Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ceg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N GLU 6.A OE2 no hydrogen 3.241 N/A GLU 6.A N SER 3.A OG no hydrogen 3.219 N/A LYS 7.A N SER 3.A O no hydrogen 2.974 N/A TYR 8.A N LEU 4.A O no hydrogen 2.838 N/A TYR 8.A OH HIS 233.A ND1 no hydrogen 2.822 N/A VAL 9.A N GLU 5.A O no hydrogen 2.828 N/A ALA 10.A N GLU 6.A O no hydrogen 2.972 N/A VAL 11.A N LYS 7.A O no hydrogen 3.049 N/A GLN 15.A NE2 LEU 66.A O no hydrogen 3.439 N/A GLN 15.A NE2 PRO 67.A O no hydrogen 3.069 N/A GLN 15.A NE2 VAL 74.A O no hydrogen 2.756 N/A ASP 17.A N VAL 76.A O no hydrogen 3.286 N/A THR 18.A N ASP 17.A OD1 no hydrogen 2.881 N/A PHE 19.A N CYS 78.A O no hydrogen 2.863 N/A SER 22.A N GLY 30.A O no hydrogen 2.783 N/A SER 22.A OG GLU 20.A OE2 no hydrogen 3.530 N/A ASP 24.A N LYS 28.A O no hydrogen 2.678 N/A GLY 30.A N SER 22.A O no hydrogen 2.772 N/A TYR 35.A OH VAL 106.A O no hydrogen 2.504 N/A HIS 36.A N ASP 105.A OD2 no hydrogen 2.725 N/A SER 38.A OG ASN 42.A OD1 no hydrogen 3.288 N/A VAL 40.A N TYR 37.A O no hydrogen 2.900 N/A ASN 42.A N SER 38.A O no hydrogen 2.864 N/A ALA 43.A N VAL 40.A O no hydrogen 3.399 N/A ASN 44.A ND2 ASN 42.A O no hydrogen 2.751 N/A ALA 46.A N GLN 110.A OE1 no hydrogen 3.034 N/A ASN 47.A N ASP 45.A OD1 no hydrogen 2.979 N/A ARG 51.A N SER 48.A OG no hydrogen 3.116 N/A ARG 51.A NE PRO 109.A O no hydrogen 3.067 N/A ARG 51.A NH2 ASP 84.A OD1 no hydrogen 2.873 N/A ARG 51.A NH2 PHE 108.A O no hydrogen 2.870 N/A ARG 51.A NH2 PRO 109.A O no hydrogen 3.518 N/A ALA 52.A N SER 48.A O no hydrogen 3.076 N/A ARG 53.A N ALA 49.A O no hydrogen 2.997 N/A ARG 54.A N ALA 50.A O no hydrogen 3.091 N/A ARG 54.A NH1 SER 162.A O no hydrogen 3.121 N/A ARG 54.A NH2 PRO 159.A O no hydrogen 2.725 N/A ARG 54.A NH2 SER 162.A O no hydrogen 3.050 N/A LEU 55.A N ARG 51.A O no hydrogen 2.818 N/A ALA 56.A N ALA 52.A O no hydrogen 2.965 N/A GLN 57.A N ARG 53.A O no hydrogen 3.012 N/A GLN 57.A NE2 GLN 57.A O no hydrogen 2.872 N/A GLU 58.A N ARG 54.A O no hydrogen 2.840 N/A ALA 59.A N LEU 55.A O no hydrogen 3.018 N/A VAL 60.A N ALA 56.A O no hydrogen 3.200 N/A THR 61.A N GLN 57.A O no hydrogen 3.287 N/A THR 61.A OG1 GLN 57.A O no hydrogen 3.230 N/A LEU 62.A N GLU 58.A O no hydrogen 3.090 N/A SER 63.A N ALA 59.A O no hydrogen 2.928 N/A SER 63.A N VAL 60.A O no hydrogen 3.165 N/A SER 63.A OG ALA 59.A O no hydrogen 3.533 N/A SER 63.A OG VAL 60.A O no hydrogen 2.502 N/A THR 64.A N THR 61.A O no hydrogen 3.275 N/A THR 64.A OG1 VAL 60.A O no hydrogen 3.569 N/A THR 64.A OG1 THR 61.A O no hydrogen 3.435 N/A THR 64.A OG1 SER 65.A OG no hydrogen 2.904 N/A SER 65.A N THR 61.A O no hydrogen 2.941 N/A SER 65.A OG THR 61.A O no hydrogen 2.940 N/A SER 65.A OG THR 64.A OG1 no hydrogen 2.904 N/A SER 69.A N SER 73.A OG no hydrogen 3.043 N/A SER 69.A OG SER 72.A O no hydrogen 2.708 N/A SER 72.A N SER 69.A OG no hydrogen 2.933 N/A SER 72.A OG THR 90.A O no hydrogen 2.731 N/A SER 73.A N THR 90.A OG1 no hydrogen 2.929 N/A SER 73.A OG SER 69.A O no hydrogen 2.684 N/A VAL 74.A N PRO 67.A O no hydrogen 2.888 N/A PHE 75.A N LEU 88.A O no hydrogen 2.903 N/A VAL 76.A N GLN 15.A O no hydrogen 2.616 N/A ARG 77.A N LYS 86.A O no hydrogen 2.961 N/A ARG 77.A NH1 LEU 14.A O no hydrogen 2.862 N/A ARG 77.A NH1 VAL 76.A O no hydrogen 2.791 N/A ARG 77.A NH2 LEU 14.A O no hydrogen 2.538 N/A CYS 78.A N ASP 17.A O no hydrogen 2.997 N/A ASP 79.A N ILE 85.A O no hydrogen 3.202 N/A GLU 81.A N ASP 79.A OD2 no hydrogen 2.803 N/A ARG 82.A N ASP 79.A OD2 no hydrogen 2.946 N/A LYS 86.A NZ ASN 34.A O no hydrogen 2.600 N/A LYS 86.A NZ GLU 103.A OE2 no hydrogen 3.400 N/A LYS 86.A NZ ASP 105.A OD1 no hydrogen 2.645 N/A VAL 87.A N PHE 104.A O no hydrogen 2.897 N/A LEU 88.A N PHE 75.A O no hydrogen 2.924 N/A ILE 89.A N PHE 102.A O no hydrogen 2.921 N/A THR 90.A N SER 73.A O no hydrogen 3.089 N/A GLY 91.A N GLY 100.A O no hydrogen 2.825 N/A ALA 93.A N SER 71.A OG no hydrogen 2.911 N/A THR 95.A OG1 PRO 92.A O no hydrogen 2.821 N/A TYR 97.A N THR 95.A OG1 no hydrogen 3.089 N/A TYR 97.A OH PHE 131.A O no hydrogen 2.628 N/A ALA 98.A N THR 95.A O no hydrogen 3.212 N/A ASN 99.A N GLY 91.A O no hydrogen 2.917 N/A ASN 99.A ND2 GLU 240.A OE1 no hydrogen 2.818 N/A ASN 99.A ND2 GLN 243.A OE1 no hydrogen 2.971 N/A GLY 100.A N TYR 97.A O no hydrogen 2.881 N/A CYS 101.A N ALA 215.A O no hydrogen 2.748 N/A PHE 102.A N ILE 89.A O no hydrogen 2.876 N/A GLU 103.A N THR 123.A OG1 no hydrogen 2.765 N/A PHE 104.A N VAL 87.A O no hydrogen 2.831 N/A ASP 105.A N ASN 120.A O no hydrogen 2.695 N/A TYR 107.A N LEU 118.A O no hydrogen 3.019 N/A PHE 108.A N ASP 84.A O no hydrogen 2.988 N/A GLN 110.A NE2 ASP 45.A OD1 no hydrogen 2.910 N/A TYR 112.A N PRO 109.A O no hydrogen 2.909 N/A TYR 112.A OH GLU 58.A OE2 no hydrogen 2.452 N/A SER 115.A N ASP 111.A O no hydrogen 3.062 N/A SER 115.A OG ASP 111.A OD2 no hydrogen 2.747 N/A LEU 118.A N TYR 107.A O no hydrogen 2.800 N/A ASN 120.A N ASP 105.A O no hydrogen 2.919 N/A ASN 120.A ND2 GLU 122.A OE2 no hydrogen 2.785 N/A ASN 120.A ND2 ASP 138.A O no hydrogen 3.638 N/A LEU 121.A N GLY 139.A O no hydrogen 2.810 N/A GLU 122.A N GLU 103.A O no hydrogen 2.609 N/A THR 124.A N GLU 122.A O no hydrogen 3.060 N/A HIS 127.A N THR 124.A OG1 no hydrogen 2.927 N/A HIS 127.A ND1 ASN 137.A O no hydrogen 3.057 N/A SER 128.A N GLY 125.A O no hydrogen 3.166 N/A SER 128.A OG GLY 125.A O no hydrogen 2.602 N/A VAL 129.A N THR 124.A O no hydrogen 2.878 N/A ARG 130.A NE ASN 132.A O no hydrogen 2.686 N/A ARG 130.A NH1 PRO 133.A O no hydrogen 2.739 N/A ASN 132.A ND2 TYR 97.A OH no hydrogen 2.815 N/A ASN 134.A N ASN 132.A OD1 no hydrogen 2.835 N/A ASN 134.A ND2 CYS 142.A O no hydrogen 2.894 N/A LEU 135.A N ASN 132.A O no hydrogen 3.105 N/A TYR 136.A N LYS 140.A O no hydrogen 3.066 N/A ASN 137.A ND2 HIS 127.A O no hydrogen 3.095 N/A GLY 139.A N TYR 136.A O no hydrogen 2.822 N/A LYS 140.A N ASP 138.A OD1 no hydrogen 3.074 N/A CYS 142.A N ASN 134.A O no hydrogen 2.850 N/A CYS 142.A SG ASN 134.A O no hydrogen 3.717 N/A LEU 143.A N THR 148.A OG1 no hydrogen 2.955 N/A SER 144.A OG GLU 155.A O no hydrogen 3.094 N/A LEU 146.A N LEU 143.A O no hydrogen 3.090 N/A ASN 147.A N SER 144.A O no hydrogen 2.839 N/A THR 148.A N LEU 143.A O no hydrogen 2.959 N/A THR 148.A OG1 VAL 141.A O no hydrogen 2.644 N/A THR 148.A OG1 LEU 143.A O no hydrogen 3.220 N/A ARG 152.A N GLU 155.A OE1 no hydrogen 2.921 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.814 N/A GLU 155.A N ARG 152.A O no hydrogen 3.116 N/A LYS 156.A N PRO 153.A O no hydrogen 3.261 N/A LYS 156.A NZ TRP 149.A O no hydrogen 2.729 N/A TRP 157.A N ASN 147.A OD1 no hydrogen 2.806 N/A TRP 157.A NE1 PRO 113.A O no hydrogen 2.718 N/A ASN 158.A N SER 162.A OG no hydrogen 2.823 N/A GLN 160.A N ASN 158.A OD1 no hydrogen 2.951 N/A THR 161.A N ASN 158.A OD1 no hydrogen 2.918 N/A SER 162.A N ASN 158.A O no hydrogen 2.801 N/A SER 162.A OG ASN 158.A O no hydrogen 3.184 N/A PHE 164.A N GLU 58.A OE1 no hydrogen 2.895 N/A GLN 166.A N SER 163.A OG no hydrogen 3.287 N/A VAL 167.A N SER 163.A O no hydrogen 3.373 N/A LEU 168.A N PHE 164.A O no hydrogen 2.998 N/A VAL 169.A N LEU 165.A O no hydrogen 2.976 N/A SER 170.A N GLN 166.A O no hydrogen 2.909 N/A SER 170.A OG GLN 166.A O no hydrogen 3.462 N/A VAL 171.A N VAL 167.A O no hydrogen 3.065 N/A VAL 171.A N LEU 168.A O no hydrogen 3.111 N/A GLN 172.A N LEU 168.A O no hydrogen 3.352 N/A GLN 172.A NE2 SER 72.A OG no hydrogen 3.083 N/A SER 173.A N VAL 169.A O no hydrogen 2.877 N/A SER 173.A OG VAL 169.A O no hydrogen 2.849 N/A LEU 174.A N SER 170.A O no hydrogen 2.886 N/A ILE 175.A N VAL 171.A O no hydrogen 3.085 N/A LEU 176.A N VAL 171.A O no hydrogen 2.951 N/A PHE 182.A N GLU 179.A O no hydrogen 3.407 N/A ASN 183.A N PRO 180.A O no hydrogen 2.986 N/A ASN 183.A ND2 ASN 132.A OD1 no hydrogen 3.329 N/A ASN 183.A ND2 ASN 134.A OD1 no hydrogen 3.339 N/A ASN 183.A ND2 LEU 174.A O no hydrogen 2.925 N/A GLU 184.A N TYR 181.A O no hydrogen 3.438 N/A TYR 187.A N GLU 184.A O no hydrogen 3.146 N/A ARG 189.A N GLY 186.A O no hydrogen 3.452 N/A SER 190.A N TYR 187.A O no hydrogen 2.912 N/A SER 190.A OG TYR 187.A O no hydrogen 3.222 N/A ARG 191.A N GLU 188.A O no hydrogen 3.066 N/A ARG 191.A NE GLU 188.A OE2 no hydrogen 2.499 N/A ARG 191.A NH1 GLU 188.A OE2 no hydrogen 3.376 N/A THR 193.A N SER 190.A O no hydrogen 2.955 N/A THR 193.A OG1 SER 190.A O no hydrogen 2.789 N/A GLY 196.A N THR 193.A OG1 no hydrogen 3.085 N/A THR 197.A N THR 193.A O no hydrogen 2.754 N/A THR 197.A OG1 THR 193.A O no hydrogen 3.227 N/A GLN 198.A N PRO 194.A O no hydrogen 3.025 N/A SER 199.A N SER 195.A O no hydrogen 3.027 N/A SER 199.A OG SER 195.A O no hydrogen 3.026 N/A SER 200.A N GLY 196.A O no hydrogen 2.939 N/A ARG 201.A N THR 197.A O no hydrogen 3.061 N/A GLU 202.A N GLN 198.A O no hydrogen 3.153 N/A TYR 203.A N SER 199.A O no hydrogen 2.936 N/A ASP 204.A N SER 200.A O no hydrogen 2.749 N/A GLY 205.A N ARG 201.A O no hydrogen 2.883 N/A ASN 206.A N GLU 202.A O no hydrogen 3.205 N/A ILE 207.A N TYR 203.A O no hydrogen 3.081 N/A ARG 208.A N ASP 204.A O no hydrogen 2.755 N/A ARG 208.A NH1 ASP 250.A OD2 no hydrogen 2.918 N/A GLN 209.A N GLY 205.A O no hydrogen 3.294 N/A GLN 209.A NE2 ASN 206.A O no hydrogen 3.131 N/A GLN 209.A NE2 ASN 206.A OD1 no hydrogen 2.933 N/A ALA 210.A N ASN 206.A O no hydrogen 3.146 N/A THR 211.A N ILE 207.A O no hydrogen 2.868 N/A THR 211.A OG1 PRO 96.A O no hydrogen 2.878 N/A THR 211.A OG1 ILE 207.A O no hydrogen 2.944 N/A VAL 212.A N ARG 208.A O no hydrogen 3.199 N/A LYS 213.A N GLN 209.A O no hydrogen 3.069 N/A LYS 213.A NZ GLU 217.A OE2 no hydrogen 2.798 N/A TRP 214.A N ALA 210.A O no hydrogen 2.789 N/A ALA 215.A N THR 211.A O no hydrogen 2.879 N/A GLU 217.A N LYS 213.A O no hydrogen 2.816 N/A GLN 218.A NE2 CYS 101.A O no hydrogen 2.872 N/A ARG 220.A N LEU 216.A O no hydrogen 3.055 N/A ARG 220.A NE GLU 274.A OE2 no hydrogen 3.164 N/A ARG 220.A NH1 GLU 217.A OE2 no hydrogen 3.204 N/A ARG 220.A NH2 GLN 270.A OE1 no hydrogen 3.477 N/A ASN 221.A N GLU 217.A O no hydrogen 2.857 N/A CYS 225.A N SER 223.A OG no hydrogen 3.231 N/A PHE 226.A N SER 223.A O no hydrogen 2.951 N/A ILE 230.A N.A PHE 226.A O no hydrogen 2.859 N/A ILE 230.A N.B PHE 226.A O no hydrogen 2.880 N/A HIS 231.A N LYS 227.A O no hydrogen 2.989 N/A HIS 231.A NE2 PRO 279.A O no hydrogen 2.682 N/A LYS 232.A N GLU 228.A O no hydrogen 3.071 N/A LYS 232.A NZ GLU 228.A OE2 no hydrogen 2.843 N/A HIS 233.A N VAL 229.A O no hydrogen 2.775 N/A HIS 233.A ND1 TYR 8.A OH no hydrogen 2.822 N/A HIS 233.A NE2 ASN 99.A O no hydrogen 3.129 N/A PHE 234.A N ILE 230.A O.A no hydrogen 2.866 N/A PHE 234.A N ILE 230.A O.B no hydrogen 2.941 N/A TYR 235.A N HIS 231.A O no hydrogen 2.915 N/A LEU 236.A N LYS 232.A O no hydrogen 2.897 N/A LYS 237.A N HIS 233.A O no hydrogen 3.108 N/A LYS 237.A NZ SER 70.A O no hydrogen 2.574 N/A LYS 237.A NZ GLU 240.A OE2 no hydrogen 3.465 N/A ARG 238.A N TYR 235.A O no hydrogen 3.330 N/A ARG 238.A NH1 TYR 235.A O no hydrogen 3.020 N/A ILE 241.A N LYS 237.A O no hydrogen 2.820 N/A GLN 243.A N GLU 240.A O no hydrogen 2.870 N/A GLN 243.A NE2 ALA 98.A O no hydrogen 2.995 N/A CYS 244.A N ILE 241.A O no hydrogen 2.838 N/A CYS 244.A SG ILE 241.A O no hydrogen 3.334 N/A GLU 246.A N ALA 242.A O no hydrogen 2.919 N/A TRP 247.A N GLN 243.A O no hydrogen 2.845 N/A ILE 248.A N CYS 244.A O no hydrogen 2.962 N/A ALA 249.A N GLU 245.A O no hydrogen 2.798 N/A ASP 250.A N GLU 246.A O no hydrogen 2.873 N/A ILE 251.A N TRP 247.A O no hydrogen 3.008 N/A GLN 252.A N ILE 248.A O no hydrogen 3.160 N/A GLN 253.A N ASP 250.A O no hydrogen 3.411 N/A TYR 254.A N ILE 251.A O no hydrogen 3.146 N/A THR 257.A OG1 GLU 202.A OE1 no hydrogen 3.279 N/A HIS 259.A N ARG 256.A O no hydrogen 3.216 N/A HIS 260.A N THR 257.A O no hydrogen 2.895 N/A ALA 262.A N SER 258.A O no hydrogen 3.084 N/A ALA 263.A N HIS 259.A O no hydrogen 3.097 N/A LEU 264.A N HIS 260.A O no hydrogen 2.875 N/A LYS 265.A N ALA 261.A O no hydrogen 3.042 N/A LYS 265.A NZ GLN 252.A OE1 no hydrogen 3.089 N/A ARG 266.A N ALA 262.A O no hydrogen 3.231 N/A HIS 267.A N ALA 263.A O no hydrogen 2.940 N/A HIS 267.A NE2 GLN 209.A OE1 no hydrogen 3.165 N/A THR 268.A N LEU 264.A O no hydrogen 2.716 N/A THR 268.A OG1 LEU 264.A O no hydrogen 2.775 N/A ALA 269.A N LYS 265.A O no hydrogen 3.186 N/A GLN 270.A N ARG 266.A O no hydrogen 3.269 N/A LEU 271.A N HIS 267.A O no hydrogen 2.972 N/A ARG 272.A N THR 268.A O no hydrogen 2.898 N/A GLU 273.A N ALA 269.A O no hydrogen 3.466 N/A GLU 274.A N GLN 270.A O no hydrogen 3.068 N/A LEU 275.A N LEU 271.A O no hydrogen 2.756 N/A LEU 276.A N ARG 272.A O no hydrogen 2.982 N/A LYS 277.A N GLU 273.A O no hydrogen 3.161 N/A LYS 277.A NZ GLU 273.A OE1 no hydrogen 3.534 N/A LYS 277.A NZ GLU 273.A OE2 no hydrogen 3.187 N/A LEU 278.A N LEU 275.A O no hydrogen 3.213 N/A CYS 280.A SG PRO 281.A O no hydrogen 3.657 N/A