Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5aei_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 6.A N GLU 2.A O no hydrogen 3.015 N/A VAL 7.A N LEU 3.A O no hydrogen 2.876 N/A GLN 8.A N PRO 4.A O no hydrogen 2.928 N/A GLN 9.A N GLN 5.A O no hydrogen 3.007 N/A GLN 9.A NE2 GLU 17.A OE2 no hydrogen 3.192 N/A LEU 10.A N VAL 7.A O no hydrogen 3.141 N/A ASN 11.A N GLN 8.A O no hydrogen 3.134 N/A SER 12.A N GLN 9.A O no hydrogen 3.097 N/A SER 12.A OG ASP 14.A O no hydrogen 3.517 N/A SER 12.A OG GLU 17.A OE1 no hydrogen 2.470 N/A ASP 14.A N SER 12.A OG no hydrogen 3.002 N/A GLN 15.A NE2 PRO 13.A O no hydrogen 3.290 N/A GLN 16.A N ASP 14.A OD1 no hydrogen 2.794 N/A GLU 17.A N ASP 14.A OD1 no hydrogen 3.183 N/A LEU 18.A N ASP 14.A O no hydrogen 2.959 N/A GLN 19.A N GLN 15.A O no hydrogen 2.975 N/A GLN 19.A NE2 GLN 58.A O no hydrogen 3.265 N/A SER 20.A N.A GLN 16.A O no hydrogen 3.069 N/A SER 20.A N.B GLN 16.A O no hydrogen 3.071 N/A SER 20.A OG.B GLN 16.A O no hydrogen 3.213 N/A ALA 21.A N GLU 17.A O no hydrogen 3.136 N/A LEU 22.A N LEU 18.A O no hydrogen 2.861 N/A ARG 23.A N GLN 19.A O no hydrogen 2.941 N/A LYS 24.A N SER 20.A O.A no hydrogen 3.000 N/A LYS 24.A N SER 20.A O.B no hydrogen 3.007 N/A LEU 25.A N ALA 21.A O no hydrogen 2.871 N/A SER 26.A N LEU 22.A O no hydrogen 2.932 N/A SER 26.A OG ARG 23.A O no hydrogen 3.288 N/A SER 26.A OG GLU 62.A OE2 no hydrogen 2.589 N/A GLN 27.A N ARG 23.A O no hydrogen 3.222 N/A GLN 27.A NE2 SER 26.A OG no hydrogen 2.994 N/A ILE 28.A N LYS 24.A O no hydrogen 2.965 N/A ALA 29.A N LEU 25.A O no hydrogen 3.054 N/A SER 30.A N GLN 27.A O no hydrogen 3.102 N/A SER 30.A OG GLN 27.A O no hydrogen 2.642 N/A GLY 31.A N ILE 28.A O no hydrogen 3.008 N/A ILE 36.A N GLY 32.A O no hydrogen 2.992 N/A GLN 37.A N ASN 33.A O no hydrogen 3.003 N/A GLN 37.A NE2 ASP 41.A OD1 no hydrogen 2.996 N/A ALA 38.A N GLU 34.A O no hydrogen 3.074 N/A VAL 39.A N GLN 35.A O no hydrogen 3.097 N/A ILE 40.A N ILE 36.A O no hydrogen 2.923 N/A ASP 41.A N GLN 37.A O no hydrogen 2.755 N/A ALA 42.A N ALA 38.A O no hydrogen 2.969 N/A GLY 43.A N ILE 40.A O no hydrogen 2.983 N/A ALA 44.A N VAL 39.A O no hydrogen 3.320 N/A LEU 48.A N ALA 44.A O no hydrogen 2.944 N/A VAL 49.A N LEU 45.A O no hydrogen 2.820 N/A GLN 50.A N PRO 46.A O no hydrogen 3.000 N/A LEU 51.A N ALA 47.A O no hydrogen 3.137 N/A LEU 52.A N VAL 49.A O no hydrogen 3.044 N/A SER 53.A N GLN 50.A O no hydrogen 3.124 N/A SER 54.A N LEU 51.A O no hydrogen 2.944 N/A ASN 56.A N SER 54.A OG no hydrogen 3.011 N/A GLU 57.A N GLU 57.A OE1 no hydrogen 2.872 N/A GLN 58.A N ASN 56.A OD1 no hydrogen 2.916 N/A ILE 59.A N ASN 56.A OD1 no hydrogen 3.180 N/A LEU 60.A N ASN 56.A O no hydrogen 2.925 N/A GLN 61.A N GLU 57.A O no hydrogen 3.031 N/A GLN 61.A NE2 GLU 62.A OE1 no hydrogen 2.967 N/A GLU 62.A N GLN 58.A O no hydrogen 3.360 N/A ALA 63.A N ILE 59.A O no hydrogen 2.887 N/A LEU 64.A N LEU 60.A O no hydrogen 2.883 N/A TRP 65.A N GLN 61.A O no hydrogen 2.961 N/A ALA 66.A N GLU 62.A O no hydrogen 2.943 N/A LEU 67.A N ALA 63.A O no hydrogen 2.978 N/A SER 68.A N LEU 64.A O no hydrogen 2.773 N/A SER 68.A OG LEU 64.A O no hydrogen 3.189 N/A ASN 69.A N TRP 65.A O no hydrogen 2.919 N/A ASN 69.A ND2 SER 26.A O no hydrogen 2.939 N/A ILE 70.A N ALA 66.A O no hydrogen 2.886 N/A ALA 71.A N LEU 67.A O no hydrogen 2.866 N/A SER 72.A N ASN 69.A O no hydrogen 2.988 N/A SER 72.A OG ASN 69.A O no hydrogen 2.663 N/A GLY 73.A N ILE 70.A O no hydrogen 3.106 N/A GLY 74.A N GLN 77.A OE1 no hydrogen 2.859 N/A GLN 77.A NE2 ASN 33.A O no hydrogen 3.003 N/A GLN 77.A NE2 GLN 37.A OE1 no hydrogen 2.954 N/A ILE 78.A N GLY 74.A O no hydrogen 2.937 N/A GLN 79.A N ASN 75.A O no hydrogen 2.937 N/A GLN 79.A NE2 ASP 83.A OD1 no hydrogen 2.973 N/A ALA 80.A N GLU 76.A O no hydrogen 2.994 N/A VAL 81.A N GLN 77.A O no hydrogen 3.268 N/A ILE 82.A N ILE 78.A O no hydrogen 3.096 N/A ASP 83.A N GLN 79.A O no hydrogen 2.734 N/A ALA 84.A N ALA 80.A O no hydrogen 2.988 N/A ALA 84.A N VAL 81.A O no hydrogen 3.262 N/A GLY 85.A N ILE 82.A O no hydrogen 2.901 N/A ALA 86.A N VAL 81.A O no hydrogen 3.475 N/A LEU 90.A N.A ALA 86.A O no hydrogen 3.105 N/A LEU 90.A N.B ALA 86.A O no hydrogen 3.098 N/A VAL 91.A N LEU 87.A O no hydrogen 2.836 N/A GLN 92.A N PRO 88.A O no hydrogen 2.903 N/A LEU 93.A N LEU 90.A O.A no hydrogen 2.974 N/A LEU 93.A N LEU 90.A O.B no hydrogen 3.280 N/A LEU 94.A N VAL 91.A O no hydrogen 2.864 N/A SER 95.A N GLN 92.A O no hydrogen 3.112 N/A SER 95.A OG GLN 92.A O no hydrogen 3.376 N/A SER 96.A N LEU 93.A O no hydrogen 2.973 N/A ASN 98.A N SER 96.A OG no hydrogen 2.963 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 2.829 N/A ILE 101.A N ASN 98.A OD1 no hydrogen 3.183 N/A LEU 102.A N ASN 98.A O no hydrogen 2.866 N/A GLN 103.A N GLU 99.A O no hydrogen 2.937 N/A GLU 104.A N GLN 100.A O no hydrogen 2.938 N/A ALA 105.A N ILE 101.A O no hydrogen 2.804 N/A LEU 106.A N LEU 102.A O no hydrogen 2.960 N/A TRP 107.A N GLN 103.A O no hydrogen 3.184 N/A ALA 108.A N GLU 104.A O no hydrogen 3.090 N/A LEU 109.A N.A ALA 105.A O no hydrogen 2.984 N/A LEU 109.A N.B ALA 105.A O no hydrogen 2.986 N/A SER 110.A N LEU 106.A O no hydrogen 2.820 N/A ASN 111.A N TRP 107.A O no hydrogen 2.950 N/A ASN 111.A ND2 SER 68.A O no hydrogen 2.897 N/A ILE 112.A N ALA 108.A O no hydrogen 3.025 N/A ALA 113.A N LEU 109.A O.A no hydrogen 2.974 N/A ALA 113.A N LEU 109.A O.B no hydrogen 2.961 N/A SER 114.A N ASN 111.A O no hydrogen 2.995 N/A SER 114.A OG ASN 111.A O no hydrogen 2.538 N/A GLY 115.A N ILE 112.A O no hydrogen 3.121 N/A GLY 116.A N GLN 119.A OE1 no hydrogen 2.755 N/A GLN 119.A NE2 GLN 79.A OE1 no hydrogen 2.797 N/A ILE 120.A N GLY 116.A O no hydrogen 2.955 N/A GLN 121.A N ASN 117.A O no hydrogen 2.880 N/A GLN 121.A NE2 ASP 125.A OD1 no hydrogen 3.015 N/A ALA 122.A N GLU 118.A O no hydrogen 3.123 N/A VAL 123.A N GLN 119.A O no hydrogen 3.342 N/A ILE 124.A N ILE 120.A O no hydrogen 3.054 N/A ASP 125.A N GLN 121.A O no hydrogen 2.838 N/A ALA 126.A N ALA 122.A O no hydrogen 2.952 N/A GLY 127.A N ILE 124.A O no hydrogen 2.959 N/A LEU 132.A N ALA 128.A O no hydrogen 3.132 N/A VAL 133.A N LEU 129.A O no hydrogen 2.891 N/A GLN 134.A N PRO 130.A O no hydrogen 2.997 N/A LEU 135.A N ALA 131.A O no hydrogen 3.001 N/A LEU 136.A N VAL 133.A O no hydrogen 3.015 N/A SER 137.A N GLN 134.A O no hydrogen 2.892 N/A SER 138.A N LEU 135.A O no hydrogen 2.980 N/A ASN 140.A N SER 138.A OG no hydrogen 3.030 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.840 N/A GLN 142.A NE2 GLU 146.A OE2 no hydrogen 3.050 N/A ILE 143.A N ASN 140.A OD1 no hydrogen 3.095 N/A LEU 144.A N ASN 140.A O no hydrogen 2.918 N/A GLN 145.A N GLU 141.A O no hydrogen 2.988 N/A GLN 145.A NE2 GLU 188.A OE2 no hydrogen 2.753 N/A GLU 146.A N GLN 142.A O no hydrogen 3.138 N/A ALA 147.A N ILE 143.A O no hydrogen 2.912 N/A LEU 148.A N LEU 144.A O no hydrogen 2.936 N/A TRP 149.A N GLN 145.A O no hydrogen 2.930 N/A TRP 149.A NE1 GLU 188.A OE2 no hydrogen 2.933 N/A ALA 150.A N GLU 146.A O no hydrogen 3.021 N/A LEU 151.A N ALA 147.A O no hydrogen 2.939 N/A SER 152.A N.A LEU 148.A O no hydrogen 2.868 N/A SER 152.A N.B LEU 148.A O no hydrogen 2.880 N/A SER 152.A OG.A LEU 148.A O no hydrogen 3.366 N/A SER 152.A OG.A TRP 149.A O no hydrogen 2.543 N/A SER 152.A OG.B LEU 148.A O no hydrogen 2.787 N/A ASN 153.A N TRP 149.A O no hydrogen 2.845 N/A ASN 153.A ND2 SER 110.A O no hydrogen 3.143 N/A ASN 153.A ND2 SER 110.A OG no hydrogen 2.987 N/A ILE 154.A N ALA 150.A O no hydrogen 2.891 N/A ALA 155.A N LEU 151.A O no hydrogen 2.905 N/A SER 156.A N ASN 153.A O no hydrogen 2.983 N/A SER 156.A OG ASN 153.A O no hydrogen 2.503 N/A GLY 157.A N ILE 154.A O no hydrogen 3.316 N/A GLY 158.A N ASN 117.A OD1 no hydrogen 3.123 N/A GLY 158.A N GLN 161.A OE1 no hydrogen 2.938 N/A GLN 161.A NE2 GLN 121.A OE1 no hydrogen 2.818 N/A ILE 162.A N GLY 158.A O no hydrogen 2.966 N/A GLN 163.A N ASN 159.A O no hydrogen 2.843 N/A GLN 163.A NE2 ASP 167.A OD1 no hydrogen 2.942 N/A ALA 164.A N GLU 160.A O no hydrogen 3.262 N/A ALA 164.A N GLN 161.A O no hydrogen 3.213 N/A VAL 165.A N GLN 161.A O no hydrogen 3.430 N/A ILE 166.A N ILE 162.A O no hydrogen 3.112 N/A ASP 167.A N GLN 163.A O no hydrogen 2.794 N/A ALA 168.A N ALA 164.A O no hydrogen 2.947 N/A ALA 168.A N VAL 165.A O no hydrogen 3.270 N/A GLY 169.A N ILE 166.A O no hydrogen 2.912 N/A ALA 170.A N VAL 165.A O no hydrogen 3.375 N/A LEU 174.A N ALA 170.A O no hydrogen 3.017 N/A VAL 175.A N LEU 171.A O no hydrogen 2.843 N/A GLN 176.A N PRO 172.A O no hydrogen 2.987 N/A LEU 177.A N ALA 173.A O no hydrogen 3.015 N/A LEU 178.A N VAL 175.A O no hydrogen 3.110 N/A SER 179.A N GLN 176.A O no hydrogen 3.201 N/A SER 179.A OG GLN 176.A O no hydrogen 2.946 N/A SER 180.A N LEU 177.A O no hydrogen 2.940 N/A ASN 182.A N SER 180.A OG no hydrogen 2.901 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.799 N/A GLN 184.A N ASN 182.A OD1 no hydrogen 2.920 N/A ILE 185.A N ASN 182.A OD1 no hydrogen 2.944 N/A LEU 186.A N ASN 182.A O no hydrogen 2.905 N/A GLN 187.A N GLU 183.A O no hydrogen 3.188 N/A GLN 187.A NE2 GLU 183.A O no hydrogen 3.022 N/A GLU 188.A N GLN 184.A O no hydrogen 3.127 N/A ALA 189.A N ILE 185.A O no hydrogen 2.950 N/A LEU 190.A N LEU 186.A O no hydrogen 2.902 N/A TRP 191.A N GLN 187.A O no hydrogen 2.887 N/A ALA 192.A N GLU 188.A O no hydrogen 3.080 N/A LEU 193.A N ALA 189.A O no hydrogen 2.956 N/A SER 194.A N.A LEU 190.A O no hydrogen 2.737 N/A SER 194.A N.B LEU 190.A O no hydrogen 2.739 N/A SER 194.A N.C LEU 190.A O no hydrogen 2.739 N/A SER 194.A OG.A LEU 190.A O no hydrogen 3.162 N/A SER 194.A OG.A TRP 191.A O no hydrogen 3.012 N/A SER 194.A OG.C LEU 190.A O no hydrogen 2.845 N/A ASN 195.A N TRP 191.A O no hydrogen 2.902 N/A ASN 195.A ND2 SER 152.A O.A no hydrogen 2.867 N/A ASN 195.A ND2 SER 152.A O.B no hydrogen 2.864 N/A ILE 196.A N ALA 192.A O no hydrogen 2.930 N/A ALA 197.A N LEU 193.A O no hydrogen 2.795 N/A SER 198.A N ASN 195.A O no hydrogen 2.970 N/A SER 198.A OG ASN 195.A O no hydrogen 2.635 N/A GLY 199.A N ILE 196.A O no hydrogen 3.123 N/A GLY 200.A N GLN 203.A OE1 no hydrogen 2.828 N/A GLN 203.A N GLY 200.A O no hydrogen 2.990 N/A GLN 203.A NE2 GLN 163.A OE1 no hydrogen 2.831 N/A ILE 204.A N GLY 200.A O no hydrogen 2.910 N/A GLN 205.A N ASN 201.A O no hydrogen 2.832 N/A GLN 205.A NE2 ASP 209.A OD1 no hydrogen 2.977 N/A ALA 206.A N GLU 202.A O no hydrogen 3.115 N/A VAL 207.A N GLN 203.A O no hydrogen 3.240 N/A ILE 208.A N ILE 204.A O no hydrogen 3.029 N/A ASP 209.A N GLN 205.A O no hydrogen 2.756 N/A ALA 210.A N ALA 206.A O no hydrogen 3.057 N/A GLY 211.A N ILE 208.A O no hydrogen 2.883 N/A ALA 212.A N VAL 207.A O no hydrogen 3.377 N/A LEU 216.A N ALA 212.A O no hydrogen 3.055 N/A VAL 217.A N LEU 213.A O no hydrogen 2.825 N/A GLN 218.A N PRO 214.A O no hydrogen 3.050 N/A LEU 219.A N ALA 215.A O no hydrogen 2.969 N/A LEU 220.A N LEU 216.A O no hydrogen 3.249 N/A LEU 220.A N VAL 217.A O no hydrogen 3.077 N/A SER 221.A N GLN 218.A O no hydrogen 3.036 N/A SER 222.A N LEU 219.A O no hydrogen 2.957 N/A SER 222.A OG ASN 224.A O no hydrogen 3.534 N/A ASN 224.A N SER 222.A OG no hydrogen 3.012 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.819 N/A GLN 226.A N ASN 224.A OD1 no hydrogen 2.775 N/A ILE 227.A N ASN 224.A OD1 no hydrogen 3.180 N/A LEU 228.A N ASN 224.A O no hydrogen 2.865 N/A GLN 229.A N GLU 225.A O no hydrogen 2.975 N/A GLN 229.A NE2 GLN 229.A O no hydrogen 3.699 N/A GLN 229.A NE2 LYS 268.A O no hydrogen 3.646 N/A GLU 230.A N GLN 226.A O no hydrogen 3.258 N/A ALA 231.A N ILE 227.A O no hydrogen 2.908 N/A LEU 232.A N LEU 228.A O no hydrogen 2.763 N/A TRP 233.A N GLN 229.A O no hydrogen 2.903 N/A ALA 234.A N GLU 230.A O no hydrogen 3.006 N/A LEU 235.A N ALA 231.A O no hydrogen 2.932 N/A SER 236.A N LEU 232.A O no hydrogen 2.783 N/A SER 236.A OG GLU 272.A OE2 no hydrogen 2.857 N/A SER 236.A OG GLU 275.A OE2 no hydrogen 3.441 N/A ASN 237.A N TRP 233.A O no hydrogen 3.012 N/A ASN 237.A ND2 SER 194.A O.A no hydrogen 2.652 N/A ASN 237.A ND2 SER 194.A O.B no hydrogen 2.667 N/A ASN 237.A ND2 SER 194.A O.C no hydrogen 2.649 N/A ILE 238.A N ALA 234.A O no hydrogen 3.024 N/A ALA 239.A N LEU 235.A O no hydrogen 2.879 N/A SER 240.A N ASN 237.A O no hydrogen 3.109 N/A SER 240.A OG SER 236.A O no hydrogen 3.339 N/A GLY 241.A N ILE 238.A O no hydrogen 2.977 N/A GLY 242.A N GLN 245.A OE1 no hydrogen 2.747 N/A GLN 245.A NE2 GLN 205.A OE1 no hydrogen 2.814 N/A LYS 246.A N GLY 242.A O no hydrogen 2.902 N/A LYS 246.A NZ ALA 239.A O no hydrogen 2.779 N/A LYS 246.A NZ GLY 241.A O no hydrogen 3.314 N/A LYS 246.A NZ LYS 279.A O no hydrogen 3.109 N/A GLN 247.A N ASN 243.A O no hydrogen 2.958 N/A GLN 247.A NE2 GLU 251.A OE2 no hydrogen 3.023 N/A ALA 248.A N GLU 244.A O no hydrogen 3.189 N/A VAL 249.A N GLN 245.A O no hydrogen 3.154 N/A LYS 250.A N LYS 246.A O no hydrogen 2.994 N/A LYS 250.A NZ LEU 280.A O no hydrogen 3.311 N/A GLU 251.A N GLN 247.A O no hydrogen 2.810 N/A ALA 252.A N ALA 248.A O no hydrogen 3.055 N/A ALA 252.A N VAL 249.A O no hydrogen 3.242 N/A GLY 253.A N LYS 250.A O no hydrogen 3.063 N/A ALA 254.A N VAL 249.A O no hydrogen 3.414 N/A LYS 257.A NZ VAL 217.A O no hydrogen 2.904 N/A LYS 257.A NZ SER 221.A OG no hydrogen 2.642 N/A LEU 258.A N ALA 254.A O no hydrogen 2.966 N/A GLU 259.A N LEU 255.A O no hydrogen 2.961 N/A GLN 260.A N GLU 256.A O no hydrogen 3.180 N/A LEU 261.A N LYS 257.A O no hydrogen 2.967 N/A GLN 262.A N GLU 259.A O no hydrogen 3.276 N/A GLN 262.A NE2 GLU 259.A O no hydrogen 3.617 N/A SER 263.A OG GLN 260.A O no hydrogen 3.493 N/A HIS 264.A N LEU 261.A O no hydrogen 2.944 N/A ASN 266.A N HIS 264.A ND1 no hydrogen 3.029 N/A ILE 269.A N ASN 266.A OD1 no hydrogen 2.908 N/A GLN 270.A N ASN 266.A O no hydrogen 2.837 N/A GLN 270.A NE2 GLN 262.A O no hydrogen 3.174 N/A LYS 271.A N GLU 267.A O no hydrogen 3.003 N/A GLU 272.A N LYS 268.A O no hydrogen 3.116 N/A ALA 273.A N ILE 269.A O no hydrogen 2.931 N/A GLN 274.A N GLN 270.A O no hydrogen 2.967 N/A GLU 275.A N LYS 271.A O no hydrogen 2.923 N/A ALA 276.A N GLU 272.A O no hydrogen 2.881 N/A LEU 277.A N ALA 273.A O no hydrogen 2.922 N/A GLU 278.A N GLN 274.A O no hydrogen 2.943 N/A LYS 279.A N GLU 275.A O no hydrogen 3.080 N/A LYS 279.A NZ SER 236.A O no hydrogen 3.071 N/A LYS 279.A NZ SER 236.A OG no hydrogen 2.948 N/A LYS 279.A NZ SER 240.A OG no hydrogen 2.855 N/A LYS 279.A NZ GLU 275.A OE2 no hydrogen 2.887 N/A LEU 280.A N ALA 276.A O no hydrogen 3.194 N/A LEU 280.A N LEU 277.A O no hydrogen 3.257 N/A GLN 281.A N GLU 278.A O no hydrogen 3.019 N/A