Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zql_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A N SER 2.A OG no hydrogen 3.293 N/A TRP 4.A NE1 GLU 70.A OE2 no hydrogen 3.224 N/A MET 5.A N SER 2.A O no hydrogen 3.405 N/A HIS 6.A N ILE 3.A O no hydrogen 3.142 N/A ARG 16.A N SER 14.A OG no hydrogen 2.988 N/A ARG 23.A N GLU 8.A OE1 no hydrogen 2.979 N/A ARG 23.A NE TYR 61.A O no hydrogen 3.090 N/A ARG 23.A NH1 HIS 6.A O no hydrogen 3.376 N/A ARG 23.A NH2 HIS 6.A O no hydrogen 2.746 N/A ARG 23.A NH2 TYR 61.A O no hydrogen 3.393 N/A GLN 25.A N SER 22.A O no hydrogen 3.138 N/A GLN 25.A N SER 22.A OG no hydrogen 3.212 N/A ILE 26.A N SER 22.A O no hydrogen 3.024 N/A ILE 26.A N ARG 23.A O no hydrogen 2.912 N/A VAL 27.A N ARG 23.A O no hydrogen 2.936 N/A ARG 28.A N ASP 24.A O no hydrogen 3.306 N/A ARG 28.A NH1 ASP 24.A OD1 no hydrogen 3.319 N/A ARG 28.A NH1 ASP 24.A OD2 no hydrogen 3.180 N/A ARG 28.A NH2 ASP 24.A OD2 no hydrogen 3.536 N/A ALA 29.A N GLN 25.A O no hydrogen 3.273 N/A ALA 30.A N ILE 26.A O no hydrogen 2.917 N/A VAL 31.A N VAL 27.A O no hydrogen 2.919 N/A LYS 32.A N ARG 28.A O no hydrogen 3.206 N/A VAL 33.A N ALA 29.A O no hydrogen 3.011 N/A ALA 34.A N ALA 30.A O no hydrogen 2.884 N/A ASP 35.A N VAL 31.A O no hydrogen 2.886 N/A THR 36.A N LYS 32.A O no hydrogen 2.994 N/A THR 36.A OG1 LYS 32.A O no hydrogen 2.838 N/A GLU 37.A N VAL 33.A O no hydrogen 2.749 N/A ALA 41.A N GLY 38.A O no hydrogen 2.807 N/A ALA 42.A N VAL 39.A O no hydrogen 3.038 N/A SER 43.A N ALA 41.A O no hydrogen 2.690 N/A SER 43.A OG ALA 41.A O no hydrogen 3.545 N/A ARG 46.A NH1 ARG 46.A O no hydrogen 3.061 N/A ARG 46.A NH1 GLU 50.A OE1 no hydrogen 2.755 N/A ARG 46.A NH2 GLU 37.A OE2 no hydrogen 2.431 N/A ARG 46.A NH2 GLU 50.A OE1 no hydrogen 3.426 N/A VAL 47.A N SER 43.A O no hydrogen 2.880 N/A ALA 48.A N MET 44.A O no hydrogen 3.022 N/A ALA 49.A N ARG 45.A O no hydrogen 2.795 N/A GLU 50.A N ARG 46.A O no hydrogen 3.055 N/A LEU 51.A N VAL 47.A O no hydrogen 3.190 N/A GLY 52.A N ALA 49.A O no hydrogen 3.225 N/A ALA 53.A N ALA 48.A O no hydrogen 3.002 N/A SER 57.A N GLY 54.A O no hydrogen 2.971 N/A LEU 58.A N THR 55.A O no hydrogen 3.216 N/A TYR 59.A N MET 56.A O no hydrogen 3.203 N/A TYR 61.A N LEU 58.A O no hydrogen 2.982 N/A VAL 62.A N LEU 58.A O no hydrogen 3.110 N/A LYS 65.A NZ ALA 42.A O no hydrogen 2.469 N/A ASP 67.A N THR 64.A OG1 no hydrogen 3.384 N/A LEU 68.A N THR 64.A O no hydrogen 3.110 N/A VAL 69.A N LYS 65.A O no hydrogen 2.983 N/A GLU 70.A N GLU 66.A O no hydrogen 3.261 N/A LEU 71.A N ASP 67.A O no hydrogen 3.026 N/A MET 72.A N LEU 68.A O no hydrogen 2.815 N/A VAL 73.A N VAL 69.A O no hydrogen 2.762 N/A ASP 74.A N GLU 70.A O no hydrogen 3.067 N/A GLU 75.A N LEU 71.A O no hydrogen 2.952 N/A VAL 76.A N MET 72.A O no hydrogen 3.187 N/A ILE 77.A N VAL 73.A O no hydrogen 3.234 N/A GLY 78.A N ASP 74.A O no hydrogen 3.318 N/A GLY 78.A N GLU 75.A O no hydrogen 3.035 N/A GLU 79.A N VAL 76.A O no hydrogen 2.899 N/A THR 80.A N ILE 77.A O no hydrogen 3.004 N/A THR 80.A OG1 ILE 77.A O no hydrogen 3.044 N/A TRP 90.A N PRO 88.A O no hydrogen 2.964 N/A ARG 91.A NH2 GLU 225.A OE2 no hydrogen 3.370 N/A ALA 92.A N ASP 89.A OD1 no hydrogen 3.450 N/A ALA 93.A N ASP 89.A O no hydrogen 2.813 N/A LEU 94.A N TRP 90.A O no hydrogen 2.816 N/A THR 95.A N ARG 91.A O no hydrogen 2.970 N/A THR 95.A OG1 ARG 91.A O no hydrogen 2.723 N/A LEU 96.A N ALA 92.A O no hydrogen 2.980 N/A ALA 97.A N ALA 93.A O no hydrogen 3.032 N/A ALA 98.A N LEU 94.A O no hydrogen 2.867 N/A ASN 99.A N THR 95.A O no hydrogen 2.817 N/A GLU 100.A N LEU 96.A O no hydrogen 2.912 N/A LYS 101.A N ALA 97.A O no hydrogen 3.019 N/A LYS 101.A NZ GLU 159.A OE2 no hydrogen 3.312 N/A ARG 102.A N ALA 98.A O no hydrogen 3.028 N/A ARG 102.A NE GLU 165.A OE1 no hydrogen 2.637 N/A ARG 102.A NH1 ASP 217.A OD2 no hydrogen 3.502 N/A ARG 102.A NH2 GLU 165.A OE1 no hydrogen 3.555 N/A ARG 102.A NH2 GLU 165.A OE2 no hydrogen 3.068 N/A ALA 103.A N ASN 99.A O no hydrogen 2.924 N/A LEU 104.A N GLU 100.A O no hydrogen 2.841 N/A TRP 105.A N LYS 101.A O no hydrogen 2.848 N/A LEU 106.A N ARG 102.A O no hydrogen 2.953 N/A ARG 107.A N ALA 103.A O no hydrogen 3.067 N/A ARG 107.A NE GLU 79.A OE1 no hydrogen 3.147 N/A ARG 107.A NH2 GLU 79.A OE1 no hydrogen 3.285 N/A HIS 108.A N LEU 104.A O no hydrogen 2.809 N/A HIS 108.A ND1 ASP 35.A OD1 no hydrogen 2.568 N/A HIS 108.A NE2 GLU 79.A OE1 no hydrogen 2.799 N/A TRP 110.A NE1 ASP 35.A OD1 no hydrogen 2.864 N/A LEU 111.A N HIS 108.A O no hydrogen 3.026 N/A ALA 114.A N TRP 110.A O no hydrogen 2.646 N/A TRP 115.A N LEU 111.A O no hydrogen 3.160 N/A ASN 117.A ND2 ASN 117.A O no hydrogen 3.242 N/A HIS 119.A NE2 GLU 70.A OE1 no hydrogen 2.938 N/A ASN 125.A N ASP 74.A OD2 no hydrogen 3.081 N/A ASN 125.A ND2 ASP 74.A O no hydrogen 2.749 N/A ASN 125.A ND2 GLU 75.A O no hydrogen 3.379 N/A SER 126.A N ASP 74.A OD1 no hydrogen 2.864 N/A SER 126.A OG ASP 74.A OD1 no hydrogen 2.657 N/A LEU 127.A N GLY 123.A O no hydrogen 3.031 N/A ARG 128.A N PRO 124.A O no hydrogen 2.886 N/A GLN 129.A N ASN 125.A O no hydrogen 2.934 N/A GLN 130.A N SER 126.A O no hydrogen 2.825 N/A GLU 131.A N LEU 127.A O no hydrogen 2.885 N/A PHE 132.A N ARG 128.A O no hydrogen 3.253 N/A VAL 133.A N GLN 129.A O no hydrogen 3.263 N/A LEU 134.A N GLN 130.A O no hydrogen 2.871 N/A GLY 135.A N GLU 131.A O no hydrogen 2.788 N/A THR 136.A N PHE 132.A O no hydrogen 3.244 N/A THR 136.A N VAL 133.A O no hydrogen 2.984 N/A THR 136.A OG1 VAL 133.A O no hydrogen 2.615 N/A GLY 138.A N GLY 135.A O no hydrogen 2.973 N/A LEU 142.A N PHE 140.A O no hydrogen 3.025 N/A GLN 143.A N GLU 146.A OE1 no hydrogen 2.983 N/A GLU 146.A N GLN 143.A O no hydrogen 2.958 N/A LEU 147.A N GLN 143.A O no hydrogen 3.010 N/A LEU 148.A N VAL 144.A O no hydrogen 3.060 N/A SER 149.A N ASP 145.A O no hydrogen 3.237 N/A LEU 150.A N GLU 146.A O no hydrogen 2.873 N/A ILE 151.A N LEU 147.A O no hydrogen 3.005 N/A GLY 152.A N LEU 148.A O no hydrogen 2.861 N/A LEU 153.A N SER 149.A O no hydrogen 2.981 N/A TYR 154.A N LEU 150.A O no hydrogen 3.219 N/A TYR 154.A OH LEU 94.A O no hydrogen 2.646 N/A ASN 155.A N ILE 151.A O no hydrogen 2.765 N/A ASN 155.A ND2 GLN 130.A OE1 no hydrogen 3.699 N/A GLY 156.A N GLY 152.A O no hydrogen 2.756 N/A TYR 157.A N LEU 153.A O no hydrogen 3.181 N/A TYR 157.A OH PHE 220.A O no hydrogen 2.647 N/A VAL 158.A N TYR 154.A O no hydrogen 3.231 N/A GLU 159.A N ASN 155.A O no hydrogen 2.949 N/A SER 160.A N GLY 156.A O no hydrogen 2.995 N/A SER 160.A OG GLY 156.A O no hydrogen 2.916 N/A PHE 161.A N TYR 157.A O no hydrogen 3.077 N/A VAL 162.A N VAL 158.A O no hydrogen 3.014 N/A ARG 163.A N GLU 159.A O no hydrogen 2.633 N/A ARG 163.A NH1 ALA 112.A O no hydrogen 3.075 N/A ARG 163.A NH2 GLU 159.A OE1 no hydrogen 3.382 N/A ASN 164.A N SER 160.A O no hydrogen 3.257 N/A ASN 164.A N PHE 161.A O no hydrogen 3.261 N/A ASN 164.A ND2 SER 160.A O no hydrogen 3.000 N/A GLU 165.A N PHE 161.A O no hydrogen 3.182 N/A VAL 166.A N VAL 162.A O no hydrogen 3.030 N/A GLY 167.A N ARG 163.A O no hydrogen 3.016 N/A TRP 168.A N ASN 164.A O no hydrogen 3.191 N/A LEU 169.A N GLU 165.A O no hydrogen 3.392 N/A GLU 170.A N VAL 166.A O no hydrogen 2.936 N/A GLU 171.A N GLY 167.A O no hydrogen 2.908 N/A ALA 172.A N TRP 168.A O no hydrogen 2.834 N/A ARG 173.A N LEU 169.A O no hydrogen 3.053 N/A ARG 173.A NE GLU 170.A OE1 no hydrogen 2.789 N/A ARG 173.A NH1 GLU 40.A OE2 no hydrogen 2.846 N/A ARG 173.A NH2 GLU 40.A OE1 no hydrogen 3.338 N/A ARG 173.A NH2 GLU 40.A OE2 no hydrogen 3.244 N/A ARG 173.A NH2 GLU 170.A OE1 no hydrogen 3.181 N/A ARG 173.A NH2 GLU 170.A OE2 no hydrogen 3.168 N/A ARG 174.A N GLU 170.A O no hydrogen 2.950 N/A THR 175.A N GLU 171.A O no hydrogen 2.818 N/A THR 175.A OG1 GLU 171.A O no hydrogen 2.847 N/A GLU 181.A N ASP 178.A OD1 no hydrogen 2.867 N/A TRP 182.A N ASP 178.A O no hydrogen 2.843 N/A MET 183.A N MET 179.A O no hydrogen 2.958 N/A ARG 184.A N ARG 180.A O no hydrogen 2.877 N/A ARG 184.A NE GLU 181.A OE1 no hydrogen 3.182 N/A ARG 184.A NH2 GLU 181.A OE2 no hydrogen 2.444 N/A ARG 185.A N GLU 181.A O no hydrogen 3.060 N/A ARG 185.A NE GLU 181.A OE2 no hydrogen 3.206 N/A ARG 185.A NH2 GLU 181.A OE2 no hydrogen 3.289 N/A SER 186.A N TRP 182.A O no hydrogen 2.951 N/A SER 186.A N MET 183.A O no hydrogen 3.118 N/A SER 186.A OG TRP 182.A O no hydrogen 3.310 N/A GLY 187.A N ARG 184.A O no hydrogen 3.181 N/A ALA 190.A N SER 186.A O no hydrogen 2.843 N/A GLN 191.A N GLY 187.A O no hydrogen 2.763 N/A GLN 191.A NE2 ASP 195.A OD2 no hydrogen 3.185 N/A GLN 192.A N PRO 188.A O no hydrogen 3.109 N/A LEU 193.A N TYR 189.A O no hydrogen 2.906 N/A VAL 194.A N ALA 190.A O no hydrogen 2.684 N/A ASP 195.A N GLN 191.A O no hydrogen 2.792 N/A SER 196.A N GLN 192.A O no hydrogen 2.848 N/A SER 196.A OG LEU 193.A O no hydrogen 2.733 N/A GLY 197.A N VAL 194.A O no hydrogen 3.275 N/A GLU 198.A N SER 196.A OG no hydrogen 3.037 N/A ALA 203.A N TYR 199.A O no hydrogen 3.217 N/A ARG 204.A N PRO 200.A O no hydrogen 2.854 N/A VAL 205.A N MET 201.A O no hydrogen 2.959 N/A VAL 205.A N PHE 202.A O no hydrogen 3.333 N/A LEU 206.A N ALA 203.A O no hydrogen 3.241 N/A THR 209.A N VAL 205.A O no hydrogen 3.103 N/A THR 209.A OG1 VAL 205.A O no hydrogen 3.110 N/A VAL 210.A N LEU 206.A O no hydrogen 2.784 N/A ALA 211.A N ALA 207.A O no hydrogen 3.047 N/A HIS 213.A N GLU 208.A OE1 no hydrogen 3.060 N/A HIS 213.A N GLU 208.A OE2 no hydrogen 3.040 N/A ARG 219.A N GLY 215.A O no hydrogen 2.924 N/A ARG 219.A NE MET 214.A O no hydrogen 3.142 N/A PHE 220.A N PRO 216.A O no hydrogen 2.764 N/A ARG 221.A N ASP 217.A O no hydrogen 3.080 N/A SER 222.A N GLN 218.A O no hydrogen 3.088 N/A SER 222.A OG GLN 218.A O no hydrogen 2.641 N/A GLY 223.A N ARG 219.A O no hydrogen 3.177 N/A LEU 224.A N PHE 220.A O no hydrogen 3.057 N/A GLU 225.A N ARG 221.A O no hydrogen 2.725 N/A ARG 226.A N SER 222.A O no hydrogen 2.889 N/A LEU 227.A N GLY 223.A O no hydrogen 2.820 N/A LEU 228.A N LEU 224.A O no hydrogen 2.787 N/A ASP 229.A N GLU 225.A O no hydrogen 3.021 N/A SER 230.A N ARG 226.A O no hydrogen 3.077 N/A SER 230.A OG LEU 227.A O no hydrogen 3.025 N/A ILE 231.A N LEU 227.A O no hydrogen 3.062 N/A GLY 232.A N LEU 228.A O no hydrogen 2.832 N/A ALA 233.A N ASP 229.A O no hydrogen 3.052 N/A SER 234.A N SER 230.A O no hydrogen 2.940 N/A SER 234.A OG SER 230.A O no hydrogen 2.997 N/A LEU 235.A N ILE 231.A O no hydrogen 2.932 N/A ASP 236.A N GLY 232.A O no hydrogen 3.330 N/A ASP 236.A N ALA 233.A O no hydrogen 3.061 N/A