Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zyl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N SER 1.A OG no hydrogen 3.079 N/A ARG 5.A N SER 1.A O no hydrogen 3.018 N/A ILE 6.A N LEU 2.A O no hydrogen 2.950 N/A THR 7.A N THR 3.A O no hydrogen 2.968 N/A THR 7.A OG1 THR 3.A O no hydrogen 3.134 N/A ALA 8.A N ASP 4.A O no hydrogen 2.792 N/A ALA 9.A N ARG 5.A O no hydrogen 3.014 N/A GLN 10.A N ILE 6.A O no hydrogen 3.177 N/A GLN 10.A NE2 GLN 10.A O no hydrogen 2.823 N/A HIS 11.A N THR 7.A O no hydrogen 3.049 N/A SER 12.A N ALA 8.A O no hydrogen 2.910 N/A VAL 13.A N ALA 9.A O no hydrogen 3.071 N/A THR 14.A N GLN 10.A O no hydrogen 2.984 N/A THR 14.A OG1 GLN 10.A O no hydrogen 3.087 N/A GLY 15.A N HIS 11.A O no hydrogen 2.962 N/A SER 16.A N SER 12.A O no hydrogen 3.050 N/A SER 16.A OG.B SER 12.A O no hydrogen 2.904 N/A ALA 17.A N VAL 13.A O no hydrogen 3.143 N/A VAL 18.A N THR 14.A O no hydrogen 3.096 N/A SER 19.A N GLY 15.A O no hydrogen 2.967 N/A SER 19.A OG.A GLY 15.A O no hydrogen 3.070 N/A SER 19.A OG.B GLY 15.A O no hydrogen 3.404 N/A SER 19.A OG.B SER 16.A O no hydrogen 2.817 N/A LYS 20.A N SER 16.A O no hydrogen 2.961 N/A THR 21.A N ALA 17.A O no hydrogen 3.086 N/A THR 21.A OG1 ALA 17.A O no hydrogen 2.899 N/A VAL 22.A N VAL 18.A O no hydrogen 2.831 N/A CYS 23.A N SER 19.A O no hydrogen 2.997 N/A CYS 23.A SG.A SER 19.A O no hydrogen 3.515 N/A LYS 24.A N LYS 20.A O no hydrogen 2.960 N/A ALA 25.A N THR 21.A O no hydrogen 2.890 N/A THR 26.A N CYS 23.A O no hydrogen 3.040 N/A THR 26.A OG1 VAL 22.A O no hydrogen 2.739 N/A THR 26.A OG1 CYS 23.A O no hydrogen 3.469 N/A GLU 29.A N THR 27.A OG1 no hydrogen 3.377 N/A MET 31.A N GLU 29.A O no hydrogen 2.920 N/A LYS 35.A NZ ASP 39.A OD1 no hydrogen 3.331 N/A LYS 35.A NZ ASP 39.A OD2 no hydrogen 2.826 N/A LEU 38.A N LYS 34.A O no hydrogen 3.058 N/A ASP 39.A N LYS 35.A O no hydrogen 2.753 N/A TYR 40.A N LYS 36.A O no hydrogen 3.089 N/A LEU 41.A N HIS 37.A O no hydrogen 2.996 N/A ILE 42.A N LEU 38.A O no hydrogen 2.886 N/A GLN 43.A N ASP 39.A O no hydrogen 2.970 N/A GLN 43.A NE2 GLU 47.A OE2 no hydrogen 2.919 N/A CYS 44.A N TYR 40.A O no hydrogen 2.971 N/A CYS 44.A SG TYR 40.A O no hydrogen 3.302 N/A THR 45.A N LEU 41.A O no hydrogen 3.034 N/A THR 45.A OG1 ILE 42.A O no hydrogen 2.617 N/A ASN 46.A N ILE 42.A O no hydrogen 3.217 N/A ASN 46.A N GLN 43.A O no hydrogen 2.882 N/A GLU 47.A N CYS 44.A O no hydrogen 2.993 N/A VAL 50.A N GLU 47.A O no hydrogen 2.957 N/A GLN 54.A N ASN 51.A OD1 no hydrogen 2.982 N/A LEU 55.A N ASN 51.A O no hydrogen 3.154 N/A ALA 56.A N ILE 52.A O no hydrogen 2.897 N/A ASP 57.A N PRO 53.A O no hydrogen 2.842 N/A SER 58.A N GLN 54.A O no hydrogen 2.966 N/A SER 58.A OG GLN 54.A O no hydrogen 3.126 N/A LEU 59.A N LEU 55.A O no hydrogen 3.125 N/A PHE 60.A N ALA 56.A O no hydrogen 2.879 N/A GLU 61.A N ASP 57.A O no hydrogen 2.866 N/A ARG 62.A N SER 58.A O no hydrogen 3.138 N/A ARG 62.A NE THR 26.A OG1 no hydrogen 2.756 N/A ARG 62.A NH2 THR 26.A O no hydrogen 2.867 N/A THR 63.A N LEU 59.A O no hydrogen 3.223 N/A THR 63.A OG1 PHE 60.A O no hydrogen 2.630 N/A THR 64.A N GLU 61.A O no hydrogen 2.988 N/A THR 64.A OG1 GLU 61.A O no hydrogen 2.681 N/A ASN 65.A N ARG 62.A O no hydrogen 3.069 N/A SER 67.A N ASN 65.A OD1 no hydrogen 2.919 N/A TRP 68.A N ASP 107.A OD2 no hydrogen 2.881 N/A VAL 69.A N SER 67.A OG no hydrogen 3.067 N/A VAL 71.A N SER 67.A O no hydrogen 3.049 N/A PHE 72.A N TRP 68.A O no hydrogen 2.854 N/A LYS 73.A N VAL 69.A O no hydrogen 2.998 N/A LYS 73.A NZ THR 27.A O no hydrogen 2.929 N/A LYS 73.A NZ THR 27.A OG1 no hydrogen 2.989 N/A LYS 73.A NZ GLU 29.A O no hydrogen 2.934 N/A SER 74.A N VAL 70.A O no hydrogen 2.948 N/A SER 74.A OG LEU 59.A O no hydrogen 2.734 N/A LEU 75.A N VAL 71.A O no hydrogen 2.977 N/A ILE 76.A N PHE 72.A O no hydrogen 2.845 N/A THR 77.A N LYS 73.A O no hydrogen 2.874 N/A THR 77.A OG1 LYS 73.A O no hydrogen 2.869 N/A THR 78.A N SER 74.A O no hydrogen 2.929 N/A THR 78.A OG1 SER 74.A O no hydrogen 2.925 N/A HIS 79.A N LEU 75.A O no hydrogen 2.882 N/A HIS 79.A ND1 TYR 123.A OH no hydrogen 2.723 N/A HIS 79.A NE2 ASP 199.A OD2 no hydrogen 2.828 N/A HIS 80.A N ILE 76.A O no hydrogen 2.820 N/A LEU 81.A N THR 77.A O no hydrogen 2.954 N/A MET 82.A N THR 78.A O no hydrogen 2.842 N/A VAL 83.A N HIS 79.A O no hydrogen 2.999 N/A VAL 83.A N HIS 80.A O no hydrogen 3.270 N/A TYR 84.A N HIS 80.A O no hydrogen 2.804 N/A GLY 85.A N LEU 81.A O no hydrogen 2.863 N/A ASN 86.A N THR 45.A OG1 no hydrogen 2.931 N/A ASN 86.A ND2 ASN 46.A OD1 no hydrogen 2.859 N/A ARG 88.A N ASN 86.A OD1 no hydrogen 2.907 N/A ARG 88.A NE.A THR 45.A O no hydrogen 2.943 N/A ARG 88.A NE.B ASN 86.A OD1 no hydrogen 3.413 N/A ARG 88.A NH1.A VAL 50.A O no hydrogen 3.485 N/A ARG 88.A NH2.A VAL 50.A O no hydrogen 2.824 N/A ARG 88.A NH2.B THR 45.A O no hydrogen 3.086 N/A ARG 88.A NH2.B GLU 47.A O no hydrogen 3.418 N/A PHE 89.A N ASN 86.A O no hydrogen 2.956 N/A GLN 91.A N GLU 87.A O no hydrogen 3.033 N/A GLN 91.A NE2 TYR 134.A OH no hydrogen 3.165 N/A TYR 92.A N ARG 88.A O no hydrogen 2.991 N/A LEU 93.A N PHE 89.A O no hydrogen 3.053 N/A ALA 94.A N ILE 90.A O no hydrogen 2.841 N/A SER 95.A N GLN 91.A O no hydrogen 3.163 N/A SER 95.A N TYR 92.A O no hydrogen 3.006 N/A SER 95.A OG TYR 92.A O no hydrogen 2.713 N/A ARG 96.A N LEU 93.A O no hydrogen 3.241 N/A ARG 96.A NE THR 98.A O no hydrogen 2.930 N/A ARG 96.A NH1 TYR 92.A OH no hydrogen 2.982 N/A ARG 96.A NH2 THR 98.A O no hydrogen 3.504 N/A PHE 100.A N ASN 128.A OD1 no hydrogen 2.965 N/A PHE 105.A N LEU 102.A O no hydrogen 2.982 N/A ASP 107.A N SER 117.A OG no hydrogen 2.890 N/A SER 109.A N ASP 107.A OD1 no hydrogen 2.908 N/A SER 109.A OG ASP 107.A OD1 no hydrogen 3.250 N/A TYR 114.A N GLY 110.A O no hydrogen 3.034 N/A ASP 115.A N LEU 111.A O no hydrogen 3.053 N/A MET 116.A N GLN 112.A O no hydrogen 2.850 N/A SER 117.A N GLY 113.A O no hydrogen 2.970 N/A SER 117.A N TYR 114.A O no hydrogen 3.264 N/A SER 117.A OG GLY 113.A O no hydrogen 2.672 N/A ILE 120.A N MET 116.A O no hydrogen 2.914 N/A ARG 121.A N SER 117.A O no hydrogen 3.056 N/A ARG 121.A NE PHE 105.A O no hydrogen 2.889 N/A ARG 121.A NH2 PHE 105.A O no hydrogen 2.997 N/A ARG 122.A N THR 118.A O no hydrogen 3.184 N/A ARG 122.A NH1 PHE 177.A O no hydrogen 2.985 N/A TYR 123.A N PHE 119.A O no hydrogen 2.756 N/A TYR 123.A OH HIS 79.A ND1 no hydrogen 2.723 N/A SER 124.A N ILE 120.A O no hydrogen 2.869 N/A SER 124.A OG.B ILE 120.A O no hydrogen 3.096 N/A SER 124.A OG.B ARG 121.A O no hydrogen 2.998 N/A ARG 125.A N ARG 121.A O no hydrogen 3.149 N/A ARG 125.A NH1 ASP 176.A OD2 no hydrogen 2.645 N/A TYR 126.A N ARG 122.A O no hydrogen 3.091 N/A TYR 126.A OH ASP 199.A OD2 no hydrogen 2.635 N/A LEU 127.A N TYR 123.A O no hydrogen 2.938 N/A ASN 128.A N SER 124.A O no hydrogen 2.943 N/A ASN 128.A ND2 PHE 100.A O no hydrogen 2.975 N/A GLU 129.A N ARG 125.A O no hydrogen 2.954 N/A LYS 130.A N TYR 126.A O no hydrogen 2.809 N/A LYS 130.A NZ ASP 199.A OD1 no hydrogen 3.310 N/A LYS 130.A NZ ASP 199.A OD2 no hydrogen 2.832 N/A ALA 131.A N LEU 127.A O no hydrogen 3.019 N/A VAL 132.A N ASN 128.A O no hydrogen 2.967 N/A SER 133.A N GLU 129.A O no hydrogen 2.809 N/A SER 133.A OG GLN 170.A OE1 no hydrogen 2.729 N/A TYR 134.A N LYS 130.A O no hydrogen 3.112 N/A TYR 134.A OH GLU 87.A OE2.B no hydrogen 2.598 N/A ARG 135.A N ALA 131.A O no hydrogen 2.972 N/A ARG 135.A NE ALA 94.A O no hydrogen 2.817 N/A GLN 136.A N VAL 132.A O no hydrogen 3.104 N/A GLN 136.A N SER 133.A O no hydrogen 3.172 N/A GLN 136.A NE2 VAL 132.A O no hydrogen 3.309 N/A VAL 137.A N SER 133.A O no hydrogen 3.434 N/A ALA 138.A N TYR 134.A O no hydrogen 2.735 N/A THR 142.A N ASP 140.A OD1 no hydrogen 2.873 N/A THR 142.A OG1 ASP 140.A OD1 no hydrogen 2.690 N/A THR 142.A OG1 ASP 140.A OD2 no hydrogen 3.413 N/A LYS 143.A N ASP 140.A O no hydrogen 2.961 N/A LYS 143.A NZ VAL 83.A O no hydrogen 2.794 N/A GLY 147.A N GLU 209.A OE2 no hydrogen 2.857 N/A GLY 150.A N GLY 147.A O no hydrogen 2.860 N/A VAL 151.A N LYS 145.A O no hydrogen 2.960 N/A ARG 153.A NH2 GLU 216.A OE2 no hydrogen 3.146 N/A THR 154.A N GLY 150.A O no hydrogen 3.266 N/A THR 154.A OG1 GLY 150.A O no hydrogen 2.861 N/A LYS 159.A N ASN 156.A OD1 no hydrogen 2.958 N/A LEU 160.A N ASN 156.A O no hydrogen 2.820 N/A LEU 161.A N THR 157.A O no hydrogen 2.940 N/A LYS 162.A N GLU 158.A O no hydrogen 3.348 N/A THR 163.A N LYS 159.A O no hydrogen 2.856 N/A THR 163.A N LEU 160.A O no hydrogen 3.104 N/A THR 163.A OG1 LYS 159.A O no hydrogen 2.712 N/A VAL 164.A N LEU 160.A O no hydrogen 2.968 N/A ILE 166.A N THR 163.A O no hydrogen 2.966 N/A ILE 167.A N THR 163.A O no hydrogen 3.191 N/A GLN 168.A N VAL 164.A O no hydrogen 2.852 N/A GLN 168.A NE2 ASP 172.A OD2 no hydrogen 2.777 N/A ASN 169.A N PRO 165.A O no hydrogen 2.887 N/A GLN 170.A N ILE 166.A O no hydrogen 3.057 N/A GLN 170.A NE2 TYR 126.A OH no hydrogen 3.158 N/A MET 171.A N ILE 167.A O no hydrogen 2.844 N/A ASP 172.A N GLN 168.A O no hydrogen 2.895 N/A ALA 173.A N ASN 169.A O no hydrogen 3.211 N/A LEU 174.A N GLN 170.A O no hydrogen 3.031 N/A LEU 175.A N MET 171.A O no hydrogen 2.854 N/A ASP 176.A N ASP 172.A O no hydrogen 2.915 N/A PHE 177.A N LEU 174.A O no hydrogen 3.060 N/A ASN 178.A N LEU 175.A O no hydrogen 2.930 N/A ASN 180.A N GLU 183.A OE1 no hydrogen 2.876 N/A SER 181.A OG.A GLN 252.A OE1 no hydrogen 3.069 N/A SER 181.A OG.B VAL 249.A O no hydrogen 2.842 N/A SER 181.A OG.B GLN 252.A OE1 no hydrogen 2.778 N/A GLU 183.A N ASN 180.A O no hydrogen 2.995 N/A LEU 184.A N SER 181.A O no hydrogen 3.139 N/A THR 185.A N GLU 183.A O no hydrogen 2.978 N/A ILE 189.A N ASN 186.A OD1 no hydrogen 2.955 N/A ASN 190.A N ASN 186.A O no hydrogen 3.048 N/A ASN 190.A ND2 LEU 184.A O no hydrogen 3.568 N/A ALA 191.A N GLY 187.A O no hydrogen 3.156 N/A ALA 192.A N VAL 188.A O no hydrogen 3.180 N/A PHE 193.A N ILE 189.A O no hydrogen 2.864 N/A MET 194.A N ASN 190.A O no hydrogen 3.001 N/A LEU 195.A N ALA 191.A O no hydrogen 3.273 N/A LEU 196.A N ALA 192.A O no hydrogen 2.959 N/A PHE 197.A N PHE 193.A O no hydrogen 2.785 N/A LYS 198.A N MET 194.A O no hydrogen 3.052 N/A LYS 198.A NZ ASP 259.A O no hydrogen 2.710 N/A ASP 199.A N LEU 195.A O no hydrogen 2.953 N/A ALA 200.A N LEU 196.A O no hydrogen 2.767 N/A ILE 201.A N PHE 197.A O no hydrogen 3.090 N/A ARG 202.A N LYS 198.A O no hydrogen 3.469 N/A ARG 202.A NH1 LYS 198.A O no hydrogen 3.148 N/A ARG 202.A NH1 ILE 260.A O no hydrogen 2.756 N/A ARG 202.A NH2 ILE 260.A O no hydrogen 2.761 N/A LEU 203.A N ASP 199.A O no hydrogen 2.723 N/A PHE 204.A N ALA 200.A O no hydrogen 2.806 N/A ALA 205.A N ILE 201.A O no hydrogen 3.059 N/A ALA 206.A N ARG 202.A O no hydrogen 3.169 N/A TYR 207.A N LEU 203.A O no hydrogen 2.949 N/A ASN 208.A N PHE 204.A O no hydrogen 2.808 N/A GLU 209.A N ALA 205.A O no hydrogen 3.023 N/A GLY 210.A N ALA 206.A O no hydrogen 2.984 N/A ILE 211.A N TYR 207.A O no hydrogen 3.020 N/A ILE 212.A N ASN 208.A O no hydrogen 2.900 N/A ASN 213.A N GLU 209.A O no hydrogen 2.986 N/A ASN 213.A ND2 MET 152.A O no hydrogen 2.886 N/A ASN 213.A ND2 MET 155.A O no hydrogen 2.969 N/A LEU 214.A N GLY 210.A O no hydrogen 2.992 N/A LEU 215.A N ILE 211.A O no hydrogen 2.825 N/A GLU 216.A N ILE 212.A O no hydrogen 2.926 N/A LYS 217.A N ASN 213.A O no hydrogen 3.231 N/A LYS 217.A N LEU 214.A O no hydrogen 3.027 N/A LYS 217.A NZ MET 155.A O no hydrogen 3.508 N/A LYS 217.A NZ ASN 213.A OD1 no hydrogen 2.790 N/A TYR 218.A N LEU 215.A O no hydrogen 3.124 N/A ASP 220.A N LYS 217.A O no hydrogen 2.826 N/A MET 221.A N TYR 218.A O no hydrogen 3.489 N/A LYS 222.A N GLN 225.A OE1 no hydrogen 2.967 N/A GLN 225.A NE2 GLU 158.A OE2 no hydrogen 3.170 N/A CYS 226.A N LYS 222.A O no hydrogen 2.846 N/A CYS 226.A SG TYR 218.A O no hydrogen 3.762 N/A CYS 226.A SG LYS 222.A O no hydrogen 3.634 N/A LYS 227.A N LYS 223.A O no hydrogen 3.110 N/A GLU 228.A N ASN 224.A O no hydrogen 3.068 N/A GLY 229.A N GLN 225.A O no hydrogen 2.819 N/A LEU 230.A N CYS 226.A O no hydrogen 2.896 N/A ASP 231.A N LYS 227.A O no hydrogen 3.083 N/A ILE 232.A N GLU 228.A O no hydrogen 2.979 N/A TYR 233.A N GLY 229.A O no hydrogen 2.770 N/A LYS 234.A N LEU 230.A O no hydrogen 2.882 N/A LYS 235.A N ASP 231.A O no hydrogen 3.033 N/A LYS 235.A NZ ASP 231.A OD2 no hydrogen 2.819 N/A PHE 236.A N ILE 232.A O no hydrogen 2.920 N/A LEU 237.A N TYR 233.A O no hydrogen 3.214 N/A THR 238.A OG1.B LYS 235.A O no hydrogen 2.726 N/A ARG 239.A N LYS 235.A O no hydrogen 3.275 N/A ARG 239.A NE ASP 172.A OD1 no hydrogen 2.741 N/A ARG 239.A NH1 LYS 235.A O no hydrogen 3.070 N/A ARG 239.A NH2 ASP 172.A OD1 no hydrogen 3.445 N/A ARG 239.A NH2 ASP 172.A OD2 no hydrogen 2.851 N/A MET 240.A N PHE 236.A O no hydrogen 2.829 N/A THR 241.A N LEU 237.A O no hydrogen 3.009 N/A THR 241.A OG1 LEU 237.A O no hydrogen 3.087 N/A ARG 242.A N THR 238.A O no hydrogen 2.940 N/A ARG 242.A NH1 ASP 176.A OD1 no hydrogen 3.054 N/A ARG 242.A NH2 ASP 176.A OD1 no hydrogen 3.010 N/A ILE 243.A N ARG 239.A O no hydrogen 2.766 N/A SER 244.A N MET 240.A O no hydrogen 3.066 N/A SER 244.A OG.A MET 240.A O no hydrogen 3.269 N/A SER 244.A OG.C THR 241.A O no hydrogen 2.724 N/A GLU 245.A N THR 241.A O no hydrogen 3.344 N/A PHE 246.A N ARG 242.A O no hydrogen 2.905 N/A LEU 247.A N ILE 243.A O no hydrogen 2.840 N/A LYS 248.A N SER 244.A O no hydrogen 3.053 N/A VAL 249.A N GLU 245.A O no hydrogen 3.058 N/A ALA 250.A N PHE 246.A O no hydrogen 3.057 N/A GLU 251.A N LEU 247.A O no hydrogen 2.867 N/A GLN 252.A N LYS 248.A O no hydrogen 2.933 N/A VAL 253.A N ALA 250.A O no hydrogen 3.042 N/A GLY 254.A N GLU 251.A O no hydrogen 2.969 N/A ILE 255.A N ALA 250.A O no hydrogen 2.852 N/A ASP 256.A N ASP 259.A OD2 no hydrogen 3.046 N/A GLY 258.A N ASP 256.A OD1 no hydrogen 2.927 N/A ASP 259.A N ASP 256.A O no hydrogen 2.815 N/A ILE 260.A N ARG 257.A O no hydrogen 3.030 N/A