Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6mku_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 205.A OE1 no hydrogen 3.506 N/A ALA 1.A N GLU 205.A OE2 no hydrogen 2.573 N/A VAL 6.A N LYS 44.A O no hydrogen 2.855 N/A ARG 7.A N ASP 65.A OD2 no hydrogen 3.107 N/A ARG 7.A NE LYS 63.A O no hydrogen 2.966 N/A ARG 7.A NH2 LYS 63.A O no hydrogen 2.821 N/A ILE 8.A N THR 46.A O no hydrogen 2.889 N/A GLY 9.A N ALA 66.A O no hydrogen 2.825 N/A THR 10.A N VAL 48.A O no hydrogen 2.970 N/A THR 10.A OG1 SER 18.A OG no hydrogen 2.815 N/A THR 10.A OG1 ILE 68.A O no hydrogen 2.783 N/A ALA 11.A N SER 69.A OG no hydrogen 2.846 N/A TYR 14.A N SER 18.A O no hydrogen 2.739 N/A PHE 17.A N TYR 14.A O no hydrogen 2.890 N/A SER 18.A N TYR 14.A O no hydrogen 3.055 N/A SER 18.A OG THR 10.A OG1 no hydrogen 2.815 N/A SER 19.A N ILE 27.A O no hydrogen 2.888 N/A ASP 21.A N GLU 25.A O no hydrogen 2.902 N/A LYS 23.A N ASP 21.A OD1 no hydrogen 2.790 N/A LYS 23.A NZ ASP 21.A OD2 no hydrogen 2.960 N/A LYS 23.A NZ GLU 25.A OE1 no hydrogen 3.534 N/A GLY 24.A N ASP 21.A O no hydrogen 3.053 N/A GLU 25.A N ASP 21.A OD1 no hydrogen 2.823 N/A ILE 27.A N SER 19.A O no hydrogen 2.843 N/A PHE 29.A N PRO 16.A O no hydrogen 3.009 N/A ASP 30.A N PHE 17.A O no hydrogen 2.887 N/A ASP 32.A N GLY 28.A O no hydrogen 2.921 N/A LEU 33.A N PHE 29.A O no hydrogen 2.826 N/A GLY 34.A N ASP 30.A O no hydrogen 2.850 N/A ASN 35.A N ILE 31.A O no hydrogen 2.812 N/A GLU 36.A N ASP 32.A O no hydrogen 2.956 N/A MET 37.A N LEU 33.A O no hydrogen 2.837 N/A CYS 38.A N GLY 34.A O no hydrogen 2.851 N/A CYS 38.A SG GLY 34.A O no hydrogen 3.119 N/A LYS 39.A N ASN 35.A O no hydrogen 2.992 N/A ARG 40.A N GLU 36.A O no hydrogen 3.229 N/A ARG 40.A NE GLU 36.A OE2 no hydrogen 2.842 N/A ARG 40.A NH1 ASP 220.A OD2 no hydrogen 3.205 N/A ARG 40.A NH2 GLU 36.A OE2 no hydrogen 3.115 N/A ARG 40.A NH2 ASP 220.A OD2 no hydrogen 2.830 N/A MET 41.A N MET 37.A O no hydrogen 2.820 N/A GLN 42.A N LYS 39.A O no hydrogen 3.235 N/A VAL 43.A N CYS 38.A O no hydrogen 3.210 N/A LYS 44.A N GLN 4.A O no hydrogen 3.329 N/A CYS 45.A SG VAL 6.A O no hydrogen 3.896 N/A THR 46.A N VAL 6.A O no hydrogen 3.020 N/A TRP 47.A NE1 ASN 35.A OD1 no hydrogen 2.915 N/A VAL 48.A N ILE 8.A O no hydrogen 2.802 N/A SER 50.A N THR 10.A O no hydrogen 3.031 N/A SER 50.A OG ASP 51.A O no hydrogen 2.826 N/A ALA 54.A N ASP 51.A O no hydrogen 3.104 N/A LEU 55.A N PHE 52.A O no hydrogen 3.064 N/A SER 58.A N ALA 54.A O no hydrogen 2.890 N/A SER 58.A OG ALA 54.A O no hydrogen 3.125 N/A LEU 59.A N LEU 55.A O no hydrogen 2.899 N/A LYS 60.A N ILE 56.A O no hydrogen 3.005 N/A LYS 60.A NZ GLU 80.A OE2 no hydrogen 2.980 N/A ALA 61.A N PRO 57.A O no hydrogen 2.990 N/A LYS 62.A N LEU 59.A O no hydrogen 3.045 N/A LYS 63.A N SER 58.A O no hydrogen 2.885 N/A ASP 65.A N ARG 7.A O no hydrogen 2.724 N/A ALA 66.A N ARG 7.A O no hydrogen 3.027 N/A ILE 67.A N GLY 198.A O no hydrogen 2.913 N/A ILE 68.A N GLY 9.A O no hydrogen 3.214 N/A SER 70.A OG TYR 88.A OH no hydrogen 2.688 N/A ILE 73.A N GLY 194.A O no hydrogen 2.823 N/A ARG 77.A N THR 74.A OG1 no hydrogen 3.014 N/A ARG 77.A NH1 SER 72.A O no hydrogen 2.999 N/A ARG 77.A NH2 GLY 119.A O no hydrogen 3.344 N/A GLN 78.A N THR 74.A O no hydrogen 3.103 N/A GLN 78.A N ASP 75.A O no hydrogen 3.191 N/A GLN 79.A N LYS 76.A O no hydrogen 3.257 N/A GLN 79.A NE2 ASP 75.A O no hydrogen 3.046 N/A GLU 80.A N ARG 77.A O no hydrogen 2.903 N/A ILE 81.A N ARG 77.A O no hydrogen 2.826 N/A ALA 82.A N LEU 199.A O no hydrogen 2.709 N/A SER 84.A N VAL 197.A O no hydrogen 2.977 N/A SER 84.A OG ASP 85.A O no hydrogen 2.754 N/A ASP 85.A N ASP 211.A OD1 no hydrogen 2.700 N/A LYS 86.A NZ TYR 236.A O no hydrogen 3.010 N/A LYS 86.A NZ ASP 238.A OXT no hydrogen 2.542 N/A LEU 87.A N THR 195.A O no hydrogen 2.711 N/A TYR 88.A OH ASP 30.A OD1 no hydrogen 2.480 N/A TYR 88.A OH ASP 30.A OD2 no hydrogen 3.334 N/A TYR 88.A OH SER 70.A OG no hydrogen 2.688 N/A ALA 89.A N VAL 235.A O no hydrogen 3.078 N/A ARG 93.A N GLN 160.A O no hydrogen 3.164 N/A ARG 93.A NE GLY 182.A O no hydrogen 2.706 N/A ARG 93.A NH1 GLU 162.A OE2 no hydrogen 2.853 N/A ARG 93.A NH2 GLY 182.A O no hydrogen 3.300 N/A ILE 95.A N ALA 158.A O no hydrogen 3.017 N/A ALA 96.A N ALA 179.A O no hydrogen 2.987 N/A LYS 98.A N GLU 177.A O no hydrogen 2.928 N/A SER 100.A N ALA 97.A O no hydrogen 2.972 N/A ILE 102.A N SER 100.A OG no hydrogen 3.056 N/A GLN 103.A N SER 108.A OG no hydrogen 2.933 N/A THR 105.A N GLN 103.A O no hydrogen 2.583 N/A SER 108.A N THR 105.A OG1 no hydrogen 3.166 N/A LEU 109.A N THR 105.A O no hydrogen 3.010 N/A LYS 110.A N LEU 106.A O no hydrogen 3.105 N/A LYS 112.A N LEU 109.A O no hydrogen 2.811 N/A HIS 113.A N ASP 156.A OD2 no hydrogen 2.919 N/A HIS 113.A ND1 ASP 136.A OD2 no hydrogen 2.631 N/A VAL 114.A N ASP 136.A O no hydrogen 2.956 N/A GLY 115.A N ALA 157.A O no hydrogen 2.854 N/A VAL 116.A N VAL 138.A O no hydrogen 3.015 N/A GLN 118.A N TYR 140.A O no hydrogen 2.738 N/A GLY 119.A N GLU 123.A OE1 no hydrogen 2.754 N/A SER 120.A N LEU 117.A O no hydrogen 3.078 N/A SER 120.A OG LEU 117.A O no hydrogen 2.688 N/A SER 120.A OG GLN 122.A OE1 no hydrogen 3.323 N/A GLN 122.A NE2 SER 92.A OG no hydrogen 2.917 N/A GLN 122.A NE2 ASP 161.A OD1 no hydrogen 2.744 N/A GLU 123.A N SER 120.A OG no hydrogen 2.923 N/A ALA 124.A N SER 120.A O no hydrogen 3.107 N/A TYR 125.A N THR 121.A O no hydrogen 3.018 N/A ALA 126.A N GLN 122.A O no hydrogen 3.008 N/A ASN 127.A N GLU 123.A O no hydrogen 2.776 N/A ASP 128.A N ALA 124.A O no hydrogen 3.186 N/A ASN 129.A N TYR 125.A O no hydrogen 2.902 N/A ASN 129.A ND2 TYR 125.A O no hydrogen 3.121 N/A TRP 130.A N ALA 126.A O no hydrogen 2.831 N/A ARG 131.A N ALA 126.A O no hydrogen 2.780 N/A THR 132.A OG1 ASP 128.A O no hydrogen 3.163 N/A LYS 133.A N TRP 130.A O no hydrogen 3.105 N/A GLY 134.A N ARG 131.A O no hydrogen 3.472 N/A VAL 135.A N TRP 130.A O no hydrogen 3.234 N/A ASP 136.A N LYS 112.A O no hydrogen 3.249 N/A VAL 137.A N VAL 135.A O no hydrogen 2.842 N/A VAL 138.A N VAL 114.A O no hydrogen 2.792 N/A TYR 140.A N VAL 116.A O no hydrogen 2.850 N/A TYR 140.A OH ASP 149.A OD2 no hydrogen 2.307 N/A GLN 143.A NE2 GLN 160.A OE1 no hydrogen 3.137 N/A LEU 145.A N ASN 142.A OD1 no hydrogen 2.989 N/A TYR 147.A N GLN 143.A O no hydrogen 3.091 N/A SER 148.A N ASP 144.A O no hydrogen 3.015 N/A SER 148.A OG ASP 144.A O no hydrogen 3.358 N/A ASP 149.A N LEU 145.A O no hydrogen 2.804 N/A LEU 150.A N ILE 146.A O no hydrogen 2.872 N/A THR 151.A N TYR 147.A O no hydrogen 3.071 N/A THR 151.A OG1 TYR 147.A O no hydrogen 3.324 N/A THR 151.A OG1 SER 148.A O no hydrogen 3.206 N/A ALA 152.A N SER 148.A O no hydrogen 3.047 N/A GLY 153.A N LEU 150.A O no hydrogen 2.932 N/A LEU 155.A N ASP 149.A O no hydrogen 2.962 N/A ASP 156.A N HIS 113.A O no hydrogen 2.826 N/A ALA 157.A N HIS 113.A O no hydrogen 3.190 N/A ALA 158.A N ILE 95.A O no hydrogen 3.181 N/A LEU 159.A N GLY 115.A O no hydrogen 2.978 N/A GLN 160.A NE2 ALA 158.A O no hydrogen 3.145 N/A ASP 161.A N TYR 14.A OH no hydrogen 2.875 N/A GLU 162.A N ASP 91.A O no hydrogen 2.764 N/A ALA 165.A N ASP 161.A O no hydrogen 3.030 N/A SER 166.A N GLU 162.A O no hydrogen 2.914 N/A GLU 167.A N VAL 163.A O no hydrogen 2.902 N/A GLY 168.A N ALA 164.A O no hydrogen 2.694 N/A PHE 169.A N ALA 165.A O no hydrogen 2.943 N/A LEU 170.A N ALA 165.A O no hydrogen 2.841 N/A LYS 171.A N SER 166.A O no hydrogen 2.945 N/A LYS 171.A NZ GLU 167.A OE1 no hydrogen 2.895 N/A LYS 171.A NZ GLU 167.A OE2 no hydrogen 2.899 N/A GLN 172.A N PHE 169.A O no hydrogen 2.931 N/A GLN 172.A NE2 GLU 167.A O no hydrogen 2.815 N/A GLY 175.A N GLN 172.A O no hydrogen 3.081 N/A LYS 176.A N PRO 173.A O no hydrogen 3.205 N/A TYR 178.A N GLY 175.A O no hydrogen 3.023 N/A ALA 179.A N ALA 96.A O no hydrogen 2.963 N/A ALA 181.A N LEU 94.A O no hydrogen 2.894 N/A SER 184.A OG GLU 162.A OE1 no hydrogen 3.087 N/A VAL 185.A N SER 92.A O no hydrogen 2.916 N/A TYR 190.A N ASP 187.A OD1 no hydrogen 3.264 N/A TYR 190.A OH ASP 128.A OD2 no hydrogen 2.392 N/A PHE 191.A N ASP 187.A O no hydrogen 3.107 N/A GLY 192.A N LYS 188.A O no hydrogen 3.123 N/A ASP 193.A N ILE 73.A O no hydrogen 3.009 N/A THR 195.A N TYR 88.A O no hydrogen 2.778 N/A THR 195.A OG1 TYR 88.A O no hydrogen 3.555 N/A GLY 196.A N LEU 71.A O no hydrogen 2.980 N/A VAL 197.A N SER 84.A OG no hydrogen 2.941 N/A GLY 198.A N ILE 67.A O no hydrogen 2.816 N/A LEU 199.A N ALA 82.A O no hydrogen 2.846 N/A ARG 200.A NH1 LEU 59.A O no hydrogen 2.857 N/A ARG 200.A NH1 ILE 64.A O no hydrogen 2.691 N/A ARG 200.A NH2 ASP 65.A OD1 no hydrogen 2.972 N/A LYS 201.A NZ GLN 79.A O no hydrogen 2.590 N/A ASP 203.A N ARG 200.A O no hydrogen 3.129 N/A LYS 207.A N ASP 203.A O no hydrogen 3.065 N/A LYS 207.A NZ PHE 83.A O no hydrogen 2.732 N/A LYS 207.A NZ ASP 211.A OD2 no hydrogen 2.938 N/A ALA 208.A N THR 204.A O no hydrogen 2.936 N/A ALA 209.A N GLU 205.A O no hydrogen 3.035 N/A PHE 210.A N LEU 206.A O no hydrogen 3.020 N/A ASP 211.A N LYS 207.A O no hydrogen 2.849 N/A LYS 212.A N ALA 208.A O no hydrogen 2.853 N/A LYS 212.A NZ GLU 216.A OE2 no hydrogen 2.575 N/A ALA 213.A N ALA 209.A O no hydrogen 3.014 N/A LEU 214.A N PHE 210.A O no hydrogen 2.865 N/A THR 215.A N ASP 211.A O no hydrogen 3.093 N/A THR 215.A OG1 ASP 211.A O no hydrogen 2.978 N/A GLU 216.A N LYS 212.A O no hydrogen 3.123 N/A LEU 217.A N ALA 213.A O no hydrogen 2.954 N/A ARG 218.A N LEU 214.A O no hydrogen 2.966 N/A GLN 219.A N THR 215.A O no hydrogen 2.830 N/A ASP 220.A N GLU 216.A O no hydrogen 3.095 N/A GLY 221.A N ARG 218.A O no hydrogen 3.352 N/A THR 222.A N ASP 220.A OD1 no hydrogen 2.997 N/A THR 222.A OG1 ASP 220.A OD1 no hydrogen 2.856 N/A THR 222.A OG1 ASP 220.A OD2 no hydrogen 3.389 N/A TYR 223.A N LEU 217.A O no hydrogen 2.861 N/A TYR 223.A OH LEU 87.A O no hydrogen 2.694 N/A LYS 225.A N GLY 221.A O no hydrogen 3.145 N/A MET 226.A N THR 222.A O no hydrogen 2.868 N/A ALA 227.A N TYR 223.A O no hydrogen 2.830 N/A LYS 228.A N ASP 224.A O no hydrogen 3.007 N/A LYS 229.A N MET 226.A O no hydrogen 3.295 N/A LYS 229.A NZ ASP 32.A OD2 no hydrogen 2.748 N/A LYS 229.A NZ MET 226.A O no hydrogen 2.905 N/A TYR 230.A N ALA 227.A O no hydrogen 2.898 N/A TYR 230.A OH ASP 32.A OD2 no hydrogen 2.717 N/A PHE 231.A N ALA 227.A O no hydrogen 2.821 N/A ASN 234.A ND2 GLY 237.A O no hydrogen 2.947 N/A GLY 237.A N ASN 234.A O no hydrogen 3.319 N/A