Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1zd1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N GLU 2.A O no hydrogen 3.004 N/A LYS 6.A N PHE 3.A O no hydrogen 3.188 N/A PHE 8.A N LEU 15.A O no hydrogen 2.809 N/A GLU 9.A N GLU 2.A OE2 no hydrogen 2.877 N/A PHE 10.A N VAL 13.A O no hydrogen 2.805 N/A VAL 13.A N PHE 10.A O no hydrogen 3.144 N/A ARG 14.A NH1 LYS 136.A O no hydrogen 3.083 N/A LEU 15.A N PHE 8.A O no hydrogen 2.571 N/A CYS 19.A N PRO 16.A O no hydrogen 3.048 N/A ARG 20.A N PRO 17.A O no hydrogen 3.239 N/A ARG 20.A NH2 GLU 2.A OE2 no hydrogen 2.826 N/A LYS 22.A NZ PHE 18.A O no hydrogen 3.096 N/A LYS 22.A NZ GLU 66.A O no hydrogen 2.812 N/A ILE 26.A N LYS 22.A O no hydrogen 3.187 N/A ALA 27.A N MET 23.A O no hydrogen 2.800 N/A ASN 28.A N GLU 24.A O no hydrogen 2.965 N/A PHE 29.A N ILE 26.A O no hydrogen 3.141 N/A VAL 31.A N ASP 96.A OD2 no hydrogen 2.884 N/A ARG 32.A N ASP 35.A OD2 no hydrogen 2.792 N/A ARG 32.A NH1 LEU 78.A O no hydrogen 2.666 N/A ARG 32.A NH1 SER 80.A OG no hydrogen 2.476 N/A ARG 32.A NH2 LYS 76.A O no hydrogen 2.592 N/A ARG 32.A NH2 LEU 78.A O no hydrogen 2.806 N/A ASP 35.A N ARG 32.A O no hydrogen 3.107 N/A VAL 36.A N ARG 82.A O no hydrogen 2.846 N/A TRP 37.A N LYS 103.A O no hydrogen 2.957 N/A ILE 38.A N ILE 84.A O no hydrogen 3.002 N/A VAL 39.A N ILE 105.A O no hydrogen 2.761 N/A THR 40.A N SER 86.A O no hydrogen 3.108 N/A THR 40.A OG1 TYR 41.A O no hydrogen 3.458 N/A THR 40.A OG1 HIS 87.A ND1 no hydrogen 2.866 N/A TYR 41.A OH GLY 140.A O no hydrogen 2.596 N/A SER 44.A OG TYR 41.A O no hydrogen 2.600 N/A LEU 49.A N THR 46.A O no hydrogen 2.838 N/A GLN 50.A N THR 46.A O no hydrogen 3.274 N/A GLN 50.A NE2 THR 46.A OG1 no hydrogen 2.917 N/A GLU 51.A N SER 47.A O no hydrogen 2.939 N/A VAL 52.A N LEU 48.A O no hydrogen 3.124 N/A VAL 53.A N LEU 49.A O no hydrogen 3.134 N/A TYR 54.A N GLN 50.A O no hydrogen 2.979 N/A LEU 55.A N GLU 51.A O no hydrogen 2.886 N/A VAL 56.A N VAL 52.A O no hydrogen 2.824 N/A SER 57.A N VAL 53.A O no hydrogen 2.898 N/A SER 57.A OG VAL 53.A O no hydrogen 3.404 N/A SER 57.A OG TYR 54.A O no hydrogen 3.039 N/A GLN 58.A N VAL 56.A O no hydrogen 2.597 N/A LEU 65.A N LYS 85.A O no hydrogen 2.834 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.939 N/A TYR 67.A N VAL 64.A O no hydrogen 3.061 N/A ILE 75.A N GLY 71.A O no hydrogen 3.293 N/A LYS 76.A N LEU 72.A O no hydrogen 2.887 N/A GLU 77.A N ILE 74.A O no hydrogen 3.000 N/A LEU 78.A N ILE 74.A O no hydrogen 3.274 N/A LEU 78.A N ILE 75.A O no hydrogen 3.419 N/A ARG 82.A NE ASP 35.A OD1 no hydrogen 2.848 N/A ARG 82.A NH1 ILE 75.A O no hydrogen 2.972 N/A ARG 82.A NH2 PRO 30.A O no hydrogen 2.918 N/A ARG 82.A NH2 ASP 35.A OD1 no hydrogen 3.355 N/A ARG 82.A NH2 ASP 35.A OD2 no hydrogen 3.103 N/A ILE 84.A N VAL 36.A O no hydrogen 2.855 N/A LYS 85.A N PRO 63.A O no hydrogen 2.823 N/A LYS 85.A NZ GLN 50.A OE1 no hydrogen 2.743 N/A SER 86.A N ILE 38.A O no hydrogen 2.983 N/A SER 86.A OG GLU 66.A OE1 no hydrogen 2.568 N/A SER 86.A OG GLU 66.A OE2 no hydrogen 3.360 N/A HIS 87.A N GLU 66.A OE2 no hydrogen 2.943 N/A HIS 87.A ND1 THR 40.A O no hydrogen 2.802 N/A LEU 88.A N SER 86.A OG no hydrogen 3.163 N/A ARG 91.A N GLU 148.A OE1 no hydrogen 3.344 N/A ARG 91.A NH1 HIS 11.A O no hydrogen 3.124 N/A ARG 91.A NH2 HIS 11.A O no hydrogen 2.737 N/A PHE 92.A N PRO 89.A O no hydrogen 2.790 N/A LEU 93.A N TYR 90.A O no hydrogen 3.035 N/A SER 95.A N ALA 27.A O no hydrogen 2.741 N/A SER 95.A OG ALA 27.A O no hydrogen 3.192 N/A LEU 97.A N PRO 94.A O no hydrogen 2.808 N/A HIS 98.A NE2 TYR 90.A O no hydrogen 2.826 N/A ASN 99.A N SER 95.A O no hydrogen 3.317 N/A ASN 99.A N ASP 96.A O no hydrogen 3.284 N/A GLY 100.A N LEU 97.A O no hydrogen 3.218 N/A ASP 101.A N ASP 96.A O no hydrogen 3.203 N/A SER 102.A OG ARG 32.A O no hydrogen 3.460 N/A SER 102.A OG ASP 35.A O no hydrogen 2.798 N/A LYS 103.A N SER 102.A OG no hydrogen 2.574 N/A LYS 103.A NZ PHE 180.A O no hydrogen 2.525 N/A VAL 104.A N ASN 157.A O no hydrogen 2.706 N/A ILE 105.A N TRP 37.A O no hydrogen 2.655 N/A TYR 106.A N LEU 159.A O no hydrogen 2.866 N/A TYR 106.A OH HIS 145.A ND1 no hydrogen 2.900 N/A MET 107.A N VAL 39.A O no hydrogen 2.867 N/A ALA 108.A N LEU 161.A O no hydrogen 2.823 N/A ARG 109.A NH1 SER 44.A O no hydrogen 2.854 N/A ARG 109.A NH1 ARG 214.A O no hydrogen 2.822 N/A ARG 109.A NH2 ARG 214.A O no hydrogen 2.771 N/A ASN 110.A N GLU 164.A OE2 no hydrogen 2.900 N/A ASN 110.A ND2 ASP 113.A OD2 no hydrogen 2.807 N/A ASN 110.A ND2 GLU 164.A OE2 no hydrogen 3.173 N/A ASN 110.A ND2 ASP 248.A O no hydrogen 3.421 N/A LYS 112.A NZ ASN 229.A OD1 no hydrogen 2.725 N/A LYS 112.A NZ ASP 233.A OD1 no hydrogen 2.439 N/A LYS 112.A NZ ASP 233.A OD2 no hydrogen 3.485 N/A ASP 113.A N ASN 110.A OD1 no hydrogen 2.895 N/A LEU 114.A N ASN 110.A O no hydrogen 3.228 N/A VAL 115.A N PRO 111.A O no hydrogen 3.175 N/A VAL 116.A N LYS 112.A O no hydrogen 3.410 N/A SER 117.A N ASP 113.A O no hydrogen 2.899 N/A SER 117.A OG LYS 43.A O no hydrogen 2.860 N/A TYR 118.A N LEU 114.A O no hydrogen 2.782 N/A TYR 119.A N VAL 115.A O no hydrogen 2.935 N/A TYR 119.A OH GLY 123.A O no hydrogen 3.388 N/A GLN 120.A N VAL 116.A O no hydrogen 2.703 N/A PHE 121.A N TYR 118.A O no hydrogen 3.240 N/A GLN 126.A N GLN 126.A OE1 no hydrogen 2.860 N/A GLU 127.A N THR 124.A O no hydrogen 3.000 N/A GLU 127.A N THR 124.A OG1 no hydrogen 2.876 N/A PHE 128.A N THR 124.A O no hydrogen 3.050 N/A CYS 129.A N PHE 125.A O no hydrogen 2.809 N/A ARG 130.A N GLN 126.A O no hydrogen 3.115 N/A ARG 130.A NH1 GLU 127.A OE1 no hydrogen 2.908 N/A ARG 131.A N GLU 127.A O no hydrogen 2.783 N/A PHE 132.A N PHE 128.A O no hydrogen 2.785 N/A MET 133.A N CYS 129.A O no hydrogen 2.848 N/A ASN 134.A N ARG 130.A O no hydrogen 2.945 N/A ASP 135.A N PHE 132.A O no hydrogen 3.177 N/A LYS 136.A N ARG 131.A O no hydrogen 2.959 N/A TYR 139.A N ARG 14.A O no hydrogen 2.531 N/A TYR 139.A OH GLU 66.A OE2 no hydrogen 2.592 N/A GLY 140.A N LEU 137.A O no hydrogen 3.086 N/A GLU 144.A N SER 141.A OG no hydrogen 2.714 N/A HIS 145.A N SER 141.A O no hydrogen 2.982 N/A HIS 145.A ND1 TYR 106.A OH no hydrogen 2.900 N/A HIS 145.A NE2 HIS 87.A O no hydrogen 2.619 N/A VAL 146.A N TRP 142.A O no hydrogen 2.973 N/A GLN 147.A N PHE 143.A O no hydrogen 3.156 N/A GLN 147.A NE2 LYS 239.A O no hydrogen 2.988 N/A GLU 148.A N GLU 144.A O no hydrogen 3.243 N/A TRP 150.A N VAL 146.A O no hydrogen 2.935 N/A TRP 150.A NE1 ASP 244.A OD1 no hydrogen 2.790 N/A GLU 151.A N GLN 147.A O no hydrogen 2.916 N/A HIS 152.A N PHE 149.A O no hydrogen 3.124 N/A HIS 152.A ND1 GLU 148.A O no hydrogen 2.998 N/A ARG 153.A N TRP 150.A O no hydrogen 3.171 N/A ARG 153.A NH1 TRP 150.A O no hydrogen 2.808 N/A ASP 155.A N HIS 152.A O no hydrogen 3.247 N/A ASN 157.A ND2 LEU 97.A O no hydrogen 2.870 N/A ASN 157.A ND2 ASP 101.A O no hydrogen 2.891 N/A VAL 158.A N ASP 155.A O no hydrogen 3.356 N/A LEU 159.A N VAL 104.A O no hydrogen 2.954 N/A LEU 161.A N TYR 106.A O no hydrogen 2.663 N/A LYS 162.A NZ THR 246.A O no hydrogen 2.862 N/A TYR 163.A N ALA 108.A O no hydrogen 2.649 N/A TYR 163.A OH GLY 215.A O no hydrogen 2.562 N/A ASP 165.A N LYS 162.A O no hydrogen 2.921 N/A MET 166.A N TYR 163.A O no hydrogen 2.999 N/A HIS 167.A N GLU 164.A O no hydrogen 3.174 N/A HIS 167.A NE2 TYR 163.A OH no hydrogen 2.993 N/A ARG 168.A N GLU 164.A O no hydrogen 3.027 N/A ARG 168.A NH1 ASP 165.A OD1 no hydrogen 2.830 N/A ASP 169.A N ASP 165.A O no hydrogen 2.735 N/A THR 172.A N ASP 169.A OD1 no hydrogen 3.256 N/A THR 172.A OG1 ASP 169.A OD1 no hydrogen 3.215 N/A THR 172.A OG1 ASP 169.A OD2 no hydrogen 2.669 N/A MET 173.A N ASP 169.A O no hydrogen 3.319 N/A VAL 174.A N LEU 170.A O no hydrogen 2.842 N/A GLU 175.A N THR 172.A O no hydrogen 3.197 N/A GLN 176.A N THR 172.A O no hydrogen 2.863 N/A LEU 177.A N MET 173.A O no hydrogen 2.978 N/A ALA 178.A N VAL 174.A O no hydrogen 2.977 N/A ARG 179.A N GLU 175.A O no hydrogen 2.780 N/A ARG 179.A NE GLU 175.A OE2 no hydrogen 2.653 N/A ARG 179.A NH2 GLU 175.A OE2 no hydrogen 2.887 N/A PHE 180.A N GLN 176.A O no hydrogen 2.975 N/A LEU 181.A N LEU 177.A O no hydrogen 2.945 N/A GLY 182.A N ARG 179.A O no hydrogen 3.160 N/A VAL 183.A N ALA 178.A O no hydrogen 3.096 N/A CYS 185.A SG VAL 183.A O no hydrogen 4.021 N/A ASP 186.A N GLN 189.A OE1 no hydrogen 2.785 N/A GLN 189.A N ASP 186.A OD1 no hydrogen 2.890 N/A LEU 190.A N ASP 186.A O no hydrogen 3.070 N/A GLU 191.A N LYS 187.A O no hydrogen 2.961 N/A ALA 192.A N ALA 188.A O no hydrogen 2.868 N/A LEU 193.A N GLN 189.A O no hydrogen 2.870 N/A THR 194.A N LEU 190.A O no hydrogen 2.980 N/A THR 194.A OG1 LEU 190.A O no hydrogen 2.827 N/A GLU 195.A N GLU 191.A O no hydrogen 3.011 N/A HIS 196.A N ALA 192.A O no hydrogen 3.026 N/A CYS 197.A N LEU 193.A O no hydrogen 3.024 N/A CYS 197.A SG LEU 193.A O no hydrogen 3.392 N/A HIS 198.A N THR 194.A O no hydrogen 2.683 N/A GLN 199.A N GLU 195.A O no hydrogen 2.855 N/A GLN 199.A NE2 GLU 195.A OE2 no hydrogen 3.011 N/A LEU 200.A N HIS 196.A O no hydrogen 3.040 N/A VAL 201.A N CYS 197.A O no hydrogen 2.986 N/A ASP 202.A N HIS 198.A O no hydrogen 2.896 N/A CYS 204.A N VAL 201.A O no hydrogen 2.911 N/A CYS 205.A N ASP 202.A O no hydrogen 3.183 N/A CYS 205.A SG VAL 201.A O no hydrogen 3.765 N/A ASN 206.A N LEU 210.A O no hydrogen 3.023 N/A GLU 208.A N ASN 206.A OD1 no hydrogen 3.110 N/A ALA 209.A N ASN 206.A O no hydrogen 2.846 N/A VAL 212.A N CYS 204.A O no hydrogen 3.391 N/A ARG 214.A NH1 SER 117.A OG no hydrogen 2.814 N/A ARG 216.A N GLY 213.A O no hydrogen 2.930 N/A ARG 216.A NH2 ASP 222.A OD2 no hydrogen 2.800 N/A GLY 218.A N ASP 113.A OD2 no hydrogen 2.849 N/A TRP 220.A N ASP 113.A OD1 no hydrogen 2.936 N/A TRP 220.A NE1 PHE 249.A O no hydrogen 2.725 N/A LYS 221.A N GLY 218.A O no hydrogen 3.119 N/A ASP 222.A N LEU 219.A O no hydrogen 3.165 N/A ILE 223.A N TRP 220.A O no hydrogen 3.061 N/A PHE 224.A N TRP 220.A O no hydrogen 2.789 N/A MET 228.A N THR 225.A OG1 no hydrogen 3.342 N/A ASN 229.A N THR 225.A O no hydrogen 2.880 N/A GLU 230.A N VAL 226.A O no hydrogen 2.914 N/A LYS 231.A N SER 227.A O no hydrogen 2.715 N/A PHE 232.A N MET 228.A O no hydrogen 2.767 N/A ASP 233.A N ASN 229.A O no hydrogen 3.050 N/A LEU 234.A N LYS 231.A O no hydrogen 3.270 N/A VAL 235.A N LYS 231.A O no hydrogen 3.132 N/A TYR 236.A N PHE 232.A O no hydrogen 2.755 N/A LYS 237.A N ASP 233.A O no hydrogen 2.960 N/A GLN 238.A N LEU 234.A O no hydrogen 3.313 N/A LYS 239.A N VAL 235.A O no hydrogen 2.806 N/A MET 240.A N TYR 236.A O no hydrogen 2.981 N/A GLY 241.A N LYS 237.A O no hydrogen 3.316 N/A CYS 243.A N MET 240.A O no hydrogen 3.164 N/A