Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6exe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N GLU 171.A OE2 no hydrogen 3.071 N/A THR 7.A N GLU 10.A OE2 no hydrogen 2.979 N/A PHE 11.A N THR 7.A O no hydrogen 2.868 N/A ALA 12.A N PRO 8.A O no hydrogen 2.841 N/A ARG 13.A N MET 9.A O no hydrogen 3.029 N/A LYS 14.A N GLU 10.A O no hydrogen 2.875 N/A TYR 15.A N PHE 11.A O no hydrogen 3.147 N/A ASN 16.A N ARG 13.A O no hydrogen 2.942 N/A LEU 17.A N ALA 12.A O no hydrogen 2.869 N/A ARG 19.A N GLY 34.A O no hydrogen 2.889 N/A ARG 19.A NH1 ILE 35.A O no hydrogen 3.203 N/A LYS 20.A NZ LEU 218.A O no hydrogen 3.517 N/A ALA 23.A N ASP 22.A OD1 no hydrogen 2.812 N/A GLY 28.A N GLU 30.A OE1 no hydrogen 2.935 N/A GLU 29.A N VAL 26.A O no hydrogen 3.110 N/A GLU 30.A N GLU 30.A OE1 no hydrogen 2.869 N/A THR 32.A OG1 GLU 29.A O no hydrogen 2.850 N/A GLY 34.A N ARG 19.A O no hydrogen 2.859 N/A ARG 36.A N LEU 17.A O no hydrogen 2.901 N/A ALA 40.A N ARG 36.A O no hydrogen 3.057 N/A LYS 41.A N ARG 37.A O no hydrogen 3.039 N/A ARG 42.A N GLY 38.A O no hydrogen 3.072 N/A ARG 42.A NH2 ASP 39.A OD1 no hydrogen 2.942 N/A VAL 43.A N ASP 39.A O no hydrogen 2.922 N/A PHE 44.A N ALA 40.A O no hydrogen 2.714 N/A THR 45.A N LYS 41.A O no hydrogen 2.828 N/A THR 45.A OG1 LYS 41.A O no hydrogen 2.705 N/A MET 46.A N ARG 42.A O no hydrogen 3.042 N/A GLN 47.A N VAL 43.A O no hydrogen 3.123 N/A GLN 47.A NE2 SER 170.A O no hydrogen 3.016 N/A LEU 48.A N THR 45.A O no hydrogen 3.095 N/A TRP 52.A N ALA 122.A O no hydrogen 2.767 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.858 N/A GLU 57.A N GLY 54.A O no hydrogen 3.168 N/A CYS 58.A N PHE 55.A O no hydrogen 3.020 N/A CYS 58.A SG GLY 54.A O no hydrogen 3.902 N/A CYS 58.A SG PHE 55.A O no hydrogen 3.582 N/A GLN 61.A N GLN 61.A OE1 no hydrogen 2.477 N/A GLN 61.A NE2 ASP 153.A OD2 no hydrogen 3.079 N/A ALA 62.A N SER 59.A OG no hydrogen 2.981 N/A TYR 63.A N SER 59.A O no hydrogen 2.910 N/A ALA 64.A N PRO 60.A O no hydrogen 2.914 N/A LEU 65.A N GLN 61.A O no hydrogen 2.917 N/A SER 66.A N ALA 62.A O no hydrogen 2.751 N/A SER 66.A OG ALA 62.A O no hydrogen 2.722 N/A ALA 67.A N TYR 63.A O no hydrogen 2.891 N/A VAL 68.A N ALA 64.A O no hydrogen 2.791 N/A PHE 69.A N LEU 65.A O no hydrogen 2.783 N/A MET 70.A N SER 66.A O no hydrogen 2.860 N/A ALA 71.A N ALA 67.A O no hydrogen 3.134 N/A ARG 72.A N VAL 68.A O no hydrogen 3.172 N/A ARG 72.A NE ASP 138.A OD2 no hydrogen 2.609 N/A MET 73.A N PHE 69.A O no hydrogen 2.915 N/A ASN 74.A N MET 70.A O no hydrogen 2.928 N/A ARG 75.A N ARG 72.A O no hydrogen 2.913 N/A ASP 76.A N ALA 71.A O no hydrogen 2.830 N/A ARG 77.A NH1 ARG 75.A O no hydrogen 3.170 N/A ALA 79.A N ASP 76.A OD1 no hydrogen 2.878 N/A ALA 80.A N ASP 76.A O no hydrogen 3.178 N/A ASN 81.A N ARG 77.A O no hydrogen 2.575 N/A ASN 82.A N ASP 78.A O no hydrogen 2.615 N/A ILE 83.A N ALA 79.A O no hydrogen 3.171 N/A LEU 84.A N ALA 80.A O no hydrogen 3.041 N/A LYS 85.A N ASN 81.A O no hydrogen 2.676 N/A VAL 86.A N ASN 82.A O no hydrogen 2.725 N/A LEU 87.A N ILE 83.A O no hydrogen 2.729 N/A ASP 88.A N LEU 84.A O no hydrogen 2.782 N/A LYS 89.A N LYS 85.A O no hydrogen 2.929 N/A THR 90.A N VAL 86.A O no hydrogen 3.075 N/A THR 90.A OG1 VAL 86.A O no hydrogen 1.922 N/A PHE 91.A N LEU 87.A O no hydrogen 2.765 N/A VAL 92.A N ASP 88.A O no hydrogen 3.009 N/A ASP 93.A N LYS 89.A O no hydrogen 3.263 N/A SER 99.A OG ASP 97.A OD1 no hydrogen 2.233 N/A VAL 100.A N ASP 97.A O no hydrogen 3.188 N/A ALA 101.A N PHE 98.A O no hydrogen 2.671 N/A ARG 102.A N SER 99.A O no hydrogen 2.934 N/A MET 105.A N ALA 101.A O no hydrogen 2.851 N/A LYS 106.A N ARG 102.A O no hydrogen 3.012 N/A LYS 107.A N PRO 103.A O no hydrogen 3.251 N/A LYS 107.A N VAL 104.A O no hydrogen 3.182 N/A LYS 107.A NZ TYR 108.A OH no hydrogen 3.432 N/A TYR 108.A N VAL 104.A O no hydrogen 3.340 N/A TYR 108.A OH ASP 76.A OD2 no hydrogen 2.901 N/A GLN 109.A N MET 105.A O no hydrogen 3.229 N/A SER 111.A N TYR 108.A O no hydrogen 3.072 N/A SER 111.A OG ASN 74.A OD1 no hydrogen 3.095 N/A SER 111.A OG TYR 108.A O no hydrogen 2.322 N/A GLN 115.A N SER 111.A O no hydrogen 3.036 N/A GLN 115.A NE2 GLN 109.A O no hydrogen 3.046 N/A GLU 116.A N GLU 112.A O no hydrogen 3.012 N/A VAL 117.A N LEU 113.A O no hydrogen 3.287 N/A VAL 118.A N VAL 114.A O no hydrogen 2.917 N/A ALA 119.A N GLN 115.A O no hydrogen 3.111 N/A LYS 120.A N VAL 117.A O no hydrogen 3.147 N/A LYS 120.A NZ GLU 116.A OE2 no hydrogen 2.769 N/A HIS 121.A ND1 GLU 182.A OE1 no hydrogen 2.624 N/A ALA 122.A N GLU 182.A OE2 no hydrogen 2.823 N/A TYR 123.A N THR 126.A OG1 no hydrogen 3.253 N/A TYR 123.A OH LEU 190.A O no hydrogen 2.623 N/A VAL 124.A N PRO 50.A O no hydrogen 3.081 N/A THR 126.A OG1 TYR 123.A O no hydrogen 3.296 N/A THR 126.A OG1 GLU 182.A OE1 no hydrogen 2.728 N/A VAL 127.A N TYR 123.A O no hydrogen 2.806 N/A ILE 128.A N VAL 124.A O no hydrogen 3.030 N/A ALA 129.A N LEU 125.A O no hydrogen 3.027 N/A SER 130.A N THR 126.A O no hydrogen 3.240 N/A SER 130.A OG HIS 121.A NE2 no hydrogen 2.917 N/A LEU 131.A N VAL 127.A O no hydrogen 2.811 N/A LEU 132.A N ILE 128.A O no hydrogen 2.753 N/A GLU 133.A N ALA 129.A O no hydrogen 3.011 N/A ALA 134.A N SER 130.A O no hydrogen 3.001 N/A ALA 135.A N LEU 131.A O no hydrogen 2.825 N/A ARG 136.A N LEU 132.A O no hydrogen 3.218 N/A ARG 136.A NE VAL 141.A O no hydrogen 3.078 N/A ARG 136.A NH1 VAL 163.A O no hydrogen 3.164 N/A ARG 136.A NH2 VAL 141.A O no hydrogen 2.611 N/A GLU 137.A N ALA 134.A O no hydrogen 2.979 N/A GLU 145.A N PRO 142.A O no hydrogen 2.950 N/A PHE 146.A N SER 143.A O no hydrogen 3.104 N/A LEU 149.A N PHE 146.A O no hydrogen 2.897 N/A LYS 150.A N LEU 147.A O no hydrogen 3.131 N/A LYS 150.A NZ ALA 3.A O no hydrogen 3.218 N/A VAL 152.A N TRP 148.A O no hydrogen 3.321 N/A ASP 153.A N LEU 149.A O no hydrogen 2.698 N/A ARG 154.A NE GLU 171.A OE1 no hydrogen 3.559 N/A ARG 154.A NH1 ALA 3.A O no hydrogen 3.412 N/A ARG 154.A NH2 MET 4.A O no hydrogen 3.064 N/A ARG 154.A NH2 GLU 171.A OE1 no hydrogen 3.203 N/A ARG 154.A NH2 GLU 171.A OE2 no hydrogen 3.313 N/A LEU 156.A N ASP 153.A OD1 no hydrogen 3.307 N/A TRP 157.A N ASP 153.A O no hydrogen 2.989 N/A TYR 158.A N ARG 154.A O no hydrogen 2.783 N/A MET 159.A N ARG 155.A O no hydrogen 2.699 N/A LEU 160.A N LEU 156.A O no hydrogen 2.884 N/A ASN 161.A N TRP 157.A O no hydrogen 2.910 N/A ASN 161.A ND2 SER 143.A OG no hydrogen 2.565 N/A CYS 162.A N TYR 158.A O no hydrogen 3.275 N/A CYS 162.A N MET 159.A O no hydrogen 3.182 N/A CYS 162.A SG TYR 158.A O no hydrogen 3.308 N/A VAL 163.A N LEU 160.A O no hydrogen 3.377 N/A ARG 165.A N CYS 162.A O no hydrogen 3.042 N/A ARG 165.A NE THR 167.A O no hydrogen 3.386 N/A ARG 165.A NH2 THR 167.A O no hydrogen 3.209 N/A VAL 172.A N TYR 169.A O no hydrogen 3.027 N/A ALA 173.A N SER 170.A O no hydrogen 3.155 N/A GLY 174.A N GLN 47.A OE1 no hydrogen 2.987 N/A PHE 176.A N VAL 172.A O no hydrogen 2.909 N/A ALA 177.A N ALA 173.A O no hydrogen 2.890 N/A HIS 178.A N GLY 174.A O no hydrogen 2.857 N/A HIS 178.A NE2 GLU 182.A OE2 no hydrogen 3.154 N/A TRP 179.A N PRO 175.A O no hydrogen 2.983 N/A TRP 179.A NE1 SER 130.A OG no hydrogen 2.790 N/A LYS 180.A N PHE 176.A O no hydrogen 3.167 N/A LYS 180.A NZ GLU 184.A OE2 no hydrogen 3.011 N/A LYS 180.A NZ GLU 196.A OE1 no hydrogen 3.458 N/A ALA 181.A N ALA 177.A O no hydrogen 2.849 N/A GLU 182.A N HIS 178.A O no hydrogen 2.868 N/A LYS 183.A N TRP 179.A O no hydrogen 3.012 N/A LYS 183.A NZ GLU 133.A OE1 no hydrogen 2.950 N/A GLU 184.A N LYS 180.A O no hydrogen 2.870 N/A MET 185.A N ALA 181.A O no hydrogen 2.773 N/A GLY 186.A N GLU 182.A O no hydrogen 2.940 N/A ARG 187.A NH1 ARG 188.A O no hydrogen 2.733 N/A ARG 188.A NH1 ALA 119.A O no hydrogen 3.263 N/A SER 189.A N GLU 182.A OE2 no hydrogen 3.059 N/A SER 189.A OG VAL 191.A O no hydrogen 2.735 N/A MET 193.A N HIS 178.A ND1 no hydrogen 2.947 N/A ALA 197.A N ILE 194.A O no hydrogen 2.984 N/A ILE 198.A N ILE 194.A O no hydrogen 3.458 N/A ARG 199.A N ASP 195.A O no hydrogen 2.976 N/A ALA 200.A N GLU 196.A O no hydrogen 2.895 N/A LEU 201.A N ALA 197.A O no hydrogen 3.052 N/A GLU 202.A N ILE 198.A O no hydrogen 3.089 N/A ILE 203.A N ARG 199.A O no hydrogen 3.131 N/A ALA 204.A N ALA 200.A O no hydrogen 3.037 N/A VAL 205.A N LEU 201.A O no hydrogen 2.857 N/A LYS 206.A N GLU 202.A O no hydrogen 3.030 N/A LYS 206.A NZ GLU 29.A OE1 no hydrogen 3.532 N/A GLU 207.A N ALA 204.A O no hydrogen 3.244 N/A VAL 208.A N VAL 205.A O no hydrogen 3.174 N/A ARG 209.A NH1 GLU 30.A O no hydrogen 2.754 N/A LEU 210.A N MET 31.A O no hydrogen 2.712 N/A THR 211.A N GLN 214.A OE1 no hydrogen 2.727 N/A THR 211.A OG1 GLN 214.A OE1 no hydrogen 3.181 N/A GLN 214.A N THR 211.A OG1 no hydrogen 2.938 N/A MET 215.A N THR 211.A O no hydrogen 2.898 N/A GLU 216.A N PRO 212.A O no hydrogen 3.079 N/A LEU 218.A N MET 215.A O no hydrogen 3.327 N/A