Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zgy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N PRO 26.A O no hydrogen 3.228 N/A THR 5.A N LEU 57.A O no hydrogen 2.993 N/A THR 5.A OG1 ALA 51.A O no hydrogen 2.709 N/A THR 5.A OG1 SER 55.A OG no hydrogen 2.534 N/A VAL 6.A N THR 28.A O no hydrogen 2.924 N/A ILE 7.A N VAL 59.A O no hydrogen 2.803 N/A GLY 8.A N TRP 30.A O no hydrogen 3.050 N/A LEU 9.A N ASN 31.A OD1 no hydrogen 2.734 N/A GLN 14.A N GLY 10.A O no hydrogen 3.062 N/A ALA 15.A N LEU 11.A O no hydrogen 3.031 N/A LEU 16.A N MET 12.A O no hydrogen 2.872 N/A ALA 17.A N GLY 13.A O no hydrogen 2.914 N/A GLY 18.A N GLN 14.A O no hydrogen 2.759 N/A ALA 19.A N ALA 15.A O no hydrogen 3.003 N/A PHE 20.A N LEU 16.A O no hydrogen 3.176 N/A LEU 21.A N ALA 17.A O no hydrogen 3.006 N/A GLY 22.A N GLY 18.A O no hydrogen 2.829 N/A ALA 23.A N PHE 20.A O no hydrogen 3.313 N/A GLY 24.A N LEU 21.A O no hydrogen 2.767 N/A HIS 25.A N PHE 20.A O no hydrogen 2.988 N/A HIS 25.A ND1 THR 2.A O no hydrogen 2.628 N/A THR 27.A OG1 HIS 25.A O no hydrogen 2.794 N/A THR 28.A N VAL 4.A O no hydrogen 3.118 N/A VAL 29.A N LYS 43.A O no hydrogen 3.105 N/A TRP 30.A N VAL 6.A O no hydrogen 3.225 N/A ASN 31.A ND2 THR 33.A O no hydrogen 2.748 N/A ARG 40.A N PRO 36.A O no hydrogen 2.872 N/A GLY 41.A N VAL 38.A O no hydrogen 3.172 N/A ALA 42.A N LEU 37.A O no hydrogen 3.000 N/A LYS 43.A N THR 27.A O no hydrogen 3.094 N/A GLU 50.A N SER 47.A OG no hydrogen 3.109 N/A ALA 51.A N SER 47.A O no hydrogen 3.036 N/A VAL 52.A N VAL 48.A O no hydrogen 2.911 N/A ALA 53.A N ALA 49.A O no hydrogen 3.000 N/A ALA 54.A N GLU 50.A O no hydrogen 3.185 N/A ALA 54.A N ALA 51.A O no hydrogen 3.288 N/A SER 55.A N VAL 52.A O no hydrogen 3.493 N/A SER 55.A OG THR 5.A OG1 no hydrogen 2.534 N/A VAL 58.A N THR 84.A O no hydrogen 2.847 N/A VAL 59.A N THR 5.A O no hydrogen 2.787 N/A VAL 60.A N VAL 86.A O no hydrogen 2.883 N/A CYS 61.A N ILE 7.A O no hydrogen 2.842 N/A VAL 62.A N THR 89.A OG1 no hydrogen 3.327 N/A TYR 65.A OH THR 89.A O no hydrogen 3.360 N/A TYR 65.A OH ASP 112.A OD2 no hydrogen 2.477 N/A ALA 67.A N ASP 64.A OD1 no hydrogen 3.056 N/A VAL 68.A N ASP 64.A O no hydrogen 3.197 N/A HIS 69.A N TYR 65.A O no hydrogen 2.715 N/A HIS 69.A ND1 ASP 73.A OD2 no hydrogen 2.752 N/A ALA 70.A N ASP 66.A O no hydrogen 2.923 N/A LEU 71.A N ALA 67.A O no hydrogen 2.907 N/A LEU 72.A N VAL 68.A O no hydrogen 2.897 N/A ASP 73.A N HIS 69.A O no hydrogen 2.962 N/A LEU 75.A N LEU 72.A O no hydrogen 3.086 N/A ALA 79.A N ASP 76.A O no hydrogen 3.099 N/A GLN 81.A N THR 78.A O no hydrogen 2.999 N/A GLY 82.A N GLY 107.A O no hydrogen 2.945 N/A ARG 83.A N LEU 80.A O no hydrogen 2.895 N/A ARG 83.A NE SER 55.A O no hydrogen 3.018 N/A ARG 83.A NH2 SER 55.A O no hydrogen 3.251 N/A THR 84.A N PRO 56.A O no hydrogen 2.930 N/A THR 84.A OG1 HIS 141.A NE2 no hydrogen 3.115 N/A LEU 85.A N ASP 109.A O no hydrogen 2.826 N/A VAL 86.A N VAL 58.A O no hydrogen 2.851 N/A ASN 87.A N LEU 111.A O no hydrogen 2.848 N/A ASN 87.A ND2 TYR 110.A OH no hydrogen 2.977 N/A LEU 88.A N VAL 60.A O no hydrogen 2.943 N/A THR 89.A N ASN 87.A OD1 no hydrogen 3.210 N/A THR 89.A OG1 ASN 87.A OD1 no hydrogen 2.811 N/A SER 90.A OG ASP 166.A OD2 no hydrogen 3.490 N/A GLN 95.A N THR 92.A OG1 no hydrogen 3.252 N/A ALA 96.A N THR 92.A O no hydrogen 3.010 N/A ARG 97.A N SER 93.A O no hydrogen 2.849 N/A ARG 97.A NE ASP 158.A OD1 no hydrogen 3.032 N/A ARG 97.A NH2 ASP 158.A OD1 no hydrogen 3.168 N/A ARG 97.A NH2 ASP 158.A OD2 no hydrogen 2.749 N/A GLU 98.A N ALA 94.A O no hydrogen 3.019 N/A ARG 99.A N GLN 95.A O no hydrogen 3.115 N/A ARG 99.A NE GLU 98.A OE1 no hydrogen 2.834 N/A ARG 99.A NH1 ASP 73.A OD1 no hydrogen 3.011 N/A ARG 99.A NH2 ASP 73.A OD1 no hydrogen 2.836 N/A ARG 99.A NH2 GLU 98.A OE1 no hydrogen 3.346 N/A ARG 99.A NH2 GLU 98.A OE2 no hydrogen 3.362 N/A ALA 100.A N ALA 96.A O no hydrogen 2.931 N/A ALA 101.A N ARG 97.A O no hydrogen 3.102 N/A TRP 102.A N GLU 98.A O no hydrogen 2.858 N/A ALA 103.A N ARG 99.A O no hydrogen 2.687 N/A ASP 104.A N ALA 100.A O no hydrogen 2.952 N/A GLY 105.A N ALA 101.A O no hydrogen 2.931 N/A ARG 106.A N TRP 102.A O no hydrogen 3.061 N/A ARG 106.A N ALA 103.A O no hydrogen 2.974 N/A ARG 106.A NH1 LEU 75.A O no hydrogen 3.061 N/A ARG 106.A NH2 ASP 73.A O no hydrogen 2.875 N/A GLY 107.A N ASP 104.A O no hydrogen 3.029 N/A ALA 108.A N ALA 103.A O no hydrogen 3.025 N/A ASP 109.A N ARG 83.A O no hydrogen 3.039 N/A TYR 110.A OH ASP 112.A OD2 no hydrogen 2.579 N/A LEU 111.A N LEU 85.A O no hydrogen 2.877 N/A ASP 112.A N SER 132.A O no hydrogen 2.959 N/A GLY 113.A N ASN 87.A O no hydrogen 2.849 N/A ALA 114.A N LEU 130.A O no hydrogen 3.081 N/A LEU 116.A N VAL 128.A O no hydrogen 2.974 N/A ALA 121.A N GLY 118.A O no hydrogen 3.014 N/A ILE 122.A N PRO 119.A O no hydrogen 3.033 N/A GLY 123.A N LEU 148.A O no hydrogen 2.806 N/A THR 124.A N ALA 121.A O no hydrogen 3.039 N/A THR 124.A OG1 ALA 121.A O no hydrogen 2.903 N/A ASP 126.A N THR 124.A OG1 no hydrogen 2.954 N/A ALA 127.A N THR 124.A O no hydrogen 3.202 N/A VAL 129.A N GLY 151.A O no hydrogen 3.515 N/A LEU 130.A N ALA 114.A O no hydrogen 2.844 N/A LEU 131.A N THR 153.A O no hydrogen 2.920 N/A SER 132.A N ASP 112.A O no hydrogen 2.893 N/A SER 132.A OG ASP 112.A O no hydrogen 3.091 N/A SER 132.A OG HIS 159.A O no hydrogen 3.226 N/A GLY 133.A N GLY 156.A O no hydrogen 2.832 N/A ARG 135.A NH1 ASP 139.A OD1 no hydrogen 2.522 N/A ARG 135.A NH1 ASP 139.A OD2 no hydrogen 3.488 N/A ALA 137.A N PRO 134.A O no hydrogen 2.772 N/A PHE 138.A N PRO 134.A O no hydrogen 3.197 N/A PHE 138.A N ARG 135.A O no hydrogen 2.939 N/A ASP 139.A N ARG 135.A O no hydrogen 2.821 N/A HIS 141.A N PHE 138.A O no hydrogen 2.894 N/A HIS 141.A NE2 THR 84.A OG1 no hydrogen 3.115 N/A ALA 142.A N ASP 139.A O no hydrogen 3.099 N/A LEU 145.A N HIS 141.A O no hydrogen 2.940 N/A GLY 146.A N ALA 142.A O no hydrogen 2.904 N/A GLY 147.A N ALA 144.A O no hydrogen 3.069 N/A LEU 148.A N LEU 145.A O no hydrogen 3.141 N/A GLY 149.A N GLY 146.A O no hydrogen 2.906 N/A THR 152.A N GLY 149.A O no hydrogen 3.200 N/A THR 152.A OG1 GLY 149.A O no hydrogen 2.942 N/A THR 153.A N VAL 129.A O no hydrogen 2.873 N/A TYR 154.A OH GLY 133.A O no hydrogen 2.571 N/A LEU 155.A N LEU 131.A O no hydrogen 2.817 N/A HIS 159.A NE2 TYR 110.A O no hydrogen 2.817 N/A GLY 160.A N ASP 158.A OD1 no hydrogen 2.837 N/A LEU 161.A N ASP 158.A O no hydrogen 3.164 N/A ALA 162.A N SER 132.A OG no hydrogen 3.237 N/A SER 163.A OG GLY 91.A O no hydrogen 3.032 N/A LEU 164.A N GLY 160.A O no hydrogen 3.221 N/A TYR 165.A N LEU 161.A O no hydrogen 2.839 N/A ASP 166.A N ALA 162.A O no hydrogen 2.965 N/A ALA 167.A N SER 163.A O no hydrogen 2.873 N/A ALA 168.A N LEU 164.A O no hydrogen 2.938 N/A GLY 169.A N TYR 165.A O no hydrogen 2.970 N/A LEU 170.A N ASP 166.A O no hydrogen 2.858 N/A VAL 171.A N ALA 167.A O no hydrogen 2.956 N/A MET 172.A N ALA 168.A O no hydrogen 3.166 N/A MET 173.A N GLY 169.A O no hydrogen 2.919 N/A TRP 174.A N LEU 170.A O no hydrogen 2.943 N/A SER 175.A N VAL 171.A O no hydrogen 2.983 N/A SER 175.A OG VAL 171.A O no hydrogen 3.120 N/A ILE 176.A N MET 172.A O no hydrogen 2.983 N/A ILE 176.A N MET 173.A O no hydrogen 3.042 N/A LEU 177.A N MET 173.A O no hydrogen 3.036 N/A ASN 178.A N TRP 174.A O no hydrogen 2.953 N/A GLY 179.A N SER 175.A O no hydrogen 3.005 N/A PHE 180.A N ILE 176.A O no hydrogen 2.884 N/A LEU 181.A N LEU 177.A O no hydrogen 2.886 N/A GLN 182.A N ASN 178.A O no hydrogen 2.991 N/A GLY 183.A N GLY 179.A O no hydrogen 3.088 N/A ALA 184.A N PHE 180.A O no hydrogen 2.837 N/A ALA 185.A N LEU 181.A O no hydrogen 2.919 N/A LEU 186.A N GLN 182.A O no hydrogen 3.053 N/A LEU 187.A N GLY 183.A O no hydrogen 2.975 N/A GLY 188.A N ALA 184.A O no hydrogen 2.776 N/A THR 189.A N LEU 186.A O no hydrogen 3.045 N/A THR 189.A OG1 LEU 186.A O no hydrogen 2.698 N/A ALA 190.A N LEU 187.A O no hydrogen 3.150 N/A GLY 191.A N GLY 188.A O no hydrogen 2.912 N/A VAL 192.A N LEU 187.A O no hydrogen 3.210 N/A THR 196.A N ASP 193.A O no hydrogen 3.019 N/A PHE 197.A N ASP 193.A O no hydrogen 3.243 N/A PHE 197.A N ALA 194.A O no hydrogen 3.079 N/A ALA 198.A N ALA 194.A O no hydrogen 3.006 N/A ILE 201.A N PHE 197.A O no hydrogen 3.085 N/A THR 202.A N ALA 198.A O no hydrogen 2.871 N/A THR 202.A OG1 ALA 198.A O no hydrogen 3.289 N/A THR 202.A OG1 PRO 199.A O no hydrogen 3.124 N/A GLN 203.A N PRO 199.A O no hydrogen 3.207 N/A GLN 203.A NE2 PRO 199.A O no hydrogen 3.384 N/A GLY 204.A N PHE 200.A O no hydrogen 3.297 N/A ILE 205.A N ILE 201.A O no hydrogen 2.930 N/A GLY 206.A N THR 202.A O no hydrogen 3.276 N/A THR 207.A N GLN 203.A O no hydrogen 3.202 N/A THR 207.A OG1 GLN 203.A O no hydrogen 3.372 N/A VAL 208.A N GLY 204.A O no hydrogen 3.027 N/A ALA 209.A N ILE 205.A O no hydrogen 2.887 N/A ASP 210.A N GLY 206.A O no hydrogen 3.200 N/A TRP 211.A N VAL 208.A O no hydrogen 2.767 N/A LEU 212.A N ALA 209.A O no hydrogen 3.057 N/A TYR 215.A N TRP 211.A O no hydrogen 3.115 N/A ALA 216.A N LEU 212.A O no hydrogen 2.722 N/A ARG 217.A N PRO 213.A O no hydrogen 2.975 N/A GLN 218.A N GLY 214.A O no hydrogen 3.121 N/A ILE 219.A N TYR 215.A O no hydrogen 2.978 N/A ASP 220.A N ALA 216.A O no hydrogen 2.871 N/A ASP 221.A N ARG 217.A O no hydrogen 3.144 N/A ALA 229.A N ALA 226.A O no hydrogen 2.665 N/A ILE 231.A N SER 273.A O no hydrogen 2.905 N/A ASP 232.A N GLY 271.A O no hydrogen 2.997 N/A THR 233.A OG1 ALA 230.A O no hydrogen 3.300 N/A HIS 234.A N ALA 230.A O no hydrogen 3.295 N/A LEU 235.A N ILE 231.A O no hydrogen 3.326 N/A LEU 235.A N ASP 232.A O no hydrogen 2.977 N/A THR 237.A OG1 THR 233.A O no hydrogen 3.557 N/A MET 238.A N HIS 234.A O no hydrogen 2.965 N/A GLU 239.A N LEU 235.A O no hydrogen 3.114 N/A HIS 240.A N ALA 236.A O no hydrogen 3.120 N/A LEU 241.A N THR 237.A O no hydrogen 3.055 N/A ILE 242.A N MET 238.A O no hydrogen 3.141 N/A HIS 243.A N GLU 239.A O no hydrogen 2.870 N/A GLU 244.A N HIS 240.A O no hydrogen 2.774 N/A SER 245.A N LEU 241.A O no hydrogen 3.072 N/A SER 245.A OG LEU 241.A O no hydrogen 2.816 N/A GLU 246.A N ILE 242.A O no hydrogen 2.925 N/A PHE 247.A N HIS 243.A O no hydrogen 2.843 N/A LEU 248.A N GLU 244.A O no hydrogen 2.995 N/A GLY 249.A N GLU 246.A O no hydrogen 2.969 N/A VAL 250.A N SER 245.A O no hydrogen 3.049 N/A ASN 251.A ND2 GLU 253.A OE2 no hydrogen 3.268 N/A GLU 253.A N ASN 251.A OD1 no hydrogen 2.938 N/A ARG 256.A N ALA 252.A O no hydrogen 3.089 N/A ARG 256.A NE GLU 246.A OE2 no hydrogen 3.195 N/A ARG 256.A NH2 GLU 246.A OE2 no hydrogen 2.603 N/A PHE 257.A N GLU 253.A O no hydrogen 2.781 N/A ILE 258.A N LEU 254.A O no hydrogen 2.946 N/A LYS 259.A N PRO 255.A O no hydrogen 3.091 N/A ALA 260.A N ARG 256.A O no hydrogen 2.712 N/A LEU 261.A N PHE 257.A O no hydrogen 3.125 N/A ALA 262.A N ILE 258.A O no hydrogen 3.357 N/A ASP 263.A N LYS 259.A O no hydrogen 2.890 N/A ARG 264.A N ALA 260.A O no hydrogen 3.198 N/A ALA 265.A N LEU 261.A O no hydrogen 3.292 N/A VAL 266.A N ALA 262.A O no hydrogen 3.111 N/A ALA 267.A N ASP 263.A O no hydrogen 2.859 N/A ASP 268.A N ARG 264.A O no hydrogen 3.068 N/A ASP 268.A N ALA 265.A O no hydrogen 3.188 N/A GLY 269.A N VAL 266.A O no hydrogen 2.829 N/A HIS 270.A N ALA 265.A O no hydrogen 2.797 N/A HIS 270.A ND1 SER 273.A OG no hydrogen 3.150 N/A SER 273.A N HIS 270.A O no hydrogen 2.685 N/A SER 273.A OG HIS 270.A ND1 no hydrogen 3.150 N/A SER 273.A OG HIS 270.A O no hydrogen 3.176 N/A GLY 274.A N TYR 224.A O no hydrogen 2.782 N/A ALA 277.A N GLY 274.A O no hydrogen 3.055 N/A LEU 278.A N TYR 275.A O no hydrogen 2.845 N/A ILE 279.A N PRO 276.A O no hydrogen 2.958 N/A GLU 280.A N ALA 277.A O no hydrogen 3.395 N/A GLN 281.A N LEU 278.A O no hydrogen 2.924 N/A GLN 281.A NE2 ASP 268.A OD2 no hydrogen 3.545 N/A PHE 282.A N LEU 278.A O no hydrogen 3.319 N/A ARG 283.A N ILE 279.A O no hydrogen 2.971 N/A THR 284.A OG1 GLU 280.A O no hydrogen 3.292 N/A