N/A THR 369.A OG1 TYR 386.A OH no hydrogen 2.544 N/A TRP 371.A N SER 374.A OG no hydrogen 2.927 N/A SER 372.A N GLU 351.A OE1 no hydrogen 2.893 N/A SER 372.A OG GLU 351.A OE1 no hydrogen 3.299 N/A SER 372.A OG GLU 351.A OE2 no hydrogen 2.427 N/A SER 374.A N TRP 371.A O no hydrogen 2.886 N/A SER 374.A OG TRP 371.A O no hydrogen 3.250 N/A VAL 375.A N ASN 385.A OD1 no hydrogen 2.880 N/A LEU 377.A N TYR 386.A O no hydrogen 2.859 N/A ASN 379.A N TRP 376.A O no hydrogen 3.016 N/A THR 380.A N TRP 376.A O no hydrogen 2.952 N/A ALA 384.A N GLN 381.A O no hydrogen 3.320 N/A ASN 385.A N VAL 375.A O no hydrogen 2.969 N/A ASN 385.A ND2 GLY 373.A O no hydrogen 3.172 N/A TYR 386.A OH SER 362.A OG.B no hydrogen 2.851 N/A TYR 386.A OH THR 369.A OG1 no hydrogen 2.544 N/A LEU 387.A N GLY 360.A O no hydrogen 2.908 N/A TYR 389.A N SER 362.A O no hydrogen 2.901 N/A ARG 392.A N GLY 390.A O no hydrogen 2.917 N/A ARG 392.A NH1 TYR 389.A O no hydrogen 2.859 N/A ARG 392.A NH2 SER 161.A OG no hydrogen 2.909 N/A GLY 395.A N GLU 158.A OE1 no hydrogen 2.770 N/A ALA 397.A N PHE 394.A O no hydrogen 2.946 N/A ILE 398.A N GLY 395.A O no hydrogen 2.847 N/A ASN 399.A ND2 ALA 424.A O no hydrogen 3.017 N/A GLY 400.A N ALA 397.A O no hydrogen 3.314 N/A LEU 401.A N ILE 398.A O no hydrogen 2.900 N/A LEU 403.A N ASN 399.A O no hydrogen 3.003 N/A TYR 404.A N GLY 400.A O no hydrogen 2.923 N/A TYR 404.A OH HIS 142.A NE2 no hydrogen 2.722 N/A LYS 408.A N GLU 358.A O no hydrogen 2.820 N/A TYR 410.A N PHE 359.A O no hydrogen 3.132 N/A TYR 410.A OH THR 369.A O no hydrogen 2.826 N/A GLY 411.A N VAL 434.A O no hydrogen 3.100 N/A GLY 412.A N GLY 361.A O no hydrogen 3.031 N/A THR 413.A N VAL 436.A O no hydrogen 2.997 N/A LEU 415.A N SER 437.A O no hydrogen 2.808 N/A PHE 417.A N PHE 414.A O no hydrogen 2.879 N/A SER 418.A N LEU 415.A O no hydrogen 2.945 N/A SER 418.A OG LEU 415.A O no hydrogen 2.704 N/A ASP 419.A N VAL 416.A O no hydrogen 3.096 N/A TYR 420.A N PHE 417.A O no hydrogen 2.854 N/A SER 421.A N PHE 417.A O no hydrogen 3.379 N/A ARG 422.A NH1 SER 458.A OG.A no hydrogen 2.821 N/A ARG 422.A NH2 SER 458.A O no hydrogen 2.935 N/A ALA 424.A N SER 421.A O no hydrogen 2.931 N/A ILE 425.A N SER 421.A O no hydrogen 3.129 N/A ARG 426.A N ARG 422.A O no hydrogen 3.013 N/A SER 427.A OG.A ILE 425.A O no hydrogen 2.711 N/A SER 427.A OG.B ASN 399.A OD1 no hydrogen 2.705 N/A SER 427.A OG.B ALA 424.A O no hydrogen 3.236 N/A ALA 428.A N ILE 425.A O no hydrogen 3.213 N/A LEU 429.A N ARG 426.A O no hydrogen 2.871 N/A GLN 431.A N SER 427.A O no hydrogen 2.887 N/A GLN 431.A NE2 SER 402.A OG no hydrogen 2.679 N/A VAL 433.A N GLN 431.A O no hydrogen 2.853 N/A VAL 434.A N PRO 409.A O no hydrogen 3.453 N/A HIS 435.A N SER 490.A O no hydrogen 2.812 N/A VAL 436.A N GLY 411.A O no hydrogen 2.914 N/A SER 437.A OG HIS 438.A ND1 no hydrogen 2.791 N/A HIS 438.A ND1 SER 437.A OG no hydrogen 2.791 N/A ASP 439.A N LEU 493.A O no hydrogen 3.195 N/A GLY 442.A N SER 440.A OG no hydrogen 2.875 N/A LEU 443.A N SER 440.A O no hydrogen 3.065 N/A GLY 444.A N ILE 441.A O no hydrogen 2.971 N/A GLU 445.A N GLU 445.A OE1 no hydrogen 2.793 N/A GLY 447.A N GLY 444.A O no hydrogen 3.235 N/A HIS 450.A N GLY 447.A O no hydrogen 2.976 N/A GLN 451.A NE2 GLU 607.A O no hydrogen 3.447 N/A GLU 454.A N GLU 454.A OE1 no hydrogen 2.597 N/A HIS 455.A NE2 ASP 419.A OD2 no hydrogen 2.984 N/A SER 458.A N GLU 454.A O no hydrogen 2.911 N/A SER 458.A OG.A HIS 455.A O no hydrogen 2.785 N/A LEU 459.A N HIS 455.A O no hydrogen 2.991 N/A LEU 459.A N VAL 456.A O no hydrogen 3.173 N/A ARG 460.A N VAL 456.A O no hydrogen 2.985 N/A ARG 460.A NH1 GLU 584.A OE1 no hydrogen 3.039 N/A ARG 460.A NH1 GLU 584.A OE2 no hydrogen 3.419 N/A ARG 460.A NH2 GLU 584.A OE2 no hydrogen 2.866 N/A LEU 461.A N PRO 457.A O no hydrogen 3.197 N/A ILE 462.A N LEU 459.A O no hydrogen 3.108 N/A ASN 464.A ND2 THR 488.A OG1 no hydrogen 2.816 N/A SER 466.A N PRO 489.A O no hydrogen 3.033 N/A VAL 467.A N GLU 560.A OE1 no hydrogen 2.881 N/A TRP 468.A N VAL 491.A O no hydrogen 2.863 N/A ARG 469.A N PRO 557.A O no hydrogen 2.859 N/A ARG 469.A NE ASP 439.A OD2 no hydrogen 2.944 N/A ARG 469.A NH1 THR 530.A OG1 no hydrogen 2.779 N/A ARG 469.A NH1 GLU 533.A OE1 no hydrogen 2.988 N/A ARG 469.A NH2 ASP 439.A OD2 no hydrogen 2.988 N/A ARG 469.A NH2 GLU 533.A OE1 no hydrogen 3.174 N/A ALA 471.A N GLU 475.A OE1 no hydrogen 2.804 N/A THR 473.A OG1 GLN 334.A OE1 no hydrogen 2.749 N/A GLU 475.A N ASP 472.A OD1 no hydrogen 2.925 N/A THR 476.A N ASP 472.A O no hydrogen 2.921 N/A THR 476.A OG1 ASP 472.A O no hydrogen 2.765 N/A ALA 478.A N GLU 475.A O no hydrogen 2.890 N/A TRP 479.A N THR 476.A O no hydrogen 3.025 N/A TRP 479.A NE1 SER 347.A OG no hydrogen 2.915 N/A LYS 480.A NZ GLU 481.A OE2 no hydrogen 3.403 N/A GLU 481.A N ILE 477.A O no hydrogen 2.909 N/A ALA 482.A N ALA 478.A O no hydrogen 2.909 N/A VAL 483.A N TRP 479.A O no hydrogen 2.904 N/A LYS 484.A N LYS 480.A O no hydrogen 2.971 N/A SER 485.A N GLU 481.A O no hydrogen 3.088 N/A SER 485.A OG THR 488.A O no hydrogen 2.968 N/A LYS 486.A NZ GLU 318.A OE2 no hydrogen 3.405 N/A THR 488.A N SER 485.A OG no hydrogen 3.110 N/A SER 490.A N VAL 433.A O no hydrogen 3.031 N/A VAL 491.A N SER 466.A O no hydrogen 2.858 N/A THR 494.A N THR 343.A OG1 no hydrogen 2.785 N/A THR 494.A OG1 GLN 496.A O no hydrogen 2.783 N/A ARG 495.A NH1 LEU 443.A O no hydrogen 3.209 N/A GLN 496.A N GLN 496.A OE1 no hydrogen 2.766 N/A LEU 498.A N VAL 341.A O no hydrogen 2.969 N/A VAL 500.A N ASP 472.A OD2 no hydrogen 2.756 N/A VAL 501.A N ASP 472.A OD2 no hydrogen 2.843 N/A GLN 502.A N GLN 506.A OE1 no hydrogen 2.878 N/A THR 503.A N GLN 506.A OE1 no hydrogen 3.082 N/A GLN 506.A N THR 503.A O no hydrogen 3.222 N/A GLN 506.A NE2 LEU 516.A O no hydrogen 3.139 N/A GLN 506.A NE2 VAL 517.A O no hydrogen 3.546 N/A VAL 507.A N GLN 504.A O no hydrogen 3.044 N/A ILE 510.A N GLN 506.A O no hydrogen 2.909 N/A ARG 512.A N ASN 509.A O no hydrogen 2.976 N/A GLY 513.A N ILE 510.A O no hydrogen 2.935 N/A TYR 515.A N SER 555.A O no hydrogen 2.997 N/A TYR 515.A OH GLU 475.A OE2 no hydrogen 2.627 N/A VAL 517.A N VAL 553.A O no hydrogen 2.803 N/A LYS 518.A N VAL 553.A O no hydrogen 3.192 N/A ASN 520.A N ASN 552.A OD1 no hydrogen 2.748 N/A ASN 520.A ND2 LEU 551.A O no hydrogen 2.907 N/A ALA 523.A N ASN 520.A O no hydrogen 3.095 N/A LYS 524.A N LYS 550.A O no hydrogen 2.889 N/A LYS 524.A NZ ASP 522.A O no hydrogen 2.834 N/A THR 526.A N PRO 579.A O no hydrogen 2.881 N/A ILE 527.A N ASN 552.A O no hydrogen 2.901 N/A VAL 528.A N VAL 581.A O no hydrogen 2.856 N/A ALA 529.A N ALA 554.A O no hydrogen 2.919 N/A THR 530.A OG1 GLU 584.A OE2 no hydrogen 2.542 N/A SER 532.A OG GLU 533.A OE1 no hydrogen 3.369 N/A SER 532.A OG GLU 533.A OE2 no hydrogen 2.575 N/A GLU 533.A N THR 530.A O no hydrogen 2.949 N/A VAL 534.A N GLY 531.A O no hydrogen 3.079 N/A ALA 537.A N GLU 533.A O no hydrogen 2.982 N/A VAL 538.A N VAL 534.A O no hydrogen 2.943 N/A LYS 539.A N GLU 535.A O no hydrogen 3.048 N/A VAL 540.A N LEU 536.A O no hydrogen 3.045 N/A ALA 541.A N ALA 537.A O no hydrogen 2.900 N/A ASN 542.A N VAL 538.A O no hydrogen 2.801 N/A GLU 543.A N LYS 539.A O no hydrogen 3.105 N/A PHE 544.A N VAL 540.A O no hydrogen 3.053 N/A GLU 545.A N ALA 541.A O no hydrogen 2.947 N/A LYS 546.A N ASN 542.A O no hydrogen 3.358 N/A LYS 546.A N GLU 543.A O no hydrogen 3.285 N/A LYS 546.A NZ GLU 543.A OE1 no hydrogen 2.837 N/A LYS 547.A N PHE 544.A O no hydrogen 2.985 N/A GLY 548.A N GLU 545.A O no hydrogen 3.101 N/A ILE 549.A N PHE 544.A O no hydrogen 2.861 N/A LYS 550.A NZ GLU 545.A OE1 no hydrogen 2.771 N/A ASN 552.A N LEU 525.A O no hydrogen 2.893 N/A VAL 553.A N LYS 518.A O no hydrogen 3.037 N/A ALA 554.A N ILE 527.A O no hydrogen 2.858 N/A SER 555.A N TYR 515.A O no hydrogen 2.923 N/A SER 555.A OG GLU 475.A OE1 no hydrogen 3.556 N/A SER 555.A OG GLU 475.A OE2 no hydrogen 2.688 N/A ILE 556.A N ALA 529.A O no hydrogen 2.943 N/A CYS 558.A N GLY 513.A O no hydrogen 3.031 N/A CYS 558.A SG VAL 467.A O no hydrogen 3.664 N/A CYS 558.A SG GLU 560.A OE1 no hydrogen 3.539 N/A PHE 562.A N CYS 558.A O no hydrogen 2.936 N/A ALA 563.A N VAL 559.A O no hydrogen 2.859 N/A THR 564.A N VAL 561.A O no hydrogen 3.095 N/A THR 564.A OG1 VAL 561.A O no hydrogen 2.769 N/A THR 564.A OG1 GLN 565.A OE1 no hydrogen 3.561 N/A GLN 565.A N PHE 562.A O no hydrogen 3.006 N/A TYR 569.A OH GLY 514.A O no hydrogen 2.635 N/A LYS 570.A N ALA 566.A O no hydrogen 2.909 N/A LYS 570.A NZ ALA 563.A O no hydrogen 3.140 N/A LYS 571.A N HIS 567.A O no hydrogen 3.069 N/A THR 572.A N GLU 568.A O no hydrogen 3.072 N/A THR 572.A N TYR 569.A O no hydrogen 2.978 N/A THR 572.A OG1 TYR 569.A O no hydrogen 2.788 N/A VAL 573.A N TYR 569.A O no hydrogen 3.137 N/A ILE 574.A N LYS 570.A O no hydrogen 2.940 N/A ALA 580.A N GLY 596.A O no hydrogen 3.047 N/A VAL 581.A N THR 526.A O no hydrogen 2.930 N/A PHE 582.A N GLU 598.A O no hydrogen 3.041 N/A VAL 583.A N VAL 528.A O no hydrogen 2.917 N/A GLU 584.A N LYS 600.A O no hydrogen 3.160 N/A GLN 586.A N ILE 453.A O no hydrogen 2.949 N/A GLN 586.A NE2 ASP 588.A OD2 no hydrogen 2.960 N/A ASP 588.A N GLN 586.A OE1 no hydrogen 2.861 N/A TRP 589.A NE1 GLU 584.A OE1 no hydrogen 2.891 N/A TYR 592.A N TRP 589.A O no hydrogen 2.873 N/A LYS 594.A N ASP 576.A OD1 no hydrogen 3.017 N/A ALA 595.A N ASP 576.A O no hydrogen 3.062 N/A GLY 596.A N PRO 593.A O no hydrogen 2.984 N/A GLU 598.A N ALA 580.A O no hydrogen 3.083 N/A LYS 600.A N PHE 582.A O no hydrogen 2.674 N/A LYS 600.A NZ PHE 618.A O no hydrogen 2.942 N/A ILE 602.A N ALA 585.A O no hydrogen 2.980 N/A TYR 603.A OH ASP 588.A OD1 no hydrogen 2.677 N/A SER 604.A OG PHE 605.A O no hydrogen 2.961 N/A SER 608.A OG GLU 445.A O no hydrogen 2.631 N/A ASP 613.A N PRO 610.A O no hydrogen 2.937 N/A LEU 614.A N PRO 610.A O no hydrogen 3.161 N/A PHE 615.A N ALA 611.A O no hydrogen 2.877 N/A LYS 616.A N GLU 612.A O no hydrogen 3.207 N/A ARG 617.A N ASP 613.A O no hydrogen 2.937 N/A PHE 618.A N LEU 614.A O no hydrogen 2.904 N/A GLY 619.A N LYS 616.A O no hydrogen 3.377 N/A PHE 620.A N PHE 615.A O no hydrogen 2.896 N/A GLU 623.A N GLU 623.A OE1 no hydrogen 2.772 N/A ASN 624.A N THR 621.A OG1 no hydrogen 2.947 N/A ILE 625.A N THR 621.A O no hydrogen 3.031 N/A SER 626.A N VAL 622.A O no hydrogen 2.944 N/A SER 626.A OG VAL 622.A O no hydrogen 2.764 N/A ASN 627.A N GLU 623.A O no hydrogen 2.948 N/A ILE 628.A N ASN 624.A O no hydrogen 3.050 N/A VAL 629.A N ILE 625.A O no hydrogen 2.950 N/A ALA 630.A N SER 626.A O no hydrogen 2.896 N/A LYS 631.A N ILE 628.A O no hydrogen 3.243 N/A LYS 631.A NZ GLU 598.A OE2 no hydrogen 2.766 N/A TYR 632.A N VAL 629.A O no hydrogen 2.945 N/A TYR 632.A OH GLU 598.A OE2 no hydrogen 2.644 N/A