Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3exr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N PHE 189.A O no hydrogen 2.957 N/A LEU 6.A N ASP 30.A OD2 no hydrogen 2.829 N/A GLN 7.A N PHE 191.A O no hydrogen 2.885 N/A GLN 7.A NE2 GLU 33.A OE1 no hydrogen 2.826 N/A VAL 8.A N VAL 31.A O no hydrogen 2.949 N/A ALA 9.A N ALA 193.A O no hydrogen 2.821 N/A LEU 10.A N GLU 33.A O no hydrogen 2.875 N/A GLY 17.A N ASN 14.A OD1 no hydrogen 2.938 N/A ALA 18.A N ASN 14.A O no hydrogen 3.451 N/A ILE 19.A N LEU 15.A O no hydrogen 3.006 N/A THR 20.A N LYS 16.A O no hydrogen 2.887 N/A THR 20.A OG1 LYS 16.A O no hydrogen 2.995 N/A ALA 21.A N GLY 17.A O no hydrogen 3.019 N/A ALA 22.A N ALA 18.A O no hydrogen 2.931 N/A VAL 23.A N ILE 19.A O no hydrogen 2.988 N/A SER 24.A N THR 20.A O no hydrogen 3.155 N/A SER 24.A OG ALA 21.A O no hydrogen 2.604 N/A VAL 25.A N ALA 21.A O no hydrogen 3.320 N/A VAL 25.A N ALA 22.A O no hydrogen 3.376 N/A GLY 26.A N ALA 22.A O no hydrogen 2.770 N/A GLU 28.A N VAL 25.A O no hydrogen 2.856 N/A VAL 29.A N GLY 26.A O no hydrogen 3.367 N/A ASP 30.A N LEU 6.A O no hydrogen 2.833 N/A VAL 31.A N LEU 6.A O no hydrogen 3.152 N/A ILE 32.A N ILE 58.A O no hydrogen 2.908 N/A GLU 33.A N VAL 8.A O no hydrogen 2.897 N/A ALA 34.A N VAL 60.A O no hydrogen 2.900 N/A GLY 35.A N LEU 10.A O no hydrogen 2.793 N/A THR 36.A N ASP 62.A OD2 no hydrogen 3.301 N/A THR 36.A OG1 ASP 62.A O no hydrogen 2.703 N/A THR 36.A OG1 ASP 62.A OD2 no hydrogen 3.039 N/A CYS 38.A SG ASN 14.A O no hydrogen 3.962 N/A LEU 39.A N GLY 35.A O no hydrogen 2.914 N/A LEU 40.A N THR 36.A O no hydrogen 2.916 N/A GLN 41.A N VAL 37.A O no hydrogen 3.352 N/A GLN 41.A NE2 SER 13.A O no hydrogen 3.044 N/A VAL 42.A N CYS 38.A O no hydrogen 2.836 N/A GLY 43.A N LEU 39.A O no hydrogen 2.826 N/A VAL 47.A N SER 44.A O no hydrogen 2.906 N/A VAL 49.A N GLU 45.A O no hydrogen 2.994 N/A LEU 50.A N LEU 46.A O no hydrogen 2.898 N/A ARG 51.A N VAL 47.A O no hydrogen 2.994 N/A ARG 51.A NE GLY 80.A O no hydrogen 3.277 N/A ARG 51.A NH1 PHE 54.A O no hydrogen 3.031 N/A ARG 51.A NH1 LYS 57.A O no hydrogen 2.853 N/A ARG 51.A NH2 GLY 80.A O no hydrogen 2.882 N/A ARG 51.A NH2 ASP 82.A OD2 no hydrogen 2.812 N/A SER 52.A N GLU 48.A O no hydrogen 2.986 N/A LEU 53.A N VAL 49.A O no hydrogen 3.008 N/A PHE 54.A N LEU 50.A O no hydrogen 2.897 N/A LYS 57.A N PHE 54.A O no hydrogen 3.387 N/A LYS 57.A NZ VAL 29.A O no hydrogen 2.781 N/A ILE 58.A N ASP 30.A O no hydrogen 3.413 N/A ILE 59.A N ASP 82.A OD2 no hydrogen 3.051 N/A VAL 60.A N ILE 32.A O no hydrogen 2.962 N/A ALA 61.A N TRP 83.A O no hydrogen 2.878 N/A ASP 62.A N ALA 34.A O no hydrogen 2.965 N/A THR 63.A N ALA 61.A O no hydrogen 2.999 N/A THR 63.A OG1 THR 85.A O no hydrogen 3.099 N/A LYS 64.A N THR 85.A OG1 no hydrogen 2.890 N/A LYS 64.A NZ THR 36.A OG1 no hydrogen 3.040 N/A LYS 64.A NZ ASP 62.A OD1 no hydrogen 2.835 N/A LYS 64.A NZ GLU 115.A OE2 no hydrogen 3.550 N/A CYS 65.A N THR 85.A O no hydrogen 3.036 N/A CYS 65.A SG ASP 67.A O no hydrogen 3.306 N/A ALA 68.A N ASP 67.A OD1 no hydrogen 2.828 N/A VAL 72.A N ALA 68.A O no hydrogen 2.973 N/A ALA 73.A N GLY 69.A O no hydrogen 3.039 N/A LYS 74.A N GLY 70.A O no hydrogen 2.975 N/A ASN 75.A N THR 71.A O no hydrogen 2.842 N/A ASN 76.A N VAL 72.A O no hydrogen 3.086 N/A ASN 76.A ND2 VAL 72.A O no hydrogen 2.907 N/A ALA 77.A N ALA 73.A O no hydrogen 2.816 N/A VAL 78.A N LYS 74.A O no hydrogen 2.986 N/A ARG 79.A N ASN 76.A O no hydrogen 3.234 N/A ARG 79.A NE SER 44.A OG no hydrogen 2.981 N/A ARG 79.A NH1 GLU 48.A OE1 no hydrogen 2.823 N/A GLY 80.A N ALA 77.A O no hydrogen 2.984 N/A ALA 81.A N ASN 76.A O no hydrogen 3.125 N/A ASP 82.A N ILE 59.A O no hydrogen 2.823 N/A TRP 83.A N ILE 59.A O no hydrogen 3.154 N/A MET 84.A N GLU 111.A O no hydrogen 3.007 N/A THR 85.A N ALA 61.A O no hydrogen 3.258 N/A THR 85.A OG1 ASP 62.A OD1 no hydrogen 2.702 N/A CYS 86.A N GLN 113.A O no hydrogen 2.851 N/A ILE 87.A N CYS 65.A O no hydrogen 3.061 N/A CYS 88.A N GLU 115.A O no hydrogen 3.085 N/A CYS 88.A SG GLU 115.A O no hydrogen 3.423 N/A CYS 88.A SG TYR 117.A O no hydrogen 3.127 N/A ALA 90.A N ILE 87.A O no hydrogen 3.025 N/A THR 91.A OG1 THR 94.A OG1 no hydrogen 3.147 N/A THR 94.A N THR 91.A OG1 no hydrogen 3.225 N/A THR 94.A OG1 THR 91.A OG1 no hydrogen 3.147 N/A MET 95.A N THR 91.A O no hydrogen 2.915 N/A LYS 96.A N ILE 92.A O no hydrogen 2.826 N/A ALA 97.A N PRO 93.A O no hydrogen 2.893 N/A ALA 98.A N THR 94.A O no hydrogen 3.029 N/A ARG 99.A N MET 95.A O no hydrogen 2.928 N/A ARG 99.A NE ALA 131.A O no hydrogen 2.956 N/A ARG 99.A NH1 GLU 103.A OE2 no hydrogen 3.116 N/A ARG 99.A NH2 ALA 131.A O no hydrogen 2.988 N/A LYS 100.A N LYS 96.A O no hydrogen 2.864 N/A ALA 101.A N ALA 97.A O no hydrogen 3.017 N/A ILE 102.A N ALA 98.A O no hydrogen 2.980 N/A GLU 103.A N ARG 99.A O no hydrogen 2.983 N/A ASP 104.A N LYS 100.A O no hydrogen 2.997 N/A ILE 105.A N ALA 101.A O no hydrogen 3.410 N/A ASN 106.A N ILE 102.A O no hydrogen 2.870 N/A ASN 106.A ND2 ALA 81.A O no hydrogen 3.196 N/A ASN 106.A ND2 ASP 82.A OD1 no hydrogen 2.873 N/A LYS 109.A N ASN 106.A OD1 no hydrogen 3.020 N/A LYS 109.A NZ ASP 82.A OD2 no hydrogen 2.900 N/A GLY 110.A N ASN 106.A O no hydrogen 2.806 N/A GLU 111.A N ASP 82.A O no hydrogen 3.017 N/A GLN 113.A N MET 84.A O no hydrogen 2.884 N/A GLN 113.A NE2 GLN 135.A OE1 no hydrogen 2.839 N/A VAL 114.A N GLN 135.A O no hydrogen 2.897 N/A GLU 115.A N CYS 86.A O no hydrogen 2.883 N/A LEU 116.A N ILE 137.A O no hydrogen 3.164 N/A THR 121.A N GLN 124.A OE1 no hydrogen 2.950 N/A GLN 124.A N THR 121.A OG1 no hydrogen 3.046 N/A ALA 125.A N THR 121.A O no hydrogen 2.984 N/A GLN 126.A N TYR 122.A O no hydrogen 2.969 N/A GLN 126.A NE2 ASP 130.A OD1 no hydrogen 3.116 N/A GLN 127.A N ASP 123.A O no hydrogen 3.233 N/A TRP 128.A N GLN 124.A O no hydrogen 3.038 N/A LEU 129.A N ALA 125.A O no hydrogen 3.160 N/A ASP 130.A N GLN 126.A O no hydrogen 2.937 N/A ALA 131.A N GLN 127.A O no hydrogen 2.995 N/A GLY 132.A N LEU 129.A O no hydrogen 2.881 N/A ILE 133.A N TRP 128.A O no hydrogen 3.011 N/A GLN 135.A NE2 GLU 111.A OE1 no hydrogen 3.143 N/A ALA 136.A N ARG 168.A O no hydrogen 3.228 N/A ILE 137.A N VAL 114.A O no hydrogen 2.754 N/A TYR 138.A N SER 170.A O no hydrogen 2.835 N/A TYR 138.A OH ASP 155.A OD1 no hydrogen 2.710 N/A GLN 140.A N THR 172.A O no hydrogen 2.976 N/A GLN 140.A NE2 GLU 149.A O no hydrogen 3.199 N/A SER 141.A N ASP 155.A OD2 no hydrogen 2.850 N/A SER 141.A OG ASP 155.A OD1 no hydrogen 2.820 N/A SER 141.A OG ASP 155.A OD2 no hydrogen 3.138 N/A LEU 145.A N SER 141.A O no hydrogen 2.932 N/A LEU 146.A N ARG 142.A O no hydrogen 2.803 N/A ALA 147.A N ASP 143.A O no hydrogen 3.102 N/A GLY 148.A N LEU 145.A O no hydrogen 3.061 N/A GLU 149.A N ALA 144.A O no hydrogen 2.829 N/A TRP 151.A NE1 GLY 173.A O no hydrogen 2.850 N/A LEU 156.A N GLY 152.A O no hydrogen 3.097 N/A ASN 157.A N GLU 153.A O no hydrogen 2.772 N/A LYS 158.A N LYS 154.A O no hydrogen 3.201 N/A VAL 159.A N ASP 155.A O no hydrogen 3.089 N/A LYS 160.A N LEU 156.A O no hydrogen 2.848 N/A LYS 161.A N ASN 157.A O no hydrogen 2.934 N/A LEU 162.A N LYS 158.A O no hydrogen 2.971 N/A ILE 163.A N VAL 159.A O no hydrogen 3.089 N/A GLU 164.A N LYS 160.A O no hydrogen 2.980 N/A MET 165.A N LYS 161.A O no hydrogen 2.981 N/A GLY 166.A N ILE 163.A O no hydrogen 2.956 N/A PHE 167.A N LEU 162.A O no hydrogen 3.021 N/A ARG 168.A N SER 134.A O no hydrogen 2.860 N/A ARG 168.A NH1 GLU 111.A OE1 no hydrogen 3.415 N/A ARG 168.A NH1 GLU 111.A OE2 no hydrogen 2.963 N/A ARG 168.A NH2 GLU 111.A OE1 no hydrogen 2.859 N/A ARG 168.A NH2 SER 134.A OG no hydrogen 2.901 N/A SER 170.A N ALA 136.A O no hydrogen 2.937 N/A VAL 171.A N THR 190.A O no hydrogen 3.013 N/A THR 172.A N TYR 138.A O no hydrogen 3.088 N/A THR 172.A OG1 ILE 192.A O no hydrogen 3.252 N/A SER 176.A N THR 179.A OG1 no hydrogen 2.988 N/A THR 179.A N SER 176.A O no hydrogen 2.909 N/A THR 179.A OG1 GLY 174.A O no hydrogen 2.907 N/A THR 179.A OG1 SER 176.A O no hydrogen 3.352 N/A LEU 180.A N SER 176.A O no hydrogen 3.202 N/A LYS 181.A NZ ASP 178.A O no hydrogen 3.009 N/A LEU 182.A N THR 179.A O no hydrogen 3.152 N/A PHE 183.A N LEU 180.A O no hydrogen 2.817 N/A GLU 184.A N LYS 181.A O no hydrogen 3.081 N/A VAL 186.A N PHE 183.A O no hydrogen 2.833 N/A VAL 188.A N VAL 186.A O no hydrogen 2.842 N/A PHE 189.A N VAL 169.A O no hydrogen 2.897 N/A THR 190.A OG1 ASN 5.A OD1 no hydrogen 3.213 N/A PHE 191.A N ASN 5.A O no hydrogen 2.858 N/A ILE 192.A N VAL 171.A O no hydrogen 2.923 N/A ALA 193.A N GLN 7.A O no hydrogen 2.789 N/A ILE 197.A N GLY 194.A O no hydrogen 3.078 N/A THR 198.A N GLY 194.A O no hydrogen 3.025 N/A THR 198.A OG1 GLY 194.A O no hydrogen 3.363 N/A GLU 199.A N ARG 195.A O no hydrogen 2.847 N/A ALA 200.A N ILE 197.A O no hydrogen 3.271 N/A GLY 205.A N ASN 202.A OD1 no hydrogen 3.168 N/A ALA 206.A N ASN 202.A O no hydrogen 2.879 N/A ALA 207.A N PRO 203.A O no hydrogen 2.847 N/A ARG 208.A N ALA 204.A O no hydrogen 2.925 N/A ARG 208.A NE GLU 28.A OE1 no hydrogen 3.012 N/A ARG 208.A NH2 GLU 28.A OE2 no hydrogen 2.975 N/A ALA 209.A N GLY 205.A O no hydrogen 2.921 N/A PHE 210.A N ALA 206.A O no hydrogen 3.056 N/A LYS 211.A N ALA 207.A O no hydrogen 3.049 N/A LYS 211.A NZ PRO 4.A O no hydrogen 2.734 N/A LYS 211.A NZ ASP 30.A OD2 no hydrogen 2.780 N/A ASP 212.A N ARG 208.A O no hydrogen 2.817 N/A GLU 213.A N ALA 209.A O no hydrogen 3.103 N/A ILE 214.A N PHE 210.A O no hydrogen 3.048 N/A LYS 215.A N LYS 211.A O no hydrogen 2.907 N/A ARG 216.A N ASP 212.A O no hydrogen 2.872 N/A ARG 216.A NE GLU 213.A OE1 no hydrogen 2.961 N/A ARG 216.A NE GLU 213.A OE2 no hydrogen 3.425 N/A ARG 216.A NH2 GLU 213.A OE2 no hydrogen 2.971 N/A ILE 217.A N GLU 213.A O no hydrogen 3.029 N/A TRP 218.A N ILE 214.A O no hydrogen 2.913 N/A TRP 218.A NE1 VAL 186.A O no hydrogen 2.951 N/A GLY 219.A N LYS 215.A O no hydrogen 2.867 N/A