Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nu8_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 8.A N ASP 6.A OD1 no hydrogen 2.694 N/A SER 8.A OG ASP 6.A OD1 no hydrogen 2.658 N/A TYR 9.A N ASP 6.A O no hydrogen 3.193 N/A SER 10.A N ASN 7.A O no hydrogen 3.172 N/A SER 10.A OG ASN 7.A O no hydrogen 2.905 N/A SER 10.A OG ASN 7.A OD1 no hydrogen 2.908 N/A GLY 12.A N ASN 36.A OD1 no hydrogen 2.970 N/A ASN 13.A N GLU 159.A OE2 no hydrogen 2.928 N/A THR 14.A N GLU 159.A OE1 no hydrogen 3.368 N/A THR 14.A OG1 GLU 33.A OE2 no hydrogen 2.650 N/A VAL 17.A N VAL 30.A O no hydrogen 2.933 N/A ARG 18.A NH1 GLY 26.A O no hydrogen 2.826 N/A LEU 19.A N VAL 28.A O no hydrogen 2.902 N/A LYS 20.A N GLU 264.A OE1 no hydrogen 2.968 N/A LYS 20.A N GLU 264.A OE2 no hydrogen 3.145 N/A HIS 21.A N GLU 264.A OE2 no hydrogen 2.679 N/A GLY 23.A N ASP 280.A OD1 no hydrogen 2.590 N/A HIS 24.A N ASN 27.A OD1 no hydrogen 2.641 N/A ASN 27.A N HIS 24.A O no hydrogen 3.309 N/A ASN 27.A ND2 ALA 283.A O no hydrogen 3.266 N/A ASN 27.A ND2 PHE 288.A O no hydrogen 3.429 N/A VAL 29.A N ILE 293.A O no hydrogen 2.903 N/A VAL 30.A N VAL 17.A O no hydrogen 2.765 N/A LYS 31.A N VAL 295.A O no hydrogen 2.779 N/A LYS 31.A NZ THR 14.A O no hydrogen 2.809 N/A LYS 31.A NZ THR 14.A OG1 no hydrogen 2.770 N/A LYS 31.A NZ GLU 159.A OE1 no hydrogen 2.661 N/A ILE 32.A N PRO 15.A O no hydrogen 3.136 N/A GLU 33.A N LEU 297.A O no hydrogen 3.018 N/A ARG 35.A N.A ILE 32.A O no hydrogen 3.088 N/A ARG 35.A N.B ILE 32.A O no hydrogen 3.099 N/A ASN 36.A ND2 GLU 33.A O no hydrogen 2.868 N/A ASN 36.A ND2 GLU 33.A OE1 no hydrogen 3.100 N/A SER 38.A OG PRO 37.A O no hydrogen 2.650 N/A TYR 39.A N ASN 36.A O no hydrogen 2.798 N/A VAL 41.A N PRO 298.A O no hydrogen 2.844 N/A CYS 42.A SG SER 40.A O no hydrogen 3.280 N/A ARG 43.A N VAL 41.A O no hydrogen 3.076 N/A ARG 43.A NE GLU 33.A OE1 no hydrogen 2.620 N/A ARG 43.A NH1 THR 155.A OG1 no hydrogen 3.002 N/A ARG 43.A NH1 GLU 159.A OE2 no hydrogen 2.948 N/A ARG 43.A NH2 GLU 33.A OE1 no hydrogen 3.286 N/A ARG 43.A NH2 GLU 33.A OE2 no hydrogen 2.791 N/A ARG 43.A NH2 GLU 159.A OE1 no hydrogen 2.832 N/A ARG 43.A NH2 GLU 159.A OE2 no hydrogen 3.463 N/A ALA 46.A N CYS 42.A O no hydrogen 3.078 N/A ASN 47.A N ARG 43.A O no hydrogen 3.103 N/A ASN 47.A ND2 ALA 147.A O no hydrogen 2.814 N/A MET 48.A N ILE 44.A O no hydrogen 2.812 N/A VAL 49.A N GLY 45.A O no hydrogen 3.421 N/A TRP 50.A N ALA 46.A O no hydrogen 2.868 N/A GLN 51.A N ASN 47.A O no hydrogen 2.831 N/A ALA 52.A N MET 48.A O no hydrogen 3.095 N/A GLU 53.A N VAL 49.A O no hydrogen 2.953 N/A LYS 54.A N TRP 50.A O no hydrogen 3.029 N/A ASP 55.A N GLN 51.A O no hydrogen 2.867 N/A GLY 56.A N GLU 53.A O no hydrogen 3.165 N/A THR 57.A OG1 ALA 52.A O no hydrogen 3.232 N/A LEU 58.A N ALA 52.A O no hydrogen 2.815 N/A LYS 62.A N THR 59.A O no hydrogen 3.021 N/A GLU 63.A N ARG 136.A O no hydrogen 2.648 N/A ILE 64.A N LYS 86.A O no hydrogen 2.964 N/A VAL 65.A N VAL 138.A O no hydrogen 3.003 N/A ASP 66.A N THR 88.A O no hydrogen 3.137 N/A ALA 67.A N ASP 66.A OD1 no hydrogen 2.790 N/A THR 68.A N THR 90.A O no hydrogen 3.212 N/A GLY 70.A N THR 68.A OG1 no hydrogen 3.195 N/A THR 72.A OG1 GLN 142.A OE1 no hydrogen 2.533 N/A GLY 73.A N GLY 70.A O no hydrogen 3.321 N/A ALA 75.A N ASN 71.A O no hydrogen 2.949 N/A LEU 76.A N THR 72.A O no hydrogen 2.830 N/A ALA 77.A N GLY 73.A O no hydrogen 2.813 N/A TYR 78.A N ILE 74.A O no hydrogen 3.006 N/A VAL 79.A N ALA 75.A O no hydrogen 3.081 N/A ALA 80.A N LEU 76.A O no hydrogen 2.711 N/A ALA 81.A N ALA 77.A O no hydrogen 2.947 N/A ALA 82.A N TYR 78.A O no hydrogen 2.814 N/A ARG 83.A N VAL 79.A O no hydrogen 2.886 N/A ARG 83.A NE GLU 53.A OE2 no hydrogen 2.881 N/A ARG 83.A NH1 ASP 6.A OD2 no hydrogen 2.765 N/A ARG 83.A NH1 TYR 9.A OH no hydrogen 3.198 N/A ARG 83.A NH2 GLU 53.A OE1 no hydrogen 2.744 N/A ARG 83.A NH2 GLU 53.A OE2 no hydrogen 3.222 N/A TYR 85.A N ALA 80.A O no hydrogen 2.776 N/A TYR 85.A OH GLU 53.A OE2 no hydrogen 2.607 N/A THR 88.A N ILE 64.A O no hydrogen 2.746 N/A THR 88.A OG1 GLU 63.A OE2 no hydrogen 2.586 N/A LEU 89.A N ASN 109.A O no hydrogen 3.193 N/A THR 90.A N ASP 66.A O no hydrogen 2.904 N/A THR 90.A OG1 ALA 122.A O no hydrogen 2.813 N/A MET 91.A N VAL 111.A O no hydrogen 3.306 N/A GLU 93.A N THR 113.A O no hydrogen 2.694 N/A LEU 97.A N MET 95.A O no hydrogen 2.968 N/A ARG 99.A N SER 96.A O no hydrogen 2.718 N/A ARG 99.A NH1 GLN 226.A OE1 no hydrogen 2.478 N/A ARG 99.A NH2 ASN 71.A OD1 no hydrogen 2.868 N/A ARG 101.A N LEU 97.A O no hydrogen 2.755 N/A LEU 102.A N GLU 98.A O no hydrogen 2.634 N/A LEU 103.A N ARG 99.A O no hydrogen 2.969 N/A CYS 104.A N LYS 100.A O no hydrogen 2.841 N/A CYS 104.A SG LYS 100.A O no hydrogen 3.143 N/A GLY 105.A N ARG 101.A O no hydrogen 2.572 N/A LEU 106.A N LEU 102.A O no hydrogen 2.931 N/A GLY 107.A N CYS 104.A O no hydrogen 2.999 N/A VAL 108.A N LEU 103.A O no hydrogen 3.101 N/A ASN 109.A N ILE 87.A O no hydrogen 2.815 N/A ASN 109.A ND2 THR 88.A OG1 no hydrogen 2.943 N/A VAL 111.A N LEU 89.A O no hydrogen 3.110 N/A THR 113.A N MET 91.A O no hydrogen 3.046 N/A GLY 115.A N GLU 93.A OE2 no hydrogen 3.329 N/A LYS 117.A N GLU 114.A O no hydrogen 3.423 N/A GLY 118.A N GLY 115.A O no hydrogen 2.645 N/A GLY 121.A N LYS 117.A O no hydrogen 3.501 N/A ALA 122.A N GLY 118.A O no hydrogen 3.256 N/A ILE 123.A N MET 119.A O no hydrogen 2.835 N/A ALA 124.A N LYS 120.A O no hydrogen 2.920 N/A LYS 125.A N GLY 121.A O no hydrogen 3.102 N/A ALA 126.A N ALA 122.A O no hydrogen 2.898 N/A GLU 127.A N ILE 123.A O no hydrogen 2.904 N/A GLU 128.A N ALA 124.A O no hydrogen 2.830 N/A ILE 129.A N LYS 125.A O no hydrogen 2.879 N/A VAL 130.A N ALA 126.A O no hydrogen 2.900 N/A ALA 131.A N GLU 127.A O no hydrogen 2.910 N/A SER 132.A N ILE 129.A O no hydrogen 3.301 N/A SER 132.A OG ILE 129.A O no hydrogen 2.801 N/A ASP 133.A N VAL 130.A O no hydrogen 3.340 N/A SER 135.A N ASP 133.A OD1 no hydrogen 3.250 N/A ARG 136.A N ASP 133.A O no hydrogen 2.542 N/A TYR 137.A N ASP 133.A O no hydrogen 3.295 N/A VAL 138.A N GLU 63.A O no hydrogen 2.889 N/A LEU 140.A N ASP 66.A OD2 no hydrogen 2.866 N/A LYS 141.A N ASP 66.A OD2 no hydrogen 2.870 N/A GLU 144.A N LYS 141.A O no hydrogen 2.955 N/A ASN 145.A N LYS 141.A O no hydrogen 2.763 N/A ASN 145.A ND2 LEU 140.A O no hydrogen 2.742 N/A ALA 147.A N ASN 145.A OD1 no hydrogen 3.027 N/A ASN 148.A N ASN 145.A O no hydrogen 2.904 N/A ASN 148.A ND2 GLN 142.A O no hydrogen 3.018 N/A ASN 148.A ND2 THR 177.A OG1 no hydrogen 2.855 N/A GLN 150.A N PRO 146.A O no hydrogen 3.033 N/A GLN 150.A NE2 GLU 154.A OE2 no hydrogen 2.560 N/A ILE 151.A N ALA 147.A O no hydrogen 3.377 N/A ILE 151.A N ASN 148.A O no hydrogen 3.291 N/A HIS 152.A ND1 THR 156.A OG1 no hydrogen 2.871 N/A ARG 153.A N PRO 149.A O no hydrogen 2.981 N/A ARG 153.A NE ASP 191.A OD2 no hydrogen 2.850 N/A ARG 153.A NH2 ASP 191.A OD1 no hydrogen 2.899 N/A GLU 154.A N GLN 150.A O no hydrogen 3.019 N/A GLU 154.A N ILE 151.A O no hydrogen 3.206 N/A THR 155.A N ILE 151.A O no hydrogen 2.882 N/A THR 155.A OG1 ILE 151.A O no hydrogen 2.772 N/A THR 156.A OG1 HIS 152.A ND1 no hydrogen 2.871 N/A GLY 157.A N HIS 152.A O no hydrogen 2.802 N/A GLU 159.A N THR 155.A O no hydrogen 2.854 N/A ILE 160.A N THR 156.A O no hydrogen 3.140 N/A TRP 161.A N GLY 157.A O no hydrogen 2.958 N/A LYS 162.A N PRO 158.A O no hydrogen 2.885 N/A ASP 163.A N GLU 159.A O no hydrogen 2.908 N/A THR 164.A N ILE 160.A O no hydrogen 3.084 N/A THR 164.A OG1 ILE 160.A O no hydrogen 2.882 N/A THR 164.A OG1 TRP 161.A O no hydrogen 3.351 N/A ASP 165.A N LYS 162.A O no hydrogen 3.162 N/A GLY 166.A N TRP 161.A O no hydrogen 2.835 N/A LYS 167.A N THR 164.A O no hydrogen 2.976 N/A VAL 168.A N THR 164.A OG1 no hydrogen 3.232 N/A ASP 169.A N LEU 292.A O no hydrogen 2.898 N/A VAL 170.A N LEU 292.A O no hydrogen 3.114 N/A VAL 171.A N THR 197.A O no hydrogen 3.030 N/A VAL 172.A N VAL 294.A O no hydrogen 2.854 N/A ALA 173.A N VAL 199.A O no hydrogen 2.936 N/A VAL 175.A N VAL 201.A O no hydrogen 2.987 N/A GLY 179.A N THR 177.A OG1 no hydrogen 3.079 N/A THR 182.A N GLY 178.A O no hydrogen 2.996 N/A THR 182.A OG1 GLY 178.A O no hydrogen 2.941 N/A THR 182.A OG1 ASN 236.A O no hydrogen 2.948 N/A GLY 183.A N GLY 179.A O no hydrogen 2.912 N/A ILE 184.A N SER 180.A O no hydrogen 2.999 N/A SER 185.A N ILE 181.A O no hydrogen 2.999 N/A SER 185.A OG ILE 181.A O no hydrogen 2.687 N/A SER 185.A OG SER 198.A OG no hydrogen 2.688 N/A ARG 186.A N THR 182.A O no hydrogen 2.942 N/A ARG 186.A NE ASP 238.A OD2 no hydrogen 3.249 N/A ARG 186.A NH2 ASP 238.A OD2 no hydrogen 3.044 N/A ALA 187.A N GLY 183.A O no hydrogen 2.874 N/A ILE 188.A N ILE 184.A O no hydrogen 2.960 N/A LYS 189.A N SER 185.A O no hydrogen 2.884 N/A LYS 189.A NZ ILE 241.A O no hydrogen 2.807 N/A LYS 189.A NZ ASP 243.A OD2 no hydrogen 2.660 N/A LEU 190.A N ARG 186.A O no hydrogen 2.876 N/A ASP 191.A N ARG 186.A O no hydrogen 3.323 N/A ASP 191.A N ALA 187.A O no hydrogen 2.947 N/A PHE 192.A N ALA 187.A O no hydrogen 2.947 N/A LYS 194.A N ILE 188.A O no hydrogen 2.991 N/A LYS 194.A NZ GLY 166.A O no hydrogen 3.017 N/A LYS 194.A NZ VAL 168.A O no hydrogen 2.787 N/A LYS 194.A NZ ASP 169.A OD1 no hydrogen 3.056 N/A ILE 196.A N LYS 194.A O no hydrogen 2.928 N/A THR 197.A N ASP 169.A O no hydrogen 2.928 N/A SER 198.A N ASP 243.A OD2 no hydrogen 2.724 N/A SER 198.A OG SER 185.A OG no hydrogen 2.688 N/A VAL 199.A N VAL 171.A O no hydrogen 2.779 N/A ALA 200.A N ARG 244.A O no hydrogen 3.036 N/A VAL 201.A N ALA 173.A O no hydrogen 2.898 N/A GLU 202.A N GLU 246.A O no hydrogen 3.079 N/A VAL 204.A N VAL 248.A O no hydrogen 2.973 N/A GLU 205.A N GLU 205.A OE1 no hydrogen 2.807 N/A SER 206.A N PRO 203.A O no hydrogen 2.991 N/A SER 206.A OG GLY 221.A O no hydrogen 3.358 N/A VAL 208.A N SER 206.A O no hydrogen 2.972 N/A ILE 209.A N GLU 202.A OE1 no hydrogen 2.812 N/A SER 210.A N GLU 202.A OE2 no hydrogen 2.808 N/A SER 210.A OG GLU 202.A OE2 no hydrogen 2.450 N/A GLN 211.A N PRO 207.A O no hydrogen 2.946 N/A THR 212.A N VAL 208.A O no hydrogen 2.977 N/A THR 212.A OG1 VAL 208.A O no hydrogen 2.625 N/A LEU 213.A N ILE 209.A O no hydrogen 2.957 N/A ALA 214.A N SER 210.A O no hydrogen 3.103 N/A GLY 215.A N THR 212.A O no hydrogen 2.942 N/A GLU 216.A N GLN 211.A O no hydrogen 2.807 N/A LYS 219.A N GLN 211.A OE1 no hydrogen 2.887 N/A GLY 221.A N SER 206.A OG no hydrogen 3.045 N/A HIS 223.A NE2 GLY 229.A O no hydrogen 3.084 N/A LYS 224.A N SER 250.A OG no hydrogen 2.978 N/A ILE 225.A N HIS 223.A ND1 no hydrogen 2.922 N/A ILE 228.A N ILE 225.A O no hydrogen 3.254 N/A GLY 229.A N VAL 175.A O no hydrogen 3.344 N/A ASN 236.A N PHE 143.A O no hydrogen 2.985 N/A ASN 236.A ND2 GLN 142.A O no hydrogen 2.788 N/A ASN 236.A ND2 ASN 145.A O no hydrogen 3.073 N/A LEU 237.A N PRO 234.A O no hydrogen 3.005 N/A ASP 238.A N THR 182.A OG1 no hydrogen 2.906 N/A SER 240.A N ASP 238.A OD1 no hydrogen 3.068 N/A ILE 241.A N ASP 238.A O no hydrogen 3.179 N/A ILE 242.A N LEU 239.A O no hydrogen 3.099 N/A ASP 243.A N SER 198.A O no hydrogen 2.892 N/A ARG 244.A N SER 198.A O no hydrogen 3.160 N/A ARG 244.A NE GLU 246.A OE2 no hydrogen 2.585 N/A GLU 246.A N ALA 200.A O no hydrogen 2.937 N/A VAL 248.A N GLU 202.A O no hydrogen 2.982 N/A SER 250.A N GLU 205.A OE2 no hydrogen 2.914 N/A SER 250.A OG GLU 205.A OE2 no hydrogen 2.625 N/A THR 252.A N ASP 249.A OD2 no hydrogen 2.808 N/A THR 252.A OG1 ASP 249.A OD1 no hydrogen 2.694 N/A THR 252.A OG1 ASP 249.A OD2 no hydrogen 3.299 N/A ALA 253.A N ASP 249.A O no hydrogen 2.977 N/A LEU 254.A N SER 250.A O no hydrogen 2.915 N/A ALA 255.A N ASP 251.A O no hydrogen 2.752 N/A THR 256.A N THR 252.A O no hydrogen 2.782 N/A THR 256.A OG1 THR 252.A O no hydrogen 2.692 N/A ALA 257.A N ALA 253.A O no hydrogen 3.019 N/A ARG 258.A N LEU 254.A O no hydrogen 3.019 N/A ARG 258.A NE LEU 309.A O no hydrogen 2.884 N/A ARG 258.A NH2 LEU 309.A O no hydrogen 3.550 N/A ARG 259.A N ALA 255.A O no hydrogen 3.004 N/A ARG 259.A NE GLU 263.A OE1 no hydrogen 3.429 N/A ARG 259.A NE GLU 263.A OE2 no hydrogen 2.994 N/A ARG 259.A NH2 HIS 21.A O no hydrogen 2.993 N/A ARG 259.A NH2 GLU 263.A OE1 no hydrogen 3.019 N/A LEU 260.A N THR 256.A O no hydrogen 2.941 N/A MET 261.A N ALA 257.A O no hydrogen 3.189 N/A ALA 262.A N ARG 258.A O no hydrogen 2.937 N/A GLU 263.A N ARG 259.A O no hydrogen 2.690 N/A GLU 264.A N LEU 260.A O no hydrogen 3.064 N/A GLY 265.A N MET 261.A O no hydrogen 3.037 N/A ILE 266.A N LEU 260.A O no hydrogen 2.919 N/A GLY 269.A N SER 299.A O no hydrogen 3.046 N/A SER 272.A N GLY 269.A O no hydrogen 3.016 N/A SER 272.A OG SER 299.A O no hydrogen 3.503 N/A GLY 273.A N GLY 269.A O no hydrogen 3.251 N/A ALA 274.A N ILE 270.A O no hydrogen 3.088 N/A ALA 275.A N SER 271.A O no hydrogen 3.024 N/A VAL 276.A N SER 272.A O no hydrogen 3.014 N/A ALA 277.A N GLY 273.A O no hydrogen 2.891 N/A ALA 278.A N ALA 274.A O no hydrogen 3.125 N/A ALA 279.A N ALA 275.A O no hydrogen 2.977 N/A ASP 280.A N VAL 276.A O no hydrogen 2.726 N/A ARG 281.A N ALA 277.A O no hydrogen 3.158 N/A LEU 282.A N ALA 278.A O no hydrogen 3.166 N/A ALA 283.A N ALA 279.A O no hydrogen 2.778 N/A LYS 284.A N ASP 280.A O no hydrogen 3.087 N/A LYS 284.A N ARG 281.A O no hydrogen 3.265 N/A LYS 284.A NZ ASP 280.A OD1 no hydrogen 3.286 N/A LYS 284.A NZ ASP 280.A OD2 no hydrogen 2.744 N/A LEU 285.A N LEU 282.A O no hydrogen 2.919 N/A PHE 288.A N LEU 285.A O no hydrogen 2.760 N/A ALA 289.A N PRO 286.A O no hydrogen 3.164 N/A LYS 291.A N PHE 288.A O no hydrogen 3.110 N/A LEU 292.A N ASP 169.A OD2 no hydrogen 2.889 N/A ILE 293.A N ASN 27.A O no hydrogen 2.831 N/A VAL 294.A N VAL 170.A O no hydrogen 2.787 N/A VAL 295.A N VAL 29.A O no hydrogen 2.896 N/A ILE 296.A N VAL 172.A O no hydrogen 3.038 N/A LEU 297.A N LYS 31.A O no hydrogen 2.921 N/A SER 299.A OG TYR 304.A OH no hydrogen 2.533 N/A SER 301.A N LEU 267.A O no hydrogen 3.119 N/A TYR 304.A N SER 301.A O no hydrogen 2.658 N/A TYR 304.A OH SER 299.A OG no hydrogen 2.533 N/A SER 306.A OG LEU 305.A O no hydrogen 2.586 N/A THR 307.A N TYR 304.A O no hydrogen 3.332 N/A THR 307.A OG1 TYR 304.A O no hydrogen 2.679 N/A LEU 309.A N THR 307.A OG1 no hydrogen 3.088 N/A