Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zml_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N ASP 56.A O no hydrogen 2.915 N/A LEU 3.A N GLU 27.A O no hydrogen 2.771 N/A TYR 4.A N VAL 54.A O no hydrogen 2.812 N/A THR 5.A N LYS 29.A O no hydrogen 2.986 N/A HIS 7.A ND1 GLU 16.A OE2 no hydrogen 2.808 N/A SER 9.A N LEU 6.A O no hydrogen 2.928 N/A CYS 12.A SG THR 5.A OG1 no hydrogen 3.222 N/A CYS 12.A SG SER 9.A OG no hydrogen 3.474 N/A ARG 13.A N SER 9.A O no hydrogen 3.008 N/A ARG 13.A NE HIS 7.A O no hydrogen 2.873 N/A ARG 13.A NH1 SER 161.A O no hydrogen 3.039 N/A ARG 13.A NH1 ASN 197.A OD1 no hydrogen 2.889 N/A ARG 13.A NH2 LEU 8.A O no hydrogen 2.875 N/A ARG 13.A NH2 SER 165.A OG no hydrogen 2.913 N/A ALA 14.A N PRO 10.A O no hydrogen 2.905 N/A VAL 15.A N PRO 11.A O no hydrogen 3.254 N/A GLU 16.A N CYS 12.A O no hydrogen 2.921 N/A LEU 17.A N ARG 13.A O no hydrogen 2.826 N/A THR 18.A N ALA 14.A O no hydrogen 3.095 N/A THR 18.A OG1 ALA 14.A O no hydrogen 2.982 N/A ALA 19.A N VAL 15.A O no hydrogen 2.860 N/A LYS 20.A N GLU 16.A O no hydrogen 2.990 N/A LYS 20.A NZ GLU 195.A OE2 no hydrogen 2.953 N/A ALA 21.A N LEU 17.A O no hydrogen 2.873 N/A LEU 22.A N THR 18.A O no hydrogen 2.957 N/A GLY 23.A N LYS 20.A O no hydrogen 3.056 N/A LEU 24.A N ALA 19.A O no hydrogen 2.888 N/A GLU 27.A N LEU 1.A O no hydrogen 2.810 N/A GLN 28.A NE2 GLU 16.A OE1 no hydrogen 3.556 N/A LYS 29.A N LEU 3.A O no hydrogen 2.860 N/A ILE 31.A N THR 5.A O no hydrogen 2.792 N/A ASN 32.A N ASP 37.A OD2 no hydrogen 2.937 N/A LEU 34.A N ASN 32.A OD1 no hydrogen 3.008 N/A ALA 35.A N ASN 32.A O no hydrogen 2.900 N/A GLY 36.A N LEU 33.A O no hydrogen 3.165 N/A ASP 37.A N ASN 32.A O no hydrogen 3.134 N/A LEU 39.A N GLY 36.A O no hydrogen 2.889 N/A THR 40.A OG1 GLU 42.A OE1 no hydrogen 3.504 N/A PHE 43.A N THR 40.A OG1 no hydrogen 2.996 N/A MET 44.A N THR 40.A O no hydrogen 3.107 N/A LYS 45.A N PRO 41.A O no hydrogen 3.262 N/A LEU 46.A N GLU 42.A O no hydrogen 3.425 N/A ASN 47.A N PHE 43.A O no hydrogen 2.907 N/A ASN 47.A ND2 THR 51.A O no hydrogen 2.980 N/A GLN 49.A N ASN 47.A OD1 no hydrogen 3.049 N/A HIS 50.A N ASN 47.A O no hydrogen 2.897 N/A VAL 54.A N TYR 4.A O no hydrogen 3.301 N/A LEU 55.A N ILE 62.A O no hydrogen 2.811 N/A ASP 56.A N VAL 2.A O no hydrogen 2.831 N/A ASP 57.A N THR 60.A O no hydrogen 2.800 N/A GLY 59.A N ASP 56.A OD1 no hydrogen 2.595 N/A THR 60.A N ASP 57.A O no hydrogen 2.999 N/A ILE 62.A N LEU 55.A O no hydrogen 2.783 N/A GLU 64.A N PRO 53.A O no hydrogen 3.392 N/A HIS 66.A ND1 GLU 64.A OE2 no hydrogen 2.608 N/A HIS 66.A NE2 GLU 100.A OE1 no hydrogen 2.702 N/A ALA 67.A N GLU 64.A OE1 no hydrogen 2.917 N/A ILE 68.A N GLU 64.A O no hydrogen 2.797 N/A MET 69.A N SER 65.A O no hydrogen 2.839 N/A ILE 70.A N HIS 66.A O no hydrogen 3.012 N/A TYR 71.A N ALA 67.A O no hydrogen 2.977 N/A TYR 71.A OH ASP 57.A OD2 no hydrogen 2.639 N/A LEU 72.A N ILE 68.A O no hydrogen 2.834 N/A VAL 73.A N MET 69.A O no hydrogen 3.033 N/A THR 74.A N ILE 70.A O no hydrogen 2.958 N/A THR 74.A OG1 ILE 70.A O no hydrogen 2.700 N/A LYS 75.A N TYR 71.A O no hydrogen 2.884 N/A TYR 76.A N LEU 72.A O no hydrogen 2.858 N/A TYR 76.A OH ASP 57.A OD1 no hydrogen 3.254 N/A TYR 76.A OH ASP 57.A OD2 no hydrogen 2.731 N/A GLY 77.A N VAL 73.A O no hydrogen 2.898 N/A THR 81.A N ASP 79.A OD1 no hydrogen 2.858 N/A TYR 83.A N ASP 80.A O no hydrogen 2.980 N/A TYR 83.A OH ASN 94.A OD1 no hydrogen 2.668 N/A LYS 85.A N ASP 80.A OD2 no hydrogen 2.870 N/A GLN 89.A N ASP 86.A OD2 no hydrogen 2.893 N/A GLN 90.A N ASP 86.A O no hydrogen 2.775 N/A ALA 91.A N PRO 87.A O no hydrogen 2.877 N/A ARG 92.A N VAL 88.A O no hydrogen 3.206 N/A ARG 92.A NH1 ASP 144.A OD2 no hydrogen 3.284 N/A ARG 92.A NH2 ASP 144.A OD2 no hydrogen 2.825 N/A VAL 93.A N GLN 89.A O no hydrogen 3.205 N/A ASN 94.A N GLN 90.A O no hydrogen 2.766 N/A ALA 95.A N ALA 91.A O no hydrogen 2.866 N/A ALA 96.A N ARG 92.A O no hydrogen 3.132 N/A LEU 97.A N VAL 93.A O no hydrogen 2.916 N/A HIS 98.A N ASN 94.A O no hydrogen 2.991 N/A PHE 99.A N ALA 95.A O no hydrogen 2.932 N/A GLU 100.A N ALA 96.A O no hydrogen 2.921 N/A SER 101.A N LEU 97.A O no hydrogen 3.016 N/A SER 101.A OG HIS 98.A O no hydrogen 3.478 N/A GLY 102.A N HIS 98.A O no hydrogen 2.774 N/A VAL 103.A N PHE 99.A O no hydrogen 2.870 N/A LEU 104.A N PHE 99.A O no hydrogen 3.175 N/A PHE 105.A N GLU 100.A O no hydrogen 2.709 N/A ARG 107.A N VAL 103.A O no hydrogen 3.118 N/A ARG 107.A NH1 TYR 130.A O no hydrogen 3.139 N/A MET 108.A N LEU 104.A O no hydrogen 3.125 N/A ARG 109.A N PHE 105.A O no hydrogen 2.818 N/A ARG 109.A NE GLU 113.A OE1 no hydrogen 3.061 N/A ARG 109.A NH2 GLU 113.A OE1 no hydrogen 3.217 N/A ARG 109.A NH2 GLU 113.A OE2 no hydrogen 3.009 N/A PHE 110.A N ALA 106.A O no hydrogen 2.975 N/A ILE 111.A N MET 108.A O no hydrogen 3.012 N/A PHE 112.A N MET 108.A O no hydrogen 2.861 N/A GLU 113.A N ARG 109.A O no hydrogen 2.951 N/A ARG 114.A NH1 ASP 122.A OD1 no hydrogen 2.863 N/A ARG 114.A NH2 ASP 122.A OD1 no hydrogen 3.171 N/A LEU 116.A N PHE 112.A O no hydrogen 2.806 N/A PHE 117.A N GLU 113.A O no hydrogen 2.904 N/A TYR 118.A N ARG 114.A O no hydrogen 3.146 N/A LYS 120.A N ARG 114.A O no hydrogen 3.163 N/A ARG 127.A N PRO 124.A O no hydrogen 2.963 N/A ARG 127.A NH1 PHE 110.A O no hydrogen 2.906 N/A ILE 128.A N PRO 124.A O no hydrogen 3.216 N/A GLU 129.A N GLU 125.A O no hydrogen 3.009 N/A TYR 130.A N ASP 126.A O no hydrogen 3.032 N/A VAL 131.A N ARG 127.A O no hydrogen 3.147 N/A GLN 132.A N ILE 128.A O no hydrogen 2.910 N/A LYS 133.A N GLU 129.A O no hydrogen 2.896 N/A SER 134.A N TYR 130.A O no hydrogen 3.140 N/A SER 134.A OG VAL 131.A O no hydrogen 2.802 N/A TYR 135.A N VAL 131.A O no hydrogen 3.074 N/A TYR 135.A OH VAL 170.A O no hydrogen 2.761 N/A ARG 136.A N GLN 132.A O no hydrogen 3.182 N/A ARG 136.A NH1 GLU 176.A O no hydrogen 3.276 N/A ARG 136.A NH2 GLU 176.A O no hydrogen 3.184 N/A LEU 137.A N LYS 133.A O no hydrogen 2.957 N/A LEU 138.A N SER 134.A O no hydrogen 3.034 N/A GLU 139.A N TYR 135.A O no hydrogen 3.008 N/A ASP 140.A N ARG 136.A O no hydrogen 2.932 N/A THR 141.A N LEU 137.A O no hydrogen 3.057 N/A THR 141.A OG1 LEU 137.A O no hydrogen 2.740 N/A LEU 142.A N LEU 138.A O no hydrogen 3.090 N/A LEU 142.A N GLU 139.A O no hydrogen 3.268 N/A LYS 143.A N THR 141.A O no hydrogen 2.861 N/A LYS 143.A NZ ASP 144.A OD2 no hydrogen 2.909 N/A PHE 146.A N GLY 149.A O no hydrogen 2.995 N/A VAL 147.A N ASP 156.A OD1 no hydrogen 2.938 N/A GLY 149.A N PHE 146.A O no hydrogen 3.224 N/A THR 153.A N ASP 156.A OD2 no hydrogen 2.818 N/A ILE 154.A N LEU 82.A O no hydrogen 2.982 N/A ALA 155.A N THR 153.A OG1 no hydrogen 3.274 N/A ASP 156.A N THR 153.A O no hydrogen 2.908 N/A SER 158.A N ILE 154.A O no hydrogen 2.931 N/A SER 158.A OG HIS 66.A NE2 no hydrogen 2.964 N/A CYS 159.A N ALA 155.A O no hydrogen 2.956 N/A CYS 159.A SG ALA 155.A O no hydrogen 3.420 N/A ILE 160.A N ASP 156.A O no hydrogen 2.814 N/A SER 161.A N PHE 157.A O no hydrogen 3.102 N/A SER 161.A OG PRO 10.A O no hydrogen 3.182 N/A SER 161.A OG PHE 157.A O no hydrogen 3.472 N/A SER 161.A OG SER 158.A O no hydrogen 2.753 N/A THR 162.A OG1 GLU 100.A OE2 no hydrogen 2.516 N/A ILE 163.A N CYS 159.A O no hydrogen 2.941 N/A SER 164.A N ILE 160.A O no hydrogen 2.845 N/A SER 164.A OG ILE 160.A O no hydrogen 2.846 N/A SER 164.A OG SER 161.A O no hydrogen 3.133 N/A SER 165.A N THR 162.A O no hydrogen 2.848 N/A SER 165.A OG SER 161.A O no hydrogen 2.748 N/A ILE 166.A N THR 162.A O no hydrogen 2.970 N/A MET 167.A N ILE 163.A O no hydrogen 3.077 N/A VAL 169.A N ILE 166.A O no hydrogen 2.892 N/A VAL 170.A N ILE 166.A O no hydrogen 2.882 N/A HIS 177.A N GLU 173.A O no hydrogen 3.052 N/A HIS 177.A N GLN 174.A O no hydrogen 3.184 N/A HIS 177.A ND1 GLU 173.A O no hydrogen 2.795 N/A ARG 179.A N GLU 139.A OE2 no hydrogen 2.812 N/A ARG 179.A NH1 GLU 139.A O no hydrogen 3.139 N/A ILE 180.A N GLU 139.A OE1 no hydrogen 2.957 N/A TYR 181.A N HIS 177.A O no hydrogen 3.368 N/A TYR 181.A OH LEU 172.A O no hydrogen 2.494 N/A GLU 182.A N PRO 178.A O no hydrogen 3.102 N/A TRP 183.A N ARG 179.A O no hydrogen 3.000 N/A TRP 183.A NE1 ASP 156.A OD1 no hydrogen 2.823 N/A ILE 184.A N ILE 180.A O no hydrogen 2.889 N/A ASP 185.A N TYR 181.A O no hydrogen 3.030 N/A ARG 186.A N GLU 182.A O no hydrogen 3.090 N/A LEU 187.A N TRP 183.A O no hydrogen 3.189 N/A LYS 188.A N ILE 184.A O no hydrogen 2.916 N/A GLN 189.A N ARG 186.A O no hydrogen 3.115 N/A LEU 190.A N LEU 187.A O no hydrogen 3.013 N/A TYR 193.A N LEU 190.A O no hydrogen 3.156 N/A ALA 196.A N TYR 192.A O no hydrogen 2.941 N/A ASN 197.A N TYR 193.A O no hydrogen 2.917 N/A ASN 197.A ND2 SER 164.A OG no hydrogen 3.128 N/A GLY 198.A N TYR 193.A O no hydrogen 2.896 N/A GLY 199.A N GLU 194.A O no hydrogen 3.154 N/A GLY 201.A N ASN 197.A O no hydrogen 2.988 N/A THR 202.A N GLY 198.A O no hydrogen 2.956 N/A THR 202.A OG1 GLY 198.A O no hydrogen 2.991 N/A ASP 203.A N GLY 199.A O no hydrogen 2.862 N/A LEU 204.A N GLY 200.A O no hydrogen 2.876 N/A GLY 205.A N GLY 201.A O no hydrogen 3.212 N/A LYS 206.A N THR 202.A O no hydrogen 3.190 N/A PHE 207.A N ASP 203.A O no hydrogen 2.899 N/A VAL 208.A N LEU 204.A O no hydrogen 2.965 N/A LEU 209.A N GLY 205.A O no hydrogen 3.164 N/A ALA 210.A N LYS 206.A O no hydrogen 2.859 N/A LYS 211.A N PHE 207.A O no hydrogen 2.764 N/A LYS 212.A N VAL 208.A O no hydrogen 2.927 N/A LYS 212.A NZ SER 121.A O no hydrogen 3.215 N/A GLU 213.A N LEU 209.A O no hydrogen 3.222 N/A GLU 214.A N ALA 210.A O no hydrogen 3.026 N/A ASN 215.A N LYS 211.A O no hydrogen 2.829 N/A ASN 215.A ND2 ILE 115.A O no hydrogen 2.981 N/A ASN 215.A ND2 LYS 120.A O no hydrogen 2.963 N/A ALA 216.A N LYS 212.A O no hydrogen 3.247 N/A ALA 216.A N GLU 213.A O no hydrogen 3.138 N/A LYS 217.A N GLU 214.A O no hydrogen 3.203 N/A