Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4zgr_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N ASN 1.A OD1 no hydrogen 3.288 N/A CYS 4.A N ASN 1.A O no hydrogen 2.773 N/A SER 5.A N GLU 2.A O no hydrogen 3.090 N/A ARG 9.A N PHE 49.A O no hydrogen 3.147 N/A THR 10.A OG1 THR 48.A OG1 no hydrogen 2.687 N/A THR 11.A N TRP 47.A O no hydrogen 2.822 N/A THR 11.A OG1 ARG 12.A O no hydrogen 3.515 N/A ARG 12.A NE ASN 132.A O no hydrogen 3.224 N/A ARG 12.A NH1 GLY 40.A O no hydrogen 2.913 N/A ARG 12.A NH2 ASN 132.A O no hydrogen 2.757 N/A SER 14.A N ARG 129.A O no hydrogen 2.962 N/A SER 14.A OG SER 176.A OG no hydrogen 2.710 N/A GLY 15.A N LEU 19.A O no hydrogen 2.836 N/A ARG 16.A NH1 ALA 106.A O no hydrogen 2.832 N/A ASP 17.A N ASP 177.A OD2 no hydrogen 3.074 N/A GLY 18.A N GLY 15.A O no hydrogen 2.868 N/A LEU 19.A N ARG 16.A O no hydrogen 3.065 N/A CYS 20.A N TYR 37.A O no hydrogen 2.768 N/A CYS 20.A SG ILE 13.A O no hydrogen 3.822 N/A VAL 21.A N ILE 13.A O no hydrogen 2.754 N/A ASP 22.A N ILE 35.A O no hydrogen 2.980 N/A VAL 23.A N ASN 44.A O no hydrogen 3.007 N/A TYR 24.A N ARG 33.A O no hydrogen 3.061 N/A ALA 26.A N VAL 23.A O no hydrogen 2.923 N/A LEU 27.A N TYR 24.A O no hydrogen 3.236 N/A GLY 31.A N ILE 75.A O no hydrogen 2.933 N/A SER 32.A N ALA 29.A O no hydrogen 2.943 N/A SER 32.A OG ALA 29.A O no hydrogen 2.541 N/A ARG 33.A NE ASN 114.A OD1 no hydrogen 2.911 N/A VAL 34.A N VAL 73.A O no hydrogen 2.962 N/A ILE 35.A N ASP 22.A O no hydrogen 2.783 N/A LEU 36.A N THR 113.A O no hydrogen 2.965 N/A TYR 37.A N CYS 20.A O no hydrogen 2.965 N/A CYS 39.A SG GLY 18.A O no hydrogen 3.427 N/A GLY 40.A N GLN 45.A OE1 no hydrogen 2.762 N/A GLN 42.A N GLN 42.A OE1 no hydrogen 2.872 N/A ASN 44.A ND2 VAL 23.A O no hydrogen 2.937 N/A GLN 45.A N GLN 42.A O no hydrogen 3.025 N/A GLN 45.A NE2 ASP 22.A OD2 no hydrogen 3.004 N/A GLN 45.A NE2 PRO 38.A O no hydrogen 2.898 N/A GLN 46.A N GLN 43.A O no hydrogen 3.056 N/A GLN 46.A NE2 GLN 41.A O no hydrogen 3.321 N/A TRP 47.A N THR 11.A O no hydrogen 2.759 N/A TRP 47.A NE1 VAL 21.A O no hydrogen 2.951 N/A THR 48.A N ARG 56.A O no hydrogen 2.734 N/A THR 48.A OG1 THR 10.A OG1 no hydrogen 2.687 N/A PHE 49.A N ARG 9.A O no hydrogen 2.841 N/A TYR 50.A N THR 54.A O no hydrogen 3.257 N/A ASN 53.A N TYR 50.A O no hydrogen 3.094 N/A ASN 53.A ND2 ASP 85.A O no hydrogen 3.521 N/A THR 54.A N ASP 52.A OD1 no hydrogen 3.040 N/A THR 54.A OG1 ASP 52.A OD1 no hydrogen 2.602 N/A THR 54.A OG1 ASP 52.A OD2 no hydrogen 3.448 N/A ARG 56.A N THR 48.A O no hydrogen 2.900 N/A ARG 56.A NE THR 54.A OG1 no hydrogen 2.944 N/A ARG 56.A NH2 ASP 52.A OD2 no hydrogen 3.002 N/A ARG 56.A NH2 THR 54.A OG1 no hydrogen 3.339 N/A SER 57.A N LYS 60.A O no hydrogen 2.842 N/A SER 57.A OG GLN 43.A O no hydrogen 3.084 N/A SER 57.A OG GLN 46.A O no hydrogen 2.870 N/A LYS 60.A N SER 57.A O no hydrogen 2.965 N/A LYS 60.A NZ THR 28.A O no hydrogen 2.709 N/A LYS 60.A NZ ASP 30.A OD1 no hydrogen 2.777 N/A CYS 61.A N THR 76.A O no hydrogen 2.823 N/A LEU 62.A N ILE 55.A O no hydrogen 2.790 N/A ALA 63.A N VAL 74.A O no hydrogen 2.792 N/A SER 65.A OG ASN 72.A O no hydrogen 2.499 N/A GLY 70.A N GLY 117.A O no hydrogen 2.884 N/A VAL 73.A N LEU 115.A O no hydrogen 2.886 N/A VAL 74.A N ALA 63.A O no hydrogen 2.797 N/A ILE 75.A N SER 32.A O no hydrogen 2.934 N/A THR 76.A N CYS 61.A O no hydrogen 2.927 N/A ASN 77.A N ASP 30.A OD1 no hydrogen 3.227 N/A CYS 78.A SG GLY 59.A O no hydrogen 3.985 N/A ASP 79.A N ASN 77.A OD1 no hydrogen 2.920 N/A TYR 80.A N ASN 77.A O no hydrogen 3.188 N/A TYR 80.A OH ASP 30.A OD2 no hydrogen 3.194 N/A LEU 81.A N CYS 78.A O no hydrogen 3.089 N/A ARG 82.A N ASP 79.A O no hydrogen 3.133 N/A ASP 84.A N LEU 81.A O no hydrogen 2.701 N/A GLY 86.A N ASP 84.A OD2 no hydrogen 2.870 N/A TRP 87.A N ASN 53.A O no hydrogen 2.999 N/A TRP 87.A NE1 LEU 62.A O no hydrogen 2.937 N/A MET 88.A N MET 96.A O no hydrogen 2.860 N/A SER 90.A N THR 94.A O no hydrogen 2.940 N/A SER 90.A OG SER 92.A OG no hydrogen 3.110 N/A SER 92.A N SER 90.A OG no hydrogen 3.240 N/A SER 92.A OG SER 90.A OG no hydrogen 3.110 N/A GLY 93.A N SER 90.A O no hydrogen 2.937 N/A THR 94.A N SER 90.A OG no hydrogen 3.139 N/A MET 96.A N MET 88.A O no hydrogen 2.874 N/A ASN 97.A N LEU 102.A O no hydrogen 2.851 N/A LYS 98.A N GLY 86.A O no hydrogen 3.056 N/A SER 100.A N ASN 97.A OD1 no hydrogen 2.868 N/A HIS 101.A N ASN 97.A O no hydrogen 2.814 N/A LEU 102.A N SER 100.A OG no hydrogen 3.299 N/A VAL 103.A N GLU 118.A O no hydrogen 2.802 N/A LEU 104.A N MET 95.A O no hydrogen 2.933 N/A THR 105.A N THR 116.A O no hydrogen 2.907 N/A THR 105.A OG1 VAL 103.A O no hydrogen 2.929 N/A ALA 106.A N LYS 125.A O no hydrogen 2.968 N/A ASN 107.A ND2 GLU 118.A OE2 no hydrogen 2.837 N/A THR 110.A OG1 THR 113.A OG1 no hydrogen 3.126 N/A ARG 112.A N LEU 36.A O no hydrogen 2.752 N/A THR 113.A N THR 110.A O no hydrogen 3.083 N/A THR 113.A OG1 THR 110.A O no hydrogen 2.679 N/A THR 113.A OG1 THR 110.A OG1 no hydrogen 3.126 N/A LEU 115.A N VAL 34.A O no hydrogen 2.971 N/A THR 116.A N THR 105.A O no hydrogen 2.985 N/A THR 116.A OG1 GLU 118.A OE2 no hydrogen 2.854 N/A GLY 117.A N SER 71.A O no hydrogen 2.977 N/A GLU 118.A N VAL 103.A O no hydrogen 2.998 N/A VAL 121.A N GLN 126.A OE1 no hydrogen 2.947 N/A PHE 122.A N ASN 120.A OD1 no hydrogen 3.067 N/A ALA 123.A N GLN 126.A OE1 no hydrogen 3.319 N/A ALA 124.A N SER 209.A O no hydrogen 3.210 N/A LYS 125.A N GLY 208.A O no hydrogen 3.109 N/A LYS 125.A NZ ASN 107.A OD1 no hydrogen 2.912 N/A GLN 126.A N ALA 123.A O no hydrogen 2.844 N/A GLN 126.A NE2 THR 105.A OG1 no hydrogen 3.069 N/A GLN 126.A NE2 ASN 119.A O no hydrogen 2.994 N/A ALA 127.A N ALA 124.A O no hydrogen 3.025 N/A TRP 128.A N GLY 93.A O no hydrogen 3.001 N/A TRP 128.A NE1 LEU 104.A O no hydrogen 2.942 N/A ARG 129.A N SER 14.A O no hydrogen 2.763 N/A ARG 129.A NH1 TYR 133.A O no hydrogen 2.995 N/A ARG 129.A NH1 GLU 135.A O no hydrogen 2.764 N/A ARG 129.A NH2 GLU 135.A O no hydrogen 3.367 N/A GLY 131.A N ARG 12.A O no hydrogen 2.849 N/A ILE 137.A N LEU 174.A O no hydrogen 2.897 N/A THR 139.A N TRP 172.A O no hydrogen 2.739 N/A THR 139.A OG1 THR 140.A O no hydrogen 2.825 N/A THR 140.A N PHE 260.A O no hydrogen 2.896 N/A THR 140.A OG1 PHE 260.A O no hydrogen 3.094 N/A ILE 142.A N THR 258.A O no hydrogen 2.821 N/A GLY 143.A N MET 147.A O no hydrogen 2.783 N/A MET 147.A N LEU 144.A O no hydrogen 3.259 N/A CYS 148.A N GLU 161.A O no hydrogen 2.759 N/A LEU 149.A N ILE 141.A O no hydrogen 2.937 N/A GLU 150.A N TRP 159.A O no hydrogen 2.828 N/A ALA 151.A N LYS 169.A O no hydrogen 2.972 N/A THR 152.A N ASN 157.A O no hydrogen 2.861 N/A THR 156.A N THR 152.A O no hydrogen 3.045 N/A THR 156.A N ASP 153.A O no hydrogen 3.257 N/A THR 156.A OG1 ASP 153.A O no hydrogen 2.707 N/A ASN 157.A N THR 152.A O no hydrogen 3.079 N/A ASN 157.A ND2 ASP 153.A OD2 no hydrogen 2.817 N/A TRP 159.A N GLU 150.A O no hydrogen 3.249 N/A TRP 159.A NE1 GLU 161.A OE2 no hydrogen 2.762 N/A GLU 161.A N CYS 148.A O no hydrogen 2.922 N/A CYS 163.A SG HIS 146.A O no hydrogen 3.575 N/A VAL 164.A N GLN 170.A OE1 no hydrogen 2.975 N/A ASN 166.A N TYR 171.A OH no hydrogen 2.766 N/A LYS 167.A N VAL 164.A O no hydrogen 2.947 N/A LYS 167.A NZ GLU 150.A OE1 no hydrogen 2.757 N/A LYS 167.A NZ GLU 150.A OE2 no hydrogen 3.266 N/A LYS 169.A NZ ASP 155.A OD1 no hydrogen 2.989 N/A LYS 169.A NZ ASP 155.A OD2 no hydrogen 2.945 N/A LYS 169.A NZ ASN 184.A OD1 no hydrogen 2.885 N/A GLN 170.A N LYS 167.A O no hydrogen 3.056 N/A GLN 170.A NE2 GLU 150.A OE1 no hydrogen 2.912 N/A GLN 170.A NE2 SER 162.A O no hydrogen 3.061 N/A TYR 171.A N THR 168.A O no hydrogen 3.319 N/A TRP 172.A N THR 139.A O no hydrogen 2.716 N/A TRP 172.A NE1 LEU 149.A O no hydrogen 3.127 N/A ALA 173.A N ARG 181.A O no hydrogen 2.794 N/A LEU 174.A N ILE 137.A O no hydrogen 2.795 N/A TYR 175.A N THR 179.A O no hydrogen 3.077 N/A SER 176.A OG SER 14.A OG no hydrogen 2.710 N/A SER 176.A OG VAL 134.A O no hydrogen 3.389 N/A ASP 178.A N TYR 175.A O no hydrogen 3.081 N/A THR 179.A N ASP 177.A OD1 no hydrogen 3.174 N/A THR 179.A OG1 ASP 177.A OD1 no hydrogen 2.572 N/A ARG 181.A N ALA 173.A O no hydrogen 2.895 N/A ARG 181.A NE THR 179.A OG1 no hydrogen 2.776 N/A ARG 181.A NH1 ASP 17.A OD1 no hydrogen 3.313 N/A ARG 181.A NH1 ARG 186.A O no hydrogen 2.952 N/A ARG 181.A NH2 ASP 17.A OD1 no hydrogen 2.851 N/A ARG 181.A NH2 ASP 177.A OD2 no hydrogen 2.911 N/A VAL 182.A N LEU 188.A O no hydrogen 3.019 N/A ASN 183.A N TYR 171.A O no hydrogen 3.249 N/A ASN 185.A N VAL 182.A O no hydrogen 3.101 N/A ARG 186.A NE ASN 183.A O no hydrogen 2.983 N/A ARG 186.A NH2 ASN 183.A OD1 no hydrogen 2.602 N/A ASN 187.A N ASN 185.A OD1 no hydrogen 3.339 N/A LEU 188.A N ASN 185.A O no hydrogen 3.070 N/A CYS 189.A N ARG 204.A O no hydrogen 2.769 N/A CYS 189.A SG GLN 212.A OE1 no hydrogen 3.960 N/A VAL 190.A N ILE 180.A O no hydrogen 2.837 N/A SER 191.A N VAL 202.A O no hydrogen 2.756 N/A SER 191.A OG SER 192.A O no hydrogen 2.759 N/A SER 192.A N ASN 211.A O no hydrogen 2.926 N/A SER 193.A OG ASP 195.A O no hydrogen 2.663 N/A SER 193.A OG SER 198.A O no hydrogen 2.896 N/A ASP 195.A N SER 193.A OG no hydrogen 2.935 N/A SER 197.A N ASP 195.A OD1 no hydrogen 2.955 N/A SER 198.A N ASP 195.A O no hydrogen 2.864 N/A LEU 200.A N SER 198.A OG no hydrogen 3.055 N/A ILE 201.A N ILE 243.A O no hydrogen 2.826 N/A VAL 202.A N SER 191.A O no hydrogen 2.816 N/A ILE 203.A N THR 156.A O no hydrogen 3.019 N/A ARG 204.A N CYS 189.A O no hydrogen 2.955 N/A ARG 204.A NH1 THR 156.A O no hydrogen 3.163 N/A ARG 204.A NH1 ILE 203.A O no hydrogen 2.825 N/A ARG 205.A NH1 ASN 187.A O no hydrogen 3.247 N/A CYS 206.A N ASN 187.A O no hydrogen 2.873 N/A ASP 207.A N GLN 212.A OE1 no hydrogen 2.817 N/A SER 209.A N ASP 207.A OD1 no hydrogen 2.910 N/A SER 209.A OG ASP 207.A OD1 no hydrogen 2.655 N/A ASN 211.A ND2 SER 192.A O no hydrogen 3.245 N/A GLN 212.A N SER 209.A O no hydrogen 3.210 N/A GLN 212.A NE2 ARG 205.A O no hydrogen 2.960 N/A ARG 213.A N ILE 210.A O no hydrogen 3.286 N/A ARG 213.A NE ASP 178.A OD2 no hydrogen 2.687 N/A ARG 213.A NH2 SER 92.A O no hydrogen 2.985 N/A ARG 213.A NH2 THR 94.A OG1 no hydrogen 3.365 N/A ARG 213.A NH2 ASP 178.A OD2 no hydrogen 3.338 N/A TRP 214.A N ASP 178.A O no hydrogen 2.890 N/A TRP 214.A NE1 VAL 190.A O no hydrogen 2.940 N/A VAL 215.A N SER 223.A O no hydrogen 2.774 N/A THR 217.A N THR 221.A O no hydrogen 2.948 N/A THR 217.A OG1 THR 221.A O no hydrogen 3.284 N/A THR 217.A OG1 THR 221.A OG1 no hydrogen 2.692 N/A GLN 219.A N GLN 219.A OE1 no hydrogen 2.708 N/A GLY 220.A N THR 217.A O no hydrogen 3.069 N/A THR 221.A N THR 217.A OG1 no hydrogen 3.018 N/A THR 221.A OG1 THR 217.A OG1 no hydrogen 2.692 N/A SER 223.A N VAL 215.A O no hydrogen 2.781 N/A ASN 224.A N ALA 229.A O no hydrogen 2.828 N/A ASN 224.A ND2 ILE 210.A O no hydrogen 2.905 N/A TYR 227.A N ASN 224.A OD1 no hydrogen 3.116 N/A TYR 227.A OH ASN 211.A OD1 no hydrogen 3.053 N/A GLU 228.A N PRO 225.A O no hydrogen 3.214 N/A ALA 229.A N ASN 224.A O no hydrogen 3.375 N/A VAL 230.A N SER 246.A O no hydrogen 2.744 N/A MET 231.A N ILE 222.A O no hydrogen 2.906 N/A ASP 232.A N VAL 244.A O no hydrogen 2.716 N/A VAL 233.A N GLY 254.A O no hydrogen 3.225 N/A ALA 234.A N LYS 242.A O no hydrogen 2.831 N/A ASN 236.A N VAL 233.A O no hydrogen 2.958 N/A ASP 237.A N ALA 234.A O no hydrogen 2.897 N/A TYR 239.A N ASP 237.A OD1 no hydrogen 2.943 N/A LEU 240.A N ASP 237.A O no hydrogen 3.159 N/A LYS 241.A N VAL 238.A O no hydrogen 3.185 N/A LYS 241.A NZ GLU 161.A OE2 no hydrogen 3.314 N/A VAL 244.A N ASP 232.A O no hydrogen 2.737 N/A LEU 245.A N LYS 199.A O no hydrogen 3.054 N/A SER 246.A N VAL 230.A O no hydrogen 2.927 N/A SER 246.A OG ASP 232.A OD2 no hydrogen 3.261 N/A THR 249.A N GLN 255.A OE1 no hydrogen 2.903 N/A LYS 251.A N THR 249.A OG1 no hydrogen 3.306 N/A GLY 254.A N ASN 236.A OD1 no hydrogen 2.772 N/A GLN 255.A NE2 ASP 232.A OD2 no hydrogen 3.073 N/A GLN 255.A NE2 SER 247.A O no hydrogen 3.033 N/A GLN 256.A N ASN 253.A O no hydrogen 3.190 N/A GLN 256.A NE2 GLN 219.A O no hydrogen 2.946 N/A TRP 257.A N GLY 220.A O no hydrogen 2.898 N/A TRP 257.A NE1 MET 231.A O no hydrogen 3.180 N/A THR 258.A N ILE 142.A O no hydrogen 2.744 N/A PHE 260.A N THR 140.A O no hydrogen 2.904 N/A