Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4akt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ASN 20.A OD1 no hydrogen 2.843 N/A HIS 4.A ND1 GLU 116.A OE1 no hydrogen 2.728 N/A HIS 6.A N ASP 9.A OD2 no hydrogen 2.674 N/A LEU 8.A N HIS 6.A ND1 no hydrogen 2.964 N/A ASP 9.A N HIS 6.A O no hydrogen 2.953 N/A ARG 11.A NH1 GLU 243.A O no hydrogen 2.919 N/A ARG 11.A NH2 GLU 243.A O no hydrogen 2.944 N/A ILE 12.A N LEU 8.A O no hydrogen 2.861 N/A LEU 15.A N ILE 12.A O no hydrogen 3.115 N/A LEU 18.A N GLY 14.A O no hydrogen 2.994 N/A HIS 19.A N LEU 15.A O no hydrogen 2.823 N/A HIS 19.A NE2 ILE 123.A O no hydrogen 2.631 N/A ASN 20.A N ALA 16.A O no hydrogen 2.929 N/A ASN 20.A ND2 VAL 1.A O no hydrogen 3.031 N/A GLN 21.A N LEU 18.A O no hydrogen 3.004 N/A GLN 21.A NE2 GLN 330.A OE1 no hydrogen 3.099 N/A THR 22.A N LEU 18.A O no hydrogen 3.009 N/A THR 22.A N HIS 19.A O no hydrogen 3.230 N/A THR 22.A OG1 GLN 281.A OE1 no hydrogen 2.751 N/A GLY 24.A N THR 22.A OG1 no hydrogen 2.955 N/A ASP 25.A N SER 277.A OG no hydrogen 2.883 N/A GLN 27.A N ASP 25.A OD1 no hydrogen 2.905 N/A ILE 28.A N ASP 25.A O no hydrogen 3.154 N/A THR 29.A N ASN 157.A OD1 no hydrogen 3.010 N/A ILE 30.A N ARG 128.A O no hydrogen 2.810 N/A VAL 31.A N ILE 158.A O no hydrogen 3.011 N/A ILE 32.A N ILE 130.A O no hydrogen 2.841 N/A ILE 33.A N HIS 160.A O no hydrogen 2.823 N/A GLY 35.A N ASP 34.A OD1 no hydrogen 2.810 N/A ASP 36.A N ASN 102.A OD1 no hydrogen 2.966 N/A TYR 39.A OH SER 50.A O no hydrogen 3.049 N/A TYR 39.A OH ASN 131.A OD1 no hydrogen 2.726 N/A THR 40.A N ASP 38.A OD1 no hydrogen 2.944 N/A THR 40.A OG1 ASP 38.A OD1 no hydrogen 2.492 N/A THR 40.A OG1 ASP 38.A OD2 no hydrogen 3.241 N/A SER 42.A N GLU 253.A OE2 no hydrogen 2.929 N/A SER 42.A OG GLU 253.A OE1 no hydrogen 2.671 N/A PHE 44.A N LEU 41.A O no hydrogen 3.200 N/A GLU 45.A N SER 42.A O no hydrogen 2.981 N/A ALA 47.A N PHE 44.A O no hydrogen 2.965 N/A VAL 49.A N ALA 47.A O no hydrogen 2.997 N/A SER 50.A N VAL 129.A O no hydrogen 3.085 N/A LYS 51.A NZ ASP 36.A OD1 no hydrogen 2.623 N/A LYS 51.A NZ PRO 37.A O no hydrogen 2.984 N/A VAL 52.A N ASN 131.A O no hydrogen 2.871 N/A HIS 57.A N PRO 54.A O no hydrogen 3.145 N/A ASP 67.A N THR 64.A O no hydrogen 3.006 N/A ASP 67.A N THR 64.A OG1 no hydrogen 3.259 N/A TYR 68.A N THR 64.A O no hydrogen 3.388 N/A ALA 69.A N PRO 65.A O no hydrogen 2.788 N/A ALA 70.A N GLU 66.A O no hydrogen 2.936 N/A PHE 71.A N ASP 67.A O no hydrogen 3.044 N/A GLN 72.A N TYR 68.A O no hydrogen 3.015 N/A GLN 72.A NE2 PRO 250.A O no hydrogen 2.811 N/A SER 73.A N ALA 69.A O no hydrogen 2.973 N/A ILE 74.A N ALA 70.A O no hydrogen 3.178 N/A ARG 75.A N PHE 71.A O no hydrogen 3.093 N/A ARG 75.A NH1 ASP 103.A OD2 no hydrogen 2.810 N/A ARG 75.A NH2 ASP 103.A OD1 no hydrogen 3.035 N/A ARG 75.A NH2 ASP 103.A OD2 no hydrogen 3.523 N/A ARG 75.A NH2 GLN 249.A OE1 no hydrogen 2.987 N/A ASP 76.A N GLN 72.A O no hydrogen 2.804 N/A GLN 77.A N SER 73.A O no hydrogen 3.081 N/A GLN 77.A NE2 SER 73.A O no hydrogen 3.152 N/A GLN 77.A NE2 SER 73.A OG no hydrogen 3.113 N/A GLY 78.A N ARG 75.A O no hydrogen 2.799 N/A GLU 85.A N GLY 81.A O no hydrogen 3.343 N/A GLU 86.A N LYS 82.A O no hydrogen 2.903 N/A ALA 87.A N GLU 83.A O no hydrogen 3.114 N/A LEU 88.A N LYS 84.A O no hydrogen 2.915 N/A GLU 89.A N GLU 85.A O no hydrogen 2.951 N/A ALA 90.A N GLU 86.A O no hydrogen 3.155 N/A ALA 90.A N ALA 87.A O no hydrogen 3.197 N/A VAL 91.A N ALA 87.A O no hydrogen 3.359 N/A ILE 92.A N LEU 88.A O no hydrogen 2.875 N/A THR 95.A N ILE 92.A O no hydrogen 3.396 N/A THR 95.A OG1 ASP 67.A OD2 no hydrogen 2.800 N/A LYS 96.A NZ GLU 85.A OE2 no hydrogen 2.968 N/A LYS 96.A NZ GLU 89.A OE1 no hydrogen 3.226 N/A ARG 98.A NE ASP 135.A OD1 no hydrogen 2.598 N/A ARG 98.A NH1 GLU 61.A O no hydrogen 3.167 N/A ARG 98.A NH2 GLU 61.A O no hydrogen 2.695 N/A ARG 98.A NH2 ASP 135.A OD1 no hydrogen 3.261 N/A ARG 98.A NH2 ASP 135.A OD2 no hydrogen 3.005 N/A ILE 99.A N THR 95.A O no hydrogen 2.961 N/A VAL 100.A N LYS 96.A O no hydrogen 3.055 N/A LEU 101.A N ASP 97.A O no hydrogen 3.373 N/A ASN 102.A N ARG 98.A O no hydrogen 2.875 N/A ASN 102.A ND2 TYR 68.A OH no hydrogen 2.994 N/A ASN 102.A ND2 ASP 135.A OD2 no hydrogen 3.219 N/A ASP 103.A N ILE 99.A O no hydrogen 2.729 N/A ALA 104.A N VAL 100.A O no hydrogen 3.014 N/A ALA 105.A N LEU 101.A O no hydrogen 2.924 N/A CYS 106.A N ASN 102.A O no hydrogen 3.023 N/A CYS 106.A SG ASN 102.A O no hydrogen 3.902 N/A HIS 107.A N ASP 103.A O no hydrogen 3.084 N/A HIS 107.A NE2 VAL 256.A O no hydrogen 3.012 N/A VAL 108.A N ALA 104.A O no hydrogen 2.804 N/A THR 109.A N ALA 105.A O no hydrogen 2.863 N/A THR 109.A OG1 ALA 105.A O no hydrogen 2.489 N/A SER 110.A N CYS 106.A O no hydrogen 2.987 N/A SER 110.A OG CYS 106.A O no hydrogen 2.962 N/A SER 110.A OG HIS 107.A O no hydrogen 2.745 N/A THR 111.A N HIS 107.A O no hydrogen 2.976 N/A THR 111.A OG1 HIS 107.A O no hydrogen 2.896 N/A ILE 112.A N VAL 108.A O no hydrogen 3.189 N/A VAL 113.A N THR 109.A O no hydrogen 2.934 N/A GLY 114.A N SER 110.A O no hydrogen 2.906 N/A GLN 115.A N CYS 43.A O no hydrogen 2.929 N/A GLN 115.A NE2 VAL 113.A O no hydrogen 2.721 N/A GLN 115.A NE2 PRO 125.A O no hydrogen 2.716 N/A SER 118.A N GLN 115.A O no hydrogen 3.263 N/A SER 118.A OG GLN 115.A O no hydrogen 2.598 N/A VAL 120.A N SER 118.A OG no hydrogen 3.281 N/A GLY 122.A N GLY 114.A O no hydrogen 2.914 N/A ILE 123.A N THR 111.A O no hydrogen 2.944 N/A ALA 124.A N ILE 112.A O no hydrogen 2.852 N/A ASN 126.A N LEU 23.A O no hydrogen 2.893 N/A ASN 126.A ND2 GLY 24.A O no hydrogen 3.393 N/A CYS 127.A N ALA 124.A O no hydrogen 3.229 N/A CYS 127.A SG ASP 25.A O no hydrogen 3.820 N/A CYS 127.A SG SER 277.A OG no hydrogen 3.524 N/A ARG 128.A N ILE 28.A O no hydrogen 3.052 N/A VAL 129.A N GLU 48.A O no hydrogen 2.940 N/A ILE 130.A N ILE 30.A O no hydrogen 2.854 N/A ASN 131.A N SER 50.A O no hydrogen 2.919 N/A ASN 131.A ND2 THR 109.A OG1 no hydrogen 2.996 N/A MET 132.A N ILE 32.A O no hydrogen 2.795 N/A GLN 134.A N ASP 34.A O no hydrogen 2.876 N/A GLN 134.A NE2 MET 132.A O no hydrogen 3.231 N/A SER 140.A OG ASP 137.A O no hydrogen 2.685 N/A ASN 143.A N SER 140.A OG no hydrogen 3.274 N/A ASN 143.A ND2 ASP 137.A O no hydrogen 2.766 N/A ASN 143.A ND2 SER 140.A OG no hydrogen 2.951 N/A LEU 144.A N SER 140.A O no hydrogen 3.081 N/A ALA 145.A N PRO 141.A O no hydrogen 2.811 N/A ARG 146.A N LEU 142.A O no hydrogen 2.959 N/A ALA 147.A N ASN 143.A O no hydrogen 2.977 N/A ILE 148.A N LEU 144.A O no hydrogen 2.743 N/A ASP 149.A N ALA 145.A O no hydrogen 2.879 N/A LEU 150.A N ARG 146.A O no hydrogen 3.154 N/A ALA 151.A N ALA 147.A O no hydrogen 2.912 N/A LEU 152.A N ILE 148.A O no hydrogen 2.962 N/A GLU 153.A N ASP 149.A O no hydrogen 3.047 N/A LEU 154.A N LEU 150.A O no hydrogen 2.790 N/A GLY 155.A N LEU 152.A O no hydrogen 2.784 N/A ALA 156.A N ALA 151.A O no hydrogen 3.202 N/A ASN 157.A N THR 29.A O no hydrogen 2.773 N/A ILE 158.A N THR 29.A O no hydrogen 3.134 N/A ILE 159.A N LEU 189.A O no hydrogen 2.683 N/A HIS 160.A N VAL 31.A O no hydrogen 2.877 N/A HIS 160.A ND1 THR 269.A OG1 no hydrogen 2.751 N/A CYS 161.A N VAL 191.A O no hydrogen 2.871 N/A ALA 162.A N ILE 33.A O no hydrogen 2.977 N/A ARG 165.A N LEU 204.A O no hydrogen 3.015 N/A THR 167.A N TRP 202.A O no hydrogen 2.968 N/A THR 167.A OG1 THR 169.A O no hydrogen 2.864 N/A THR 167.A OG1 GLU 171.A O no hydrogen 3.442 N/A GLN 168.A NE2 GLU 200.A O no hydrogen 3.383 N/A THR 169.A N THR 167.A OG1 no hydrogen 3.096 N/A GLU 171.A N THR 169.A OG1 no hydrogen 3.130 N/A LEU 176.A N GLU 173.A O no hydrogen 3.102 N/A VAL 177.A N GLU 173.A O no hydrogen 3.235 N/A GLN 178.A N GLU 174.A O no hydrogen 2.851 N/A ALA 179.A N ILE 175.A O no hydrogen 3.238 N/A ILE 180.A N LEU 176.A O no hydrogen 2.973 N/A LYS 181.A N VAL 177.A O no hydrogen 2.995 N/A LYS 182.A N GLN 178.A O no hydrogen 2.885 N/A LYS 182.A NZ ASP 149.A OD1 no hydrogen 2.758 N/A CYS 183.A N ALA 179.A O no hydrogen 3.236 N/A CYS 183.A SG ALA 179.A O no hydrogen 3.421 N/A GLN 184.A N ILE 180.A O no hydrogen 3.167 N/A GLN 184.A NE2 GLU 289.A OE1 no hydrogen 3.351 N/A ASP 185.A N LYS 181.A O no hydrogen 2.871 N/A ASN 186.A N CYS 183.A O no hydrogen 3.213 N/A ASN 186.A ND2 LYS 182.A O no hydrogen 2.715 N/A ASN 187.A N GLN 184.A O no hydrogen 3.080 N/A ASN 187.A ND2 VAL 286.A O no hydrogen 2.935 N/A VAL 188.A N CYS 183.A O no hydrogen 2.873 N/A LEU 189.A N ASN 157.A O no hydrogen 3.066 N/A VAL 191.A N ILE 159.A O no hydrogen 2.983 N/A SER 192.A N LEU 212.A O no hydrogen 3.139 N/A SER 192.A OG PRO 193.A O no hydrogen 3.567 N/A THR 194.A N VAL 214.A O no hydrogen 2.839 N/A THR 194.A OG1 VAL 214.A O no hydrogen 3.219 N/A THR 194.A OG1 ASN 228.A O no hydrogen 3.246 N/A GLY 195.A N THR 261.A OG1 no hydrogen 3.162 N/A SER 198.A N PHE 226.A O no hydrogen 2.871 N/A ASN 199.A N ASN 228.A OD1 no hydrogen 2.837 N/A ASN 199.A ND2 TRP 229.A O no hydrogen 2.892 N/A GLU 200.A N ASN 197.A O no hydrogen 3.114 N/A TRP 202.A N THR 167.A O no hydrogen 2.709 N/A TRP 202.A NE1 ASN 199.A OD1 no hydrogen 3.208 N/A TRP 202.A NE1 TRP 229.A O no hydrogen 2.955 N/A CYS 203.A SG THR 194.A O no hydrogen 3.131 N/A LEU 204.A N ARG 165.A O no hydrogen 2.887 N/A VAL 207.A N CYS 203.A O no hydrogen 3.157 N/A LEU 208.A N PRO 205.A O no hydrogen 2.959 N/A GLY 210.A N GLU 236.A OE1 no hydrogen 3.086 N/A THR 211.A N LEU 208.A O no hydrogen 3.526 N/A THR 211.A OG1 PRO 205.A O no hydrogen 3.203 N/A THR 211.A OG1 ALA 206.A O no hydrogen 3.000 N/A THR 211.A OG1 LEU 208.A O no hydrogen 3.062 N/A LEU 212.A N ILE 190.A O no hydrogen 2.754 N/A ALA 213.A N GLU 236.A O no hydrogen 3.259 N/A VAL 214.A N SER 192.A O no hydrogen 3.025 N/A GLY 215.A N ILE 238.A O no hydrogen 2.925 N/A ALA 216.A N SER 227.A OG no hydrogen 2.939 N/A ALA 217.A N ALA 240.A O no hydrogen 2.709 N/A LYS 218.A N THR 222.A O no hydrogen 2.665 N/A VAL 219.A N GLU 243.A OE1 no hydrogen 2.969 N/A GLY 221.A N LYS 218.A O no hydrogen 3.069 N/A THR 222.A N ASP 220.A OD1 no hydrogen 2.898 N/A THR 222.A OG1 ASP 220.A OD1 no hydrogen 2.510 N/A THR 222.A OG1 ASP 220.A OD2 no hydrogen 3.320 N/A CYS 224.A N ALA 216.A O no hydrogen 2.934 N/A CYS 224.A SG ALA 216.A O no hydrogen 3.634 N/A SER 227.A N CYS 224.A O no hydrogen 2.992 N/A ASN 228.A N GLY 195.A O no hydrogen 2.973 N/A ASN 228.A ND2 THR 194.A O no hydrogen 2.910 N/A ASN 228.A ND2 ASN 197.A OD1 no hydrogen 3.222 N/A TRP 229.A N ASN 199.A OD1 no hydrogen 2.810 N/A GLY 230.A N THR 234.A OG1 no hydrogen 2.844 N/A ASN 232.A ND2 VAL 207.A O no hydrogen 2.860 N/A ASN 233.A N GLY 230.A O no hydrogen 2.927 N/A ASN 233.A ND2 GLY 230.A O no hydrogen 3.302 N/A THR 234.A N GLY 230.A O no hydrogen 3.350 N/A THR 234.A N GLY 231.A O no hydrogen 3.121 N/A THR 234.A OG1 GLU 311.A O no hydrogen 2.965 N/A LYS 235.A N GLY 231.A O no hydrogen 3.159 N/A GLU 236.A N ASN 232.A O no hydrogen 2.994 N/A ILE 238.A N ALA 213.A O no hydrogen 2.884 N/A LEU 239.A N GLY 316.A O no hydrogen 2.901 N/A ALA 240.A N GLY 215.A O no hydrogen 3.069 N/A GLY 242.A N ALA 217.A O no hydrogen 2.922 N/A GLU 243.A N ALA 217.A O no hydrogen 3.136 N/A GLU 244.A N THR 259.A OG1 no hydrogen 2.946 N/A ILE 245.A N LEU 258.A O no hydrogen 2.870 N/A GLY 247.A N VAL 256.A O no hydrogen 3.074 N/A ALA 248.A N SER 110.A OG no hydrogen 3.012 N/A GLN 249.A NE2 GLU 254.A O no hydrogen 2.928 N/A CYS 251.A N ASP 38.A OD2 no hydrogen 2.896 N/A GLU 254.A N THR 252.A OG1 no hydrogen 3.188 N/A VAL 256.A N GLY 247.A O no hydrogen 2.885 N/A ARG 257.A NH1 ASP 7.A OD2 no hydrogen 3.006 N/A ARG 257.A NH1 GLU 244.A O no hydrogen 2.827 N/A ARG 257.A NH2 ASP 7.A OD1 no hydrogen 2.729 N/A ARG 257.A NH2 ASP 7.A OD2 no hydrogen 3.392 N/A LEU 258.A N ILE 245.A O no hydrogen 2.994 N/A GLY 260.A N GLY 242.A O no hydrogen 2.991 N/A THR 261.A N ASN 196.A OD1 no hydrogen 3.052 N/A THR 261.A OG1 ASN 196.A OD1 no hydrogen 2.875 N/A MET 263.A N GLY 260.A O no hydrogen 2.898 N/A ALA 264.A N GLY 260.A O no hydrogen 3.202 N/A ALA 265.A N THR 261.A O no hydrogen 2.848 N/A MET 268.A N ALA 264.A O no hydrogen 3.356 N/A THR 269.A N ALA 265.A O no hydrogen 2.904 N/A THR 269.A OG1 HIS 160.A ND1 no hydrogen 2.751 N/A THR 269.A OG1 ALA 265.A O no hydrogen 3.481 N/A GLY 270.A N PRO 266.A O no hydrogen 2.817 N/A ILE 271.A N VAL 267.A O no hydrogen 2.788 N/A SER 272.A N MET 268.A O no hydrogen 2.793 N/A SER 272.A OG MET 268.A O no hydrogen 2.808 N/A ALA 273.A N THR 269.A O no hydrogen 2.838 N/A LEU 274.A N GLY 270.A O no hydrogen 2.982 N/A LEU 275.A N ILE 271.A O no hydrogen 3.016 N/A MET 276.A N SER 272.A O no hydrogen 2.908 N/A SER 277.A N ALA 273.A O no hydrogen 2.814 N/A SER 277.A OG ALA 273.A O no hydrogen 2.784 N/A LEU 278.A N LEU 274.A O no hydrogen 2.848 N/A GLN 279.A N LEU 275.A O no hydrogen 3.318 N/A VAL 280.A N MET 276.A O no hydrogen 3.273 N/A GLN 281.A N SER 277.A O no hydrogen 2.922 N/A GLN 281.A NE2 GLN 21.A O no hydrogen 3.026 N/A GLN 282.A N LEU 278.A O no hydrogen 3.049 N/A GLY 283.A N VAL 280.A O no hydrogen 2.876 N/A ASP 287.A N GLN 279.A OE1 no hydrogen 3.039 N/A ALA 290.A N ASP 287.A OD1 no hydrogen 2.869 N/A VAL 291.A N ASP 287.A O no hydrogen 3.043 N/A ARG 292.A N ALA 288.A O no hydrogen 2.890 N/A ARG 292.A NE GLU 289.A OE1 no hydrogen 3.084 N/A ARG 292.A NH2 GLU 289.A OE2 no hydrogen 2.811 N/A THR 293.A N GLU 289.A O no hydrogen 2.888 N/A THR 293.A OG1 GLU 289.A O no hydrogen 2.938 N/A THR 293.A OG1 ALA 290.A O no hydrogen 3.236 N/A ALA 294.A N ALA 290.A O no hydrogen 2.840 N/A LEU 295.A N VAL 291.A O no hydrogen 3.022 N/A LEU 296.A N ARG 292.A O no hydrogen 3.042 N/A LYS 297.A N THR 293.A O no hydrogen 2.831 N/A THR 298.A N ALA 294.A O no hydrogen 3.258 N/A THR 298.A OG1 ALA 294.A O no hydrogen 2.832 N/A THR 298.A OG1 LEU 295.A O no hydrogen 3.523 N/A ALA 299.A N LEU 296.A O no hydrogen 3.321 N/A ILE 300.A N PHE 317.A O no hydrogen 2.989 N/A GLU 305.A N ASP 303.A OD1 no hydrogen 3.129 N/A VAL 306.A N ASP 303.A O no hydrogen 2.978 N/A VAL 307.A N ASP 303.A O no hydrogen 2.978 N/A GLU 311.A N GLU 309.A OE1 no hydrogen 3.101 N/A ARG 312.A N GLU 309.A O no hydrogen 2.962 N/A ARG 312.A NH1 HIS 225.A O no hydrogen 3.260 N/A CYS 313.A N PRO 310.A O no hydrogen 2.896 N/A LEU 314.A N GLU 311.A O no hydrogen 2.991 N/A ARG 315.A N GLY 237.A O no hydrogen 2.948 N/A ARG 315.A NH1 LYS 235.A O no hydrogen 2.894 N/A PHE 317.A N ILE 300.A O no hydrogen 2.819 N/A VAL 318.A N LEU 239.A O no hydrogen 2.904 N/A ASN 319.A ND2 THR 298.A O no hydrogen 2.764 N/A GLY 322.A N ASN 319.A OD1 no hydrogen 3.273 N/A ALA 323.A N ASN 319.A O no hydrogen 3.061 N/A MET 324.A N ILE 320.A O no hydrogen 2.862 N/A LYS 325.A N PRO 321.A O no hydrogen 3.240 N/A VAL 326.A N GLY 322.A O no hydrogen 3.080 N/A LEU 327.A N ALA 323.A O no hydrogen 3.022 N/A PHE 328.A N MET 324.A O no hydrogen 2.776 N/A GLY 329.A N LYS 325.A O no hydrogen 2.909 N/A GLN 330.A NE2 ASP 17.A OD2 no hydrogen 3.482 N/A GLN 330.A NE2 GLN 21.A OE1 no hydrogen 3.200 N/A