Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ck6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N HIS 29.A O no hydrogen 3.220 N/A HIS 5.A ND1 THR 16.A O no hydrogen 2.738 N/A TRP 6.A N TRP 27.A O no hydrogen 2.945 N/A TRP 6.A NE1 GLU 4.A OE1 no hydrogen 2.680 N/A ASP 7.A N THR 13.A O no hydrogen 2.804 N/A PHE 8.A N ASN 25.A O no hydrogen 2.667 N/A SER 9.A N ASP 7.A OD1 no hydrogen 2.776 N/A SER 9.A OG ASP 7.A OD1 no hydrogen 2.667 N/A THR 13.A N ASP 7.A O no hydrogen 3.219 N/A THR 13.A OG1 GLU 15.A OE1 no hydrogen 2.664 N/A GLU 15.A N HIS 5.A O no hydrogen 2.794 N/A THR 16.A OG1 THR 18.A OG1 no hydrogen 3.328 N/A THR 18.A N THR 16.A OG1 no hydrogen 3.289 N/A THR 18.A OG1 THR 16.A OG1 no hydrogen 3.328 N/A THR 18.A OG1 THR 18.A O no hydrogen 2.562 N/A ILE 22.A N ASN 44.A OD1 no hydrogen 2.985 N/A GLN 23.A N TYR 28.A OH no hydrogen 2.833 N/A ASN 25.A N GLY 96.A O no hydrogen 2.648 N/A HIS 26.A N GLN 23.A O no hydrogen 3.353 N/A HIS 26.A ND1 PRO 24.A O no hydrogen 3.130 N/A TRP 27.A N TRP 6.A O no hydrogen 2.839 N/A TRP 27.A NE1 SER 100.A OG no hydrogen 2.870 N/A TYR 28.A N LEU 98.A O no hydrogen 2.881 N/A HIS 29.A N GLU 4.A O no hydrogen 2.843 N/A HIS 29.A ND1 SER 100.A OG no hydrogen 2.712 N/A CYS 30.A N SER 100.A O no hydrogen 2.819 N/A GLU 31.A N PHE 2.A O no hydrogen 2.725 N/A ARG 32.A N ARG 102.A O no hydrogen 2.903 N/A ARG 32.A NH1 SER 88.A O no hydrogen 3.349 N/A ARG 32.A NH2 SER 88.A O no hydrogen 2.849 N/A HIS 34.A N GLU 31.A O no hydrogen 3.352 N/A ILE 37.A N HIS 34.A O no hydrogen 3.276 N/A ARG 38.A NH1 ASP 52.A OD1 no hydrogen 2.717 N/A ARG 38.A NH2 GLU 42.A OE1 no hydrogen 3.021 N/A ARG 38.A NH2 ASP 52.A OD1 no hydrogen 2.949 N/A TRP 40.A N ASP 36.A O no hydrogen 3.312 N/A TRP 40.A NE1 ALA 19.A O no hydrogen 2.938 N/A LEU 41.A N ILE 37.A O no hydrogen 3.122 N/A GLU 42.A N ARG 38.A O no hydrogen 2.927 N/A ASP 43.A N GLY 39.A O no hydrogen 2.957 N/A ASN 44.A N TRP 40.A O no hydrogen 3.028 N/A ASN 44.A ND2 GLU 20.A O no hydrogen 3.012 N/A ASN 44.A ND2 TRP 40.A O no hydrogen 2.805 N/A HIS 45.A N GLU 42.A O no hydrogen 2.858 N/A VAL 46.A N LEU 41.A O no hydrogen 2.978 N/A VAL 51.A N PRO 47.A O no hydrogen 2.991 N/A ASP 52.A N ARG 48.A O no hydrogen 2.752 N/A HIS 53.A N ALA 49.A O no hydrogen 3.142 N/A LEU 54.A N THR 50.A O no hydrogen 2.969 N/A LEU 55.A N VAL 51.A O no hydrogen 2.953 N/A ALA 56.A N HIS 53.A O no hydrogen 3.345 N/A SER 59.A OG SER 88.A OG no hydrogen 3.390 N/A SER 62.A N ILE 73.A O no hydrogen 3.057 N/A SER 62.A OG ARG 60.A O no hydrogen 2.749 N/A SER 62.A OG HIS 64.A NE2 no hydrogen 2.987 N/A HIS 64.A NE2 SER 62.A OG no hydrogen 2.987 N/A LEU 66.A N ASN 70.A O no hydrogen 2.867 N/A ASN 70.A N ASP 67.A O no hydrogen 2.838 N/A PHE 71.A N TYR 93.A O no hydrogen 2.988 N/A ILE 73.A N SER 62.A O no hydrogen 2.895 N/A LEU 74.A N ILE 89.A O no hydrogen 2.979 N/A ARG 75.A N GLN 180.A OE1 no hydrogen 2.763 N/A ARG 75.A NH2 SER 59.A O no hydrogen 3.284 N/A GLY 76.A N LEU 87.A O no hydrogen 2.886 N/A ASN 78.A N PRO 84.A O no hydrogen 3.060 N/A ASN 78.A ND2 ASP 86.A O no hydrogen 3.163 N/A ASN 79.A ND2 ASN 78.A OD1 no hydrogen 3.108 N/A ASN 79.A ND2 PRO 105.A O no hydrogen 3.011 N/A ALA 82.A N ASN 79.A O no hydrogen 3.151 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 2.801 N/A ASP 86.A N SER 83.A O no hydrogen 2.879 N/A LEU 87.A N GLY 76.A O no hydrogen 2.906 N/A SER 88.A OG SER 59.A OG no hydrogen 3.390 N/A ILE 89.A N LEU 74.A O no hydrogen 2.783 N/A ARG 90.A N THR 101.A O no hydrogen 3.173 N/A ARG 90.A NE SER 88.A OG no hydrogen 3.020 N/A ARG 90.A NH1 LEU 54.A O no hydrogen 2.781 N/A ARG 90.A NH1 ALA 56.A O no hydrogen 2.738 N/A ARG 90.A NH2 ALA 56.A O no hydrogen 3.145 N/A ILE 91.A N LEU 72.A O no hydrogen 2.729 N/A LEU 92.A N ILE 99.A O no hydrogen 2.788 N/A TYR 93.A N PHE 71.A O no hydrogen 2.895 N/A TYR 93.A OH GLU 193.A OE2 no hydrogen 2.646 N/A PHE 94.A N ALA 97.A O no hydrogen 2.801 N/A GLN 95.A N ASN 70.A OD1 no hydrogen 2.845 N/A ALA 97.A N PHE 94.A O no hydrogen 3.008 N/A LEU 98.A N HIS 26.A O no hydrogen 2.943 N/A ILE 99.A N LEU 92.A O no hydrogen 2.801 N/A SER 100.A N TYR 28.A O no hydrogen 2.789 N/A SER 100.A OG HIS 29.A ND1 no hydrogen 2.712 N/A THR 101.A N ARG 90.A O no hydrogen 2.907 N/A THR 101.A OG1 ARG 90.A O no hydrogen 3.062 N/A ARG 102.A N CYS 30.A O no hydrogen 2.894 N/A ARG 102.A NE GLU 31.A OE1 no hydrogen 3.323 N/A ARG 102.A NE GLU 31.A OE2 no hydrogen 3.352 N/A ARG 102.A NH2 GLU 31.A OE2 no hydrogen 2.855 N/A ILE 109.A N SER 106.A OG no hydrogen 3.147 N/A ILE 111.A N ALA 108.A O no hydrogen 3.058 N/A ARG 112.A N ILE 109.A O no hydrogen 2.920 N/A ARG 112.A NE GLU 4.A OE1 no hydrogen 3.447 N/A ARG 112.A NE GLU 4.A OE2 no hydrogen 3.461 N/A ARG 112.A NH2 GLU 4.A OE2 no hydrogen 2.957 N/A ALA 114.A N GLU 110.A O no hydrogen 2.970 N/A LEU 115.A N ILE 111.A O no hydrogen 3.023 N/A ALA 116.A N ARG 112.A O no hydrogen 2.994 N/A GLU 117.A N ALA 114.A O no hydrogen 3.016 N/A HIS 118.A N LEU 115.A O no hydrogen 3.192 N/A LYS 119.A N ALA 114.A O no hydrogen 2.900 N/A SER 126.A N SER 123.A OG no hydrogen 2.985 N/A LEU 127.A N SER 123.A O no hydrogen 2.896 N/A LEU 128.A N LEU 124.A O no hydrogen 2.991 N/A ASN 129.A N ALA 125.A O no hydrogen 3.304 N/A GLN 130.A N SER 126.A O no hydrogen 2.813 N/A ILE 131.A N LEU 127.A O no hydrogen 2.876 N/A ILE 132.A N LEU 128.A O no hydrogen 3.008 N/A GLU 133.A N ASN 129.A O no hydrogen 3.007 N/A GLY 134.A N GLN 130.A O no hydrogen 2.740 N/A LEU 135.A N ILE 131.A O no hydrogen 2.936 N/A ASN 136.A N ILE 132.A O no hydrogen 2.941 N/A ASN 136.A ND2 GLU 133.A OE1 no hydrogen 2.884 N/A ASN 136.A ND2 ALA 205.A O no hydrogen 3.369 N/A GLY 137.A N GLU 133.A O no hydrogen 2.836 N/A LYS 138.A N GLY 134.A O no hydrogen 3.123 N/A LYS 138.A NZ GLU 110.A OE1 no hydrogen 3.404 N/A LYS 138.A NZ GLU 110.A OE2 no hydrogen 2.835 N/A ILE 139.A N LEU 135.A O no hydrogen 3.078 N/A ASP 140.A N ASN 136.A O no hydrogen 2.878 N/A LEU 141.A N GLY 137.A O no hydrogen 2.986 N/A TYR 142.A N LYS 138.A O no hydrogen 3.067 N/A LEU 143.A N ILE 139.A O no hydrogen 2.930 N/A ASP 144.A N ASP 140.A O no hydrogen 3.015 N/A ASP 144.A N LEU 141.A O no hydrogen 3.194 N/A THR 145.A N TYR 142.A O no hydrogen 2.860 N/A THR 145.A OG1 TYR 142.A O no hydrogen 2.439 N/A ILE 146.A N TYR 142.A O no hydrogen 3.210 N/A GLU 147.A N LEU 143.A O no hydrogen 2.898 N/A GLU 148.A N ASP 144.A O no hydrogen 3.053 N/A THR 149.A N THR 145.A O no hydrogen 3.174 N/A THR 149.A OG1 THR 145.A O no hydrogen 3.092 N/A LEU 150.A N ILE 146.A O no hydrogen 2.885 N/A ASN 151.A N GLU 147.A O no hydrogen 2.857 N/A GLU 152.A N THR 149.A O no hydrogen 3.234 N/A PHE 153.A N LEU 150.A O no hydrogen 3.132 N/A ASP 154.A N THR 160.A OG1 no hydrogen 2.827 N/A ASN 156.A N ASP 154.A OD2 no hydrogen 3.136 N/A ASP 157.A N ASP 154.A O no hydrogen 2.929 N/A SER 159.A OG ASP 157.A OD1 no hydrogen 2.892 N/A SER 159.A OG ASP 157.A OD2 no hydrogen 3.424 N/A THR 160.A N ASP 157.A O no hydrogen 2.826 N/A THR 160.A OG1 ASP 154.A O no hydrogen 2.956 N/A THR 160.A OG1 ASP 157.A O no hydrogen 2.693 N/A TYR 161.A N GLU 158.A O no hydrogen 3.186 N/A TYR 161.A OH VAL 155.A O no hydrogen 2.715 N/A ASN 162.A N THR 160.A O no hydrogen 2.707 N/A ALA 166.A N ASN 162.A O no hydrogen 3.164 N/A GLN 167.A N HIS 163.A O no hydrogen 2.938 N/A GLN 167.A NE2 GLN 227.A OE1 no hydrogen 2.587 N/A LYS 168.A N ILE 164.A O no hydrogen 2.967 N/A ALA 169.A N ALA 165.A O no hydrogen 2.974 N/A LEU 170.A N ALA 166.A O no hydrogen 2.928 N/A ILE 171.A N GLN 167.A O no hydrogen 2.973 N/A SER 172.A N LYS 168.A O no hydrogen 3.189 N/A SER 172.A OG LYS 168.A O no hydrogen 2.892 N/A ILE 173.A N ALA 169.A O no hydrogen 3.078 N/A LYS 174.A N LEU 170.A O no hydrogen 2.891 N/A LYS 174.A NZ GLU 217.A OE1 no hydrogen 2.706 N/A ARG 175.A N ILE 171.A O no hydrogen 3.076 N/A PHE 176.A N ILE 173.A O no hydrogen 3.002 N/A ILE 177.A N ILE 173.A O no hydrogen 2.798 N/A ARG 178.A N LYS 174.A O no hydrogen 3.212 N/A GLN 180.A N PHE 176.A O no hydrogen 3.063 N/A GLN 180.A NE2 ARG 75.A O no hydrogen 3.024 N/A GLN 181.A N ILE 177.A O no hydrogen 3.325 N/A ALA 183.A N PRO 179.A O no hydrogen 2.811 N/A ILE 184.A N GLN 180.A O no hydrogen 3.011 N/A ARG 185.A N GLN 181.A O no hydrogen 2.901 N/A ARG 185.A NE ASP 186.A OD1 no hydrogen 3.051 N/A ARG 185.A NH2 ASP 186.A OD1 no hydrogen 2.908 N/A ASP 186.A N TYR 182.A O no hydrogen 2.798 N/A LEU 187.A N ALA 183.A O no hydrogen 2.856 N/A ILE 188.A N ILE 184.A O no hydrogen 3.093 N/A GLU 189.A N ARG 185.A O no hydrogen 3.042 N/A SER 190.A N ASP 186.A O no hydrogen 3.045 N/A SER 190.A N LEU 187.A O no hydrogen 3.266 N/A SER 190.A OG LEU 187.A O no hydrogen 2.719 N/A GLU 191.A N ILE 188.A O no hydrogen 3.311 N/A SER 192.A N SER 190.A OG no hydrogen 3.158 N/A LEU 194.A N SER 192.A OG no hydrogen 3.049 N/A VAL 195.A N SER 192.A O no hydrogen 2.797 N/A THR 196.A N SER 192.A O no hydrogen 2.890 N/A THR 196.A OG1 SER 192.A O no hydrogen 3.277 N/A SER 197.A OG GLU 193.A O no hydrogen 3.039 N/A ARG 198.A N VAL 195.A O no hydrogen 2.884 N/A ARG 198.A NE ASN 129.A OD1 no hydrogen 2.792 N/A ARG 198.A NH2 ASN 129.A OD1 no hydrogen 2.892 N/A GLN 201.A N GLN 201.A OE1 no hydrogen 2.902 N/A TYR 202.A N ARG 198.A O no hydrogen 3.054 N/A TYR 202.A OH ALA 125.A O no hydrogen 3.103 N/A ARG 203.A N PRO 199.A O no hydrogen 3.046 N/A PHE 204.A N HIS 200.A O no hydrogen 2.982 N/A ALA 205.A N GLN 201.A O no hydrogen 3.113 N/A HIS 206.A N TYR 202.A O no hydrogen 3.002 N/A ASN 207.A N ARG 203.A O no hydrogen 2.907 N/A ASN 208.A N PHE 204.A O no hydrogen 2.919 N/A ASN 208.A ND2 GLU 133.A OE1 no hydrogen 3.222 N/A ASN 208.A ND2 GLU 133.A OE2 no hydrogen 3.326 N/A ILE 209.A N ALA 205.A O no hydrogen 3.082 N/A THR 210.A N HIS 206.A O no hydrogen 3.003 N/A THR 210.A OG1 HIS 206.A O no hydrogen 2.846 N/A ARG 211.A N ASN 207.A O no hydrogen 2.943 N/A ARG 211.A NH1 ASP 140.A OD2 no hydrogen 2.876 N/A ARG 211.A NH1 ASN 208.A OD1 no hydrogen 3.132 N/A ARG 211.A NH2 ASP 140.A OD1 no hydrogen 2.818 N/A ARG 211.A NH2 ASP 140.A OD2 no hydrogen 3.427 N/A ILE 212.A N ASN 208.A O no hydrogen 2.979 N/A ASN 213.A N ILE 209.A O no hydrogen 3.118 N/A ASN 213.A ND2 ILE 177.A O no hydrogen 3.088 N/A ASN 213.A ND2 ILE 209.A O no hydrogen 3.172 N/A GLU 214.A N THR 210.A O no hydrogen 2.945 N/A THR 215.A N ARG 211.A O no hydrogen 2.785 N/A THR 215.A OG1 ARG 211.A O no hydrogen 3.175 N/A ILE 216.A N ILE 212.A O no hydrogen 2.897 N/A GLU 217.A N ASN 213.A O no hydrogen 3.086 N/A PHE 218.A N GLU 214.A O no hydrogen 3.009 N/A TYR 219.A N THR 215.A O no hydrogen 2.946 N/A LEU 220.A N ILE 216.A O no hydrogen 3.025 N/A GLY 221.A N GLU 217.A O no hydrogen 3.071 N/A GLU 222.A N PHE 218.A O no hydrogen 2.882 N/A VAL 223.A N TYR 219.A O no hydrogen 2.849 N/A ALA 224.A N LEU 220.A O no hydrogen 2.846 N/A LEU 225.A N GLY 221.A O no hydrogen 3.049 N/A PHE 226.A N GLU 222.A O no hydrogen 2.988 N/A GLN 227.A N VAL 223.A O no hydrogen 3.028 N/A ASP 228.A N ALA 224.A O no hydrogen 3.170 N/A GLU 229.A N LEU 225.A O no hydrogen 2.785 N/A ILE 230.A N PHE 226.A O no hydrogen 2.906 N/A LYS 231.A N GLN 227.A O no hydrogen 3.112 N/A LYS 231.A NZ GLN 227.A O no hydrogen 3.007 N/A HIS 232.A N ASP 228.A O no hydrogen 2.815 N/A ASN 233.A N GLU 229.A O no hydrogen 2.861 N/A ARG 234.A N ILE 230.A O no hydrogen 2.917 N/A ASP 235.A N LYS 231.A O no hydrogen 3.364 N/A GLU 236.A N HIS 232.A O no hydrogen 2.958 N/A GLU 236.A N ASN 233.A O no hydrogen 3.271 N/A LYS 237.A N ASN 233.A O no hydrogen 2.864 N/A