Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4x8i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 317.A OD1 no hydrogen 2.741 N/A ASP 3.A N TYR 174.A OH no hydrogen 2.705 N/A LEU 6.A N ASP 3.A OD1 no hydrogen 3.099 N/A MET 7.A N ASP 3.A O no hydrogen 2.835 N/A LYS 8.A N TRP 4.A O no hydrogen 2.979 N/A LYS 8.A NZ GLU 12.A OE1 no hydrogen 2.931 N/A LYS 8.A NZ GLU 12.A OE2 no hydrogen 3.279 N/A LYS 9.A N GLU 5.A O no hydrogen 3.187 N/A ILE 10.A N LEU 6.A O no hydrogen 2.983 N/A ILE 11.A N MET 7.A O no hydrogen 2.897 N/A GLU 12.A N LYS 8.A O no hydrogen 2.978 N/A GLY 15.A N GLU 149.A OE2 no hydrogen 2.779 N/A SER 17.A N LYS 66.A O no hydrogen 3.190 N/A SER 17.A OG ASP 65.A OD2 no hydrogen 2.532 N/A GLY 18.A N GLU 20.A OE2 no hydrogen 2.879 N/A TYR 19.A N VAL 16.A O no hydrogen 2.695 N/A GLU 20.A N GLU 20.A OE1 no hydrogen 2.645 N/A LEU 22.A N TYR 19.A O no hydrogen 3.186 N/A ILE 24.A N PRO 14.A O no hydrogen 2.876 N/A ARG 25.A N GLU 20.A O no hydrogen 3.102 N/A ARG 25.A NE ASP 26.A OD1 no hydrogen 2.948 N/A ARG 25.A NH2 ASP 26.A OD1 no hydrogen 2.970 N/A ARG 25.A NH2 ASP 26.A OD2 no hydrogen 3.425 N/A LEU 27.A N GLY 23.A O no hydrogen 3.284 N/A VAL 28.A N ILE 24.A O no hydrogen 2.957 N/A VAL 29.A N ARG 25.A O no hydrogen 2.828 N/A ASP 30.A N ASP 26.A O no hydrogen 2.703 N/A ILE 31.A N LEU 27.A O no hydrogen 3.167 N/A ILE 31.A N VAL 28.A O no hydrogen 3.124 N/A LEU 32.A N VAL 28.A O no hydrogen 3.080 N/A LYS 33.A N VAL 29.A O no hydrogen 3.118 N/A LYS 33.A NZ ASP 30.A OD1 no hydrogen 3.025 N/A VAL 35.A N LEU 32.A O no hydrogen 3.069 N/A ALA 36.A N LEU 32.A O no hydrogen 2.840 N/A ASP 37.A N HIS 50.A O no hydrogen 2.874 N/A LYS 40.A N ILE 48.A O no hydrogen 2.836 N/A ASP 42.A N ASN 46.A O no hydrogen 3.258 N/A LEU 44.A N ASP 42.A OD1 no hydrogen 3.175 N/A GLY 45.A N ASP 42.A O no hydrogen 3.071 N/A GLY 45.A N ASP 42.A OD1 no hydrogen 2.878 N/A ASN 46.A N ASP 42.A OD1 no hydrogen 2.828 N/A ASN 46.A ND2 ASP 42.A OD2 no hydrogen 2.704 N/A ASN 46.A ND2 GLY 204.A O no hydrogen 2.897 N/A VAL 47.A N ALA 194.A O no hydrogen 3.144 N/A ILE 48.A N LYS 40.A O no hydrogen 2.936 N/A ALA 49.A N ILE 192.A O no hydrogen 2.888 N/A HIS 50.A N GLU 38.A O no hydrogen 2.743 N/A HIS 50.A NE2 ASP 189.A OD1 no hydrogen 2.681 N/A PHE 51.A N ILE 190.A O no hydrogen 2.733 N/A LYS 52.A N ASP 37.A OD2 no hydrogen 2.682 N/A SER 54.A N GLU 187.A O no hydrogen 2.874 N/A ALA 55.A N GLU 187.A O no hydrogen 3.007 N/A LYS 57.A N GLU 215.A OE1 no hydrogen 2.924 N/A LYS 57.A NZ ILE 212.A O no hydrogen 3.004 N/A LYS 57.A NZ ASP 213.A O no hydrogen 3.403 N/A VAL 58.A N ASP 189.A O no hydrogen 2.995 N/A MET 59.A N VAL 216.A O no hydrogen 2.862 N/A VAL 60.A N TYR 191.A O no hydrogen 2.944 N/A ALA 61.A N ILE 218.A O no hydrogen 2.860 N/A ALA 62.A N VAL 193.A O no hydrogen 3.122 N/A HIS 63.A N ASP 169.A OD1 no hydrogen 3.069 N/A HIS 63.A ND1 ASP 65.A O no hydrogen 3.162 N/A HIS 63.A ND1 ASP 65.A OD1 no hydrogen 2.961 N/A HIS 63.A NE2 ASP 168.A OD1 no hydrogen 2.829 N/A HIS 63.A NE2 ASP 221.A OD1 no hydrogen 3.232 N/A MET 64.A N SER 195.A O no hydrogen 2.749 N/A LYS 66.A N GLY 15.A O no hydrogen 2.669 N/A LYS 66.A NZ ILE 11.A O no hydrogen 3.337 N/A LYS 66.A NZ SER 13.A O no hydrogen 3.153 N/A LYS 66.A NZ GLU 149.A OE1 no hydrogen 2.722 N/A GLY 68.A N ILE 85.A O no hydrogen 2.921 N/A LEU 69.A N GLY 148.A O no hydrogen 2.836 N/A MET 70.A N VAL 83.A O no hydrogen 2.881 N/A VAL 71.A N THR 146.A O no hydrogen 2.852 N/A ASN 72.A N ARG 81.A O no hydrogen 2.964 N/A ASP 75.A N TYR 79.A O no hydrogen 3.112 N/A LYS 76.A NZ ASP 77.A OD1 no hydrogen 3.268 N/A LYS 76.A NZ ASP 77.A OD2 no hydrogen 3.567 N/A GLY 78.A N ASP 75.A O no hydrogen 3.007 N/A TYR 79.A N ASP 75.A OD1 no hydrogen 3.051 N/A LEU 80.A N VAL 127.A O no hydrogen 2.915 N/A ARG 81.A N HIS 73.A O no hydrogen 3.032 N/A VAL 83.A N MET 70.A O no hydrogen 2.982 N/A ILE 85.A N GLY 68.A O no hydrogen 2.797 N/A VAL 88.A N GLY 86.A O no hydrogen 2.774 N/A THR 92.A N LEU 89.A O no hydrogen 2.749 N/A THR 92.A OG1 LEU 89.A O no hydrogen 2.473 N/A LEU 93.A N PRO 90.A O no hydrogen 2.736 N/A ILE 98.A N GLY 109.A O no hydrogen 2.761 N/A ARG 99.A N GLU 149.A O no hydrogen 2.982 N/A ARG 99.A NE GLU 106.A OE1 no hydrogen 2.988 N/A ARG 99.A NH1 GLU 12.A O no hydrogen 3.228 N/A ARG 99.A NH2 GLU 106.A OE1 no hydrogen 3.453 N/A ARG 99.A NH2 GLU 106.A OE2 no hydrogen 2.964 N/A PHE 100.A N ARG 107.A O no hydrogen 2.657 N/A PHE 101.A N ILE 147.A O no hydrogen 2.935 N/A THR 102.A N GLY 105.A O no hydrogen 3.178 N/A THR 102.A OG1 GLY 105.A O no hydrogen 2.536 N/A GLU 103.A N GLY 141.A O no hydrogen 3.431 N/A LYS 104.A N THR 102.A OG1 no hydrogen 3.036 N/A LYS 104.A NZ GLU 139.A O no hydrogen 2.809 N/A GLY 105.A N THR 102.A O no hydrogen 3.410 N/A ARG 107.A N PHE 100.A O no hydrogen 2.798 N/A GLY 109.A N ILE 98.A O no hydrogen 2.734 N/A VAL 110.A N ASP 128.A O no hydrogen 2.849 N/A VAL 111.A N GLN 96.A O no hydrogen 3.056 N/A LEU 118.A N PRO 115.A O no hydrogen 3.063 N/A ARG 119.A N PRO 116.A O no hydrogen 3.033 N/A ARG 119.A NE LEU 114.A O no hydrogen 3.134 N/A ARG 119.A NH2 LEU 114.A O no hydrogen 2.899 N/A TRP 122.A N ASP 121.A OD1 no hydrogen 2.614 N/A SER 124.A OG ASP 121.A O no hydrogen 2.629 N/A ILE 125.A N TRP 122.A O no hydrogen 3.328 N/A VAL 127.A N LEU 80.A O no hydrogen 2.819 N/A ASP 128.A N VAL 110.A O no hydrogen 2.685 N/A GLY 130.A N ASP 128.A OD1 no hydrogen 3.122 N/A SER 132.A N GLU 136.A OE1 no hydrogen 2.776 N/A SER 133.A OG GLU 135.A OE1 no hydrogen 3.542 N/A ARG 134.A N LYS 76.A O no hydrogen 2.967 N/A ARG 134.A NE ILE 74.A O no hydrogen 3.084 N/A GLU 135.A N GLU 135.A OE1 no hydrogen 2.521 N/A GLU 136.A N SER 133.A OG no hydrogen 3.136 N/A ALA 137.A N SER 133.A O no hydrogen 3.235 N/A GLU 138.A N ARG 134.A O no hydrogen 2.813 N/A GLU 139.A N GLU 135.A O no hydrogen 2.639 N/A MET 140.A N GLU 136.A O no hydrogen 2.890 N/A GLY 141.A N GLU 138.A O no hydrogen 2.851 N/A PHE 142.A N ALA 137.A O no hydrogen 3.212 N/A ARG 143.A N THR 146.A OG1 no hydrogen 2.736 N/A ARG 143.A NH1 GLU 138.A O no hydrogen 2.866 N/A ARG 143.A NH1 PHE 142.A O no hydrogen 2.682 N/A GLY 145.A N VAL 71.A O no hydrogen 2.716 N/A THR 146.A N ARG 143.A O no hydrogen 3.033 N/A THR 146.A OG1 ARG 143.A O no hydrogen 2.894 N/A GLY 148.A N LEU 69.A O no hydrogen 2.853 N/A GLU 149.A N ARG 99.A O no hydrogen 2.850 N/A PHE 150.A N TYR 166.A OH no hydrogen 2.884 N/A ALA 151.A N LYS 97.A O no hydrogen 3.213 N/A THR 155.A N ALA 163.A O no hydrogen 3.162 N/A ARG 156.A NH2 GLU 159.A O no hydrogen 2.672 N/A LEU 157.A N ARG 161.A O no hydrogen 3.050 N/A SER 158.A N ARG 161.A O no hydrogen 3.161 N/A ARG 161.A N SER 158.A OG no hydrogen 3.186 N/A ARG 161.A NE ASP 312.A OD2 no hydrogen 3.108 N/A PHE 162.A N ALA 311.A O no hydrogen 3.156 N/A ALA 163.A N THR 155.A O no hydrogen 2.932 N/A THR 164.A N GLU 309.A O no hydrogen 2.873 N/A THR 164.A OG1 PRO 165.A O no hydrogen 2.869 N/A TYR 166.A OH ILE 67.A O no hydrogen 2.746 N/A ASP 168.A N GLU 309.A OE1 no hydrogen 3.009 N/A ARG 170.A NE MET 64.A O no hydrogen 3.031 N/A ARG 170.A NH1 ILE 10.A O no hydrogen 2.848 N/A ARG 170.A NH1 SER 13.A O no hydrogen 2.496 N/A ARG 170.A NH2 SER 13.A O no hydrogen 3.149 N/A ARG 170.A NH2 GLY 15.A O no hydrogen 3.401 N/A ARG 170.A NH2 MET 64.A O no hydrogen 2.808 N/A ILE 171.A N LEU 167.A O no hydrogen 2.895 N/A CYS 172.A N ASP 169.A O no hydrogen 3.036 N/A CYS 172.A SG ASP 221.A O no hydrogen 3.236 N/A LEU 173.A N ASP 169.A O no hydrogen 2.862 N/A TYR 174.A N ARG 170.A O no hydrogen 2.847 N/A TYR 174.A OH GLU 178.A OE2 no hydrogen 2.879 N/A ALA 175.A N ILE 171.A O no hydrogen 3.091 N/A MET 176.A N CYS 172.A O no hydrogen 2.785 N/A ILE 177.A N LEU 173.A O no hydrogen 2.928 N/A GLU 178.A N TYR 174.A O no hydrogen 2.998 N/A ALA 179.A N ALA 175.A O no hydrogen 2.993 N/A ALA 180.A N MET 176.A O no hydrogen 2.902 N/A ARG 181.A N ILE 177.A O no hydrogen 2.948 N/A ARG 181.A NH1 GLU 178.A OE1 no hydrogen 2.897 N/A GLN 182.A N GLU 178.A O no hydrogen 3.050 N/A GLN 182.A N ALA 179.A O no hydrogen 3.217 N/A LEU 183.A N ALA 180.A O no hydrogen 3.169 N/A GLY 184.A N GLU 328.A OE2 no hydrogen 2.800 N/A HIS 186.A ND1 ALA 188.A O no hydrogen 2.697 N/A ASP 189.A N PRO 56.A O no hydrogen 2.906 N/A ILE 190.A N PHE 51.A O no hydrogen 3.033 N/A TYR 191.A N VAL 58.A O no hydrogen 2.810 N/A ILE 192.A N ALA 49.A O no hydrogen 2.871 N/A VAL 193.A N VAL 60.A O no hydrogen 2.682 N/A ALA 194.A N VAL 47.A O no hydrogen 2.937 N/A SER 195.A N ALA 62.A O no hydrogen 3.165 N/A SER 195.A OG ASP 281.A OD2 no hydrogen 2.650 N/A VAL 196.A N ASN 46.A OD1 no hydrogen 2.919 N/A GLN 197.A N GLU 20.A OE2 no hydrogen 2.834 N/A GLU 198.A N ASP 65.A OD1 no hydrogen 3.164 N/A GLU 199.A N ASP 65.A OD2 no hydrogen 3.053 N/A LEU 202.A N GLU 198.A O no hydrogen 3.282 N/A ARG 203.A N GLN 197.A O no hydrogen 3.257 N/A ARG 206.A N LEU 202.A O no hydrogen 3.312 N/A ALA 208.A N GLY 204.A O no hydrogen 2.746 N/A SER 209.A N ALA 205.A O no hydrogen 2.861 N/A PHE 210.A N VAL 207.A O no hydrogen 3.191 N/A ALA 211.A N VAL 207.A O no hydrogen 3.126 N/A ILE 212.A N ALA 208.A O no hydrogen 3.015 N/A ASP 213.A N SER 209.A O no hydrogen 2.981 N/A GLU 215.A N LYS 57.A O no hydrogen 2.860 N/A VAL 216.A N LYS 57.A O no hydrogen 3.188 N/A GLY 217.A N ALA 293.A O no hydrogen 2.841 N/A ILE 218.A N MET 59.A O no hydrogen 2.679 N/A ALA 219.A N ALA 295.A O no hydrogen 3.035 N/A MET 220.A N ALA 61.A O no hydrogen 2.826 N/A VAL 222.A N ASP 221.A OD1 no hydrogen 2.729 N/A THR 223.A N ILE 299.A O no hydrogen 2.925 N/A THR 223.A OG1 GLU 272.A OE1 no hydrogen 2.519 N/A THR 223.A OG1 GLU 272.A OE2 no hydrogen 3.421 N/A ALA 225.A N ILE 301.A O no hydrogen 2.878 N/A LYS 226.A N PRO 236.A O no hydrogen 2.887 N/A GLN 227.A N ASP 230.A OD2 no hydrogen 2.892 N/A LYS 231.A NZ ASN 229.A O no hydrogen 3.315 N/A GLY 232.A N ASP 230.A OD1 no hydrogen 2.614 N/A LYS 233.A N ASP 230.A O no hydrogen 2.991 N/A GLU 237.A N GLN 270.A OE1 no hydrogen 3.033 N/A GLY 239.A N ASP 315.A OD2 no hydrogen 2.684 N/A LYS 240.A N GLU 237.A O no hydrogen 3.408 N/A LYS 240.A NZ GLU 237.A OE2 no hydrogen 2.818 N/A GLY 241.A N ASP 315.A OD1 no hydrogen 2.758 N/A VAL 243.A N SER 298.A O no hydrogen 2.874 N/A MET 244.A N GLN 270.A O no hydrogen 2.913 N/A VAL 246.A N GLU 272.A O no hydrogen 2.993 N/A ASN 249.A ND2 ASN 249.A O no hydrogen 2.525 N/A ASN 249.A ND2 ALA 282.A O no hydrogen 3.246 N/A ILE 250.A N GLY 247.A O no hydrogen 2.811 N/A ASN 251.A N THR 294.A O no hydrogen 2.939 N/A ASN 251.A ND2 PHE 335.A O no hydrogen 3.061 N/A LYS 253.A NZ PRO 337.A O no hydrogen 3.508 N/A LEU 254.A N ASN 251.A OD1 no hydrogen 2.945 N/A ARG 255.A N ASN 251.A O no hydrogen 2.898 N/A ARG 255.A NE MET 244.A O no hydrogen 3.239 N/A ARG 255.A NE ASP 245.A O no hydrogen 2.913 N/A ARG 255.A NH1 ARG 255.A O no hydrogen 3.558 N/A ARG 255.A NH1 ASP 259.A OD1 no hydrogen 3.502 N/A ARG 255.A NH2 MET 244.A O no hydrogen 2.698 N/A GLN 256.A N PRO 252.A O no hydrogen 2.894 N/A PHE 257.A N LYS 253.A O no hydrogen 2.983 N/A ALA 258.A N LEU 254.A O no hydrogen 2.949 N/A ASP 259.A N ARG 255.A O no hydrogen 2.998 N/A GLU 260.A N GLN 256.A O no hydrogen 3.026 N/A VAL 261.A N PHE 257.A O no hydrogen 2.929 N/A ALA 262.A N ALA 258.A O no hydrogen 3.055 N/A LYS 263.A N ASP 259.A O no hydrogen 3.003 N/A LYS 264.A N GLU 260.A O no hydrogen 3.070 N/A LYS 264.A NZ GLU 329.A OE2 no hydrogen 2.504 N/A TYR 265.A N VAL 261.A O no hydrogen 3.057 N/A TYR 265.A OH GLU 329.A OE2 no hydrogen 2.810 N/A GLU 266.A N LYS 263.A O no hydrogen 3.060 N/A ILE 267.A N ALA 262.A O no hydrogen 2.808 N/A GLN 270.A N PRO 242.A O no hydrogen 2.850 N/A GLN 270.A NE2 GLU 237.A O no hydrogen 2.911 N/A GLN 270.A NE2 GLY 241.A O no hydrogen 2.805 N/A SER 274.A N VAL 246.A O no hydrogen 2.937 N/A SER 274.A OG ASP 245.A OD2 no hydrogen 2.569 N/A SER 274.A OG GLU 272.A O no hydrogen 3.529 N/A THR 278.A N ASN 249.A OD1 no hydrogen 2.999 N/A THR 278.A OG1 ASN 249.A OD1 no hydrogen 2.912 N/A THR 278.A OG1 THR 280.A OG1 no hydrogen 3.054 N/A THR 280.A OG1 THR 278.A OG1 no hydrogen 3.054 N/A ALA 282.A N THR 280.A OG1 no hydrogen 3.105 N/A ASN 283.A N THR 280.A O no hydrogen 2.961 N/A ASN 283.A ND2 THR 278.A O no hydrogen 2.734 N/A MET 285.A N ASP 281.A O no hydrogen 3.112 N/A GLN 286.A N ALA 282.A O no hydrogen 3.122 N/A GLN 286.A NE2 PRO 248.A O no hydrogen 3.113 N/A ASN 288.A N MET 285.A O no hydrogen 2.944 N/A ASN 288.A ND2 SER 209.A O no hydrogen 2.780 N/A ARG 289.A NE PHE 210.A O no hydrogen 3.043 N/A ARG 289.A NH2 PHE 210.A O no hydrogen 3.380 N/A GLY 291.A N ASN 288.A O no hydrogen 2.879 N/A VAL 292.A N GLN 286.A O no hydrogen 3.203 N/A ALA 293.A N GLU 215.A O no hydrogen 2.893 N/A THR 294.A OG1 ASN 249.A O no hydrogen 2.865 N/A ALA 295.A N GLY 217.A O no hydrogen 2.965 N/A LEU 297.A N ALA 219.A O no hydrogen 2.749 N/A SER 298.A N VAL 243.A O no hydrogen 2.832 N/A SER 298.A OG VAL 243.A O no hydrogen 3.535 N/A ILE 299.A N ASP 221.A O no hydrogen 3.304 N/A ILE 301.A N THR 223.A O no hydrogen 2.865 N/A ARG 302.A N LEU 310.A O no hydrogen 2.910 N/A ARG 302.A NE LYS 226.A O no hydrogen 2.943 N/A TYR 303.A N GLN 227.A OE1 no hydrogen 2.989 N/A HIS 305.A N GLU 309.A OE2 no hydrogen 2.674 N/A HIS 305.A ND1 GLY 87.A O no hydrogen 3.280 N/A HIS 305.A NE2 ASP 168.A OD2 no hydrogen 2.754 N/A HIS 305.A NE2 GLU 199.A OE2 no hydrogen 2.833 N/A SER 306.A OG TYR 303.A O no hydrogen 2.684 N/A GLN 307.A N GLN 307.A OE1 no hydrogen 2.704 N/A GLN 307.A NE2 THR 92.A O no hydrogen 2.757 N/A VAL 308.A N SER 306.A OG no hydrogen 3.343 N/A GLU 309.A N SER 306.A O no hydrogen 3.335 N/A LEU 310.A N ARG 302.A O no hydrogen 3.117 N/A ALA 311.A N PHE 162.A O no hydrogen 3.073 N/A ALA 313.A N HIS 160.A O no hydrogen 2.641 N/A ARG 314.A N ASP 312.A OD1 no hydrogen 2.884 N/A ARG 314.A NE ASP 312.A OD1 no hydrogen 3.002 N/A ARG 314.A NE ASP 312.A OD2 no hydrogen 3.391 N/A ARG 314.A NH2 ASP 312.A OD2 no hydrogen 2.784 N/A ASP 315.A N ASP 312.A O no hydrogen 3.032 N/A VAL 316.A N ASP 312.A O no hydrogen 3.392 N/A ASP 317.A N ALA 313.A O no hydrogen 3.013 N/A ASN 318.A N ARG 314.A O no hydrogen 3.075 N/A THR 319.A N ASP 315.A O no hydrogen 2.893 N/A THR 319.A OG1 ASP 315.A O no hydrogen 2.639 N/A ILE 320.A N VAL 316.A O no hydrogen 2.974 N/A LYS 321.A N ASP 317.A O no hydrogen 3.057 N/A LEU 322.A N ASN 318.A O no hydrogen 2.935 N/A ALA 323.A N THR 319.A O no hydrogen 2.759 N/A LYS 324.A N ILE 320.A O no hydrogen 2.799 N/A LYS 324.A NZ GLU 328.A OE1 no hydrogen 3.226 N/A LYS 324.A NZ GLU 328.A OE2 no hydrogen 2.924 N/A ALA 325.A N LYS 321.A O no hydrogen 2.826 N/A LEU 326.A N LEU 322.A O no hydrogen 2.897 N/A LEU 327.A N ALA 323.A O no hydrogen 3.186 N/A GLU 328.A N LYS 324.A O no hydrogen 3.063 N/A GLU 329.A N ALA 325.A O no hydrogen 2.945 N/A LEU 330.A N LEU 326.A O no hydrogen 2.979 N/A THR 336.A N ASP 334.A OD2 no hydrogen 3.247 N/A THR 336.A OG1 ASP 334.A OD2 no hydrogen 3.524 N/A