Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ak9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 133.A OE2 no hydrogen 3.411 N/A GLN 2.A N GLN 2.A OE1 no hydrogen 2.857 N/A ASP 5.A N GLN 289.A OE1 no hydrogen 2.804 N/A LEU 8.A N ASP 5.A OD1 no hydrogen 3.037 N/A LEU 9.A N ASP 5.A O no hydrogen 3.136 N/A PHE 10.A N ILE 6.A O no hydrogen 2.905 N/A SER 11.A N GLN 7.A O no hydrogen 2.921 N/A SER 11.A OG GLN 7.A O no hydrogen 3.363 N/A SER 11.A OG LEU 8.A O no hydrogen 3.331 N/A GLY 12.A N LEU 8.A O no hydrogen 2.863 N/A PHE 13.A N LEU 9.A O no hydrogen 3.007 N/A SER 14.A N SER 11.A O no hydrogen 3.202 N/A SER 14.A OG SER 11.A O no hydrogen 3.265 N/A THR 16.A OG1 THR 259.A O no hydrogen 3.415 N/A ARG 17.A N PHE 13.A O no hydrogen 2.836 N/A ARG 17.A NH1 PHE 10.A O no hydrogen 2.840 N/A ARG 17.A NH1 ALA 299.A O no hydrogen 2.845 N/A ARG 17.A NH2 PHE 10.A O no hydrogen 3.057 N/A GLU 18.A N SER 14.A O no hydrogen 3.032 N/A ASN 19.A ND2 VAL 45.A O no hydrogen 3.071 N/A ASN 19.A ND2 SER 49.A OG no hydrogen 2.749 N/A LEU 20.A N THR 16.A O no hydrogen 3.094 N/A VAL 22.A N ASN 19.A O no hydrogen 3.428 N/A VAL 23.A N LEU 20.A O no hydrogen 3.093 N/A LEU 26.A N VAL 22.A O no hydrogen 2.839 N/A LEU 27.A N VAL 23.A O no hydrogen 2.911 N/A LEU 27.A N ASP 24.A O no hydrogen 3.228 N/A THR 28.A N ASP 24.A O no hydrogen 3.238 N/A THR 28.A N GLU 25.A O no hydrogen 3.096 N/A THR 28.A OG1 GLU 25.A O no hydrogen 2.550 N/A TYR 29.A N LEU 26.A O no hydrogen 3.003 N/A TRP 30.A N LEU 27.A O no hydrogen 3.070 N/A TRP 30.A NE1 SER 35.A OG no hydrogen 2.529 N/A ASN 31.A ND2 GLU 34.A OE1 no hydrogen 2.955 N/A GLU 34.A N ASN 31.A OD1 no hydrogen 2.923 N/A ILE 38.A N GLU 34.A O no hydrogen 2.838 N/A LEU 39.A N SER 35.A O no hydrogen 2.852 N/A ASP 40.A N GLU 36.A O no hydrogen 3.072 N/A GLU 41.A N SER 37.A O no hydrogen 3.086 N/A LEU 42.A N ILE 38.A O no hydrogen 2.845 N/A GLU 43.A N LEU 39.A O no hydrogen 2.871 N/A GLU 44.A N ASP 40.A O no hydrogen 2.983 N/A VAL 45.A N GLU 41.A O no hydrogen 2.991 N/A LEU 46.A N LEU 42.A O no hydrogen 3.109 N/A LEU 47.A N GLU 43.A O no hydrogen 3.025 N/A VAL 48.A N GLU 44.A O no hydrogen 3.103 N/A SER 49.A N VAL 45.A O no hydrogen 3.373 N/A SER 49.A OG ALA 260.A O no hydrogen 3.295 N/A ASP 50.A N LEU 47.A O no hydrogen 2.939 N/A PHE 51.A N LEU 46.A O no hydrogen 3.184 N/A GLY 52.A N SER 267.A OG no hydrogen 2.809 N/A THR 55.A OG1 ASP 270.A OD2 no hydrogen 2.834 N/A ALA 56.A N GLY 52.A O no hydrogen 2.826 N/A LEU 57.A N PRO 53.A O no hydrogen 2.976 N/A LYS 58.A N LYS 54.A O no hydrogen 3.162 N/A LYS 58.A NZ ASP 270.A OD1 no hydrogen 2.753 N/A LYS 58.A NZ ASP 270.A OD2 no hydrogen 3.273 N/A ILE 59.A N THR 55.A O no hydrogen 2.972 N/A VAL 60.A N ALA 56.A O no hydrogen 3.028 N/A ASP 61.A N LEU 57.A O no hydrogen 2.842 N/A THR 62.A N LYS 58.A O no hydrogen 3.440 N/A THR 62.A OG1 LYS 58.A O no hydrogen 3.038 N/A ARG 64.A N VAL 60.A O no hydrogen 2.871 N/A ARG 64.A NH1 GLU 36.A OE1 no hydrogen 3.227 N/A ARG 64.A NH1 ASP 40.A OD1 no hydrogen 3.484 N/A ARG 64.A NH2 ASP 40.A OD1 no hydrogen 3.065 N/A ARG 64.A NH2 GLU 43.A OE1 no hydrogen 2.979 N/A LYS 65.A N ASP 61.A O no hydrogen 3.047 N/A ASP 66.A N THR 62.A O no hydrogen 3.048 N/A ILE 67.A N ILE 63.A O no hydrogen 2.899 N/A LEU 68.A N ARG 64.A O no hydrogen 2.991 N/A ALA 69.A N LYS 65.A O no hydrogen 2.915 N/A GLY 70.A N ILE 67.A O no hydrogen 3.076 N/A ARG 71.A N ASP 66.A O no hydrogen 2.890 N/A LEU 72.A N ASP 66.A O no hydrogen 3.270 N/A LYS 73.A N GLN 77.A OE1 no hydrogen 2.916 N/A LYS 73.A NZ GLY 70.A O no hydrogen 3.207 N/A GLN 77.A N SER 74.A OG no hydrogen 3.081 N/A ILE 78.A N SER 74.A O no hydrogen 2.964 N/A LYS 79.A N GLY 75.A O no hydrogen 2.942 N/A LYS 79.A NZ ASP 24.A OD1 no hydrogen 3.105 N/A GLU 80.A N PRO 76.A O no hydrogen 2.996 N/A ALA 81.A N GLN 77.A O no hydrogen 2.983 N/A LEU 82.A N ILE 78.A O no hydrogen 2.812 N/A LYS 83.A N LYS 79.A O no hydrogen 3.182 N/A LYS 83.A NZ PHE 301.A O no hydrogen 3.112 N/A LYS 84.A N GLU 80.A O no hydrogen 3.078 N/A ASN 85.A N ALA 81.A O no hydrogen 2.860 N/A ASN 85.A ND2 ILE 59.A O no hydrogen 3.472 N/A ILE 86.A N LEU 82.A O no hydrogen 3.130 N/A PHE 87.A N LYS 83.A O no hydrogen 2.984 N/A LYS 88.A N LYS 84.A O no hydrogen 2.866 N/A LYS 88.A NZ GLU 92.A OE1 no hydrogen 3.270 N/A LEU 89.A N ASN 85.A O no hydrogen 2.991 N/A LEU 90.A N ILE 86.A O no hydrogen 3.079 N/A THR 91.A N LYS 88.A O no hydrogen 3.086 N/A THR 91.A OG1 PHE 87.A O no hydrogen 2.733 N/A THR 91.A OG1 LYS 88.A O no hydrogen 3.417 N/A GLU 92.A N LYS 88.A O no hydrogen 2.815 N/A ARG 93.A NH1 ARG 93.A O no hydrogen 3.027 N/A THR 97.A OG1 PHE 291.A O no hydrogen 3.361 N/A GLU 98.A N THR 96.A OG1 no hydrogen 3.096 N/A GLN 100.A N GLU 222.A OE2 no hydrogen 2.857 N/A GLN 100.A NE2 GLU 98.A O no hydrogen 3.360 N/A SER 104.A OG ASN 103.A OD1 no hydrogen 3.091 N/A ARG 105.A NH2 ASP 183.A O no hydrogen 2.573 N/A ALA 107.A N ASP 185.A O no hydrogen 2.919 N/A VAL 108.A N ASN 221.A OD1 no hydrogen 2.843 N/A LEU 109.A N VAL 187.A O no hydrogen 2.848 N/A MET 110.A N GLU 222.A O no hydrogen 2.925 N/A ILE 111.A N CYS 189.A O no hydrogen 2.860 N/A VAL 112.A N LEU 224.A O no hydrogen 2.825 N/A GLY 118.A N ASN 115.A OD1 no hydrogen 2.791 N/A LYS 119.A N ASN 115.A O no hydrogen 2.926 N/A LYS 119.A NZ GLY 113.A O no hydrogen 2.821 N/A LYS 119.A NZ THR 191.A O no hydrogen 2.577 N/A THR 120.A N GLY 116.A O no hydrogen 2.872 N/A THR 120.A OG1 GLY 116.A O no hydrogen 2.679 N/A THR 121.A N GLY 117.A O no hydrogen 2.964 N/A THR 121.A OG1 GLY 117.A O no hydrogen 3.091 N/A THR 122.A N GLY 118.A O no hydrogen 2.899 N/A THR 122.A OG1 GLY 118.A O no hydrogen 2.800 N/A LEU 123.A N LYS 119.A O no hydrogen 2.901 N/A GLY 124.A N THR 120.A O no hydrogen 3.002 N/A LYS 125.A N THR 121.A O no hydrogen 2.977 N/A LYS 125.A NZ GLY 284.A O no hydrogen 2.821 N/A LEU 126.A N THR 122.A O no hydrogen 2.790 N/A ALA 127.A N LEU 123.A O no hydrogen 3.010 N/A ASN 128.A N GLY 124.A O no hydrogen 3.030 N/A ASN 128.A ND2 ASP 286.A OD1 no hydrogen 2.959 N/A ARG 129.A N LYS 125.A O no hydrogen 3.274 N/A ARG 129.A NH2 SER 1.A O no hydrogen 2.497 N/A PHE 130.A N LEU 126.A O no hydrogen 3.102 N/A LYS 131.A N ALA 127.A O no hydrogen 2.881 N/A LYS 131.A NZ VAL 135.A O no hydrogen 3.532 N/A LYS 131.A NZ GLY 159.A O no hydrogen 3.412 N/A LYS 132.A N ASN 128.A O no hydrogen 3.088 N/A LYS 132.A NZ ASP 286.A OD1 no hydrogen 3.547 N/A GLU 133.A N PHE 130.A O no hydrogen 2.992 N/A GLY 134.A N LYS 131.A O no hydrogen 3.079 N/A VAL 135.A N PHE 130.A O no hydrogen 3.029 N/A LYS 136.A N ASP 185.A OD2 no hydrogen 2.905 N/A LYS 136.A NZ GLU 182.A O no hydrogen 2.765 N/A LEU 138.A N VAL 186.A O no hydrogen 2.972 N/A MET 139.A N GLU 161.A O no hydrogen 2.739 N/A ALA 140.A N LEU 188.A O no hydrogen 2.933 N/A ALA 141.A N VAL 163.A O no hydrogen 2.939 N/A GLY 142.A N ALA 140.A O no hydrogen 3.054 N/A THR 144.A OG1 PRO 166.A O no hydrogen 3.532 N/A GLN 150.A N ALA 146.A O no hydrogen 2.803 N/A LEU 151.A N ALA 147.A O no hydrogen 2.978 N/A GLU 152.A N GLY 148.A O no hydrogen 2.979 N/A VAL 153.A N GLU 149.A O no hydrogen 3.213 N/A TRP 154.A N GLN 150.A O no hydrogen 3.320 N/A ALA 155.A N LEU 151.A O no hydrogen 2.839 N/A GLN 156.A N GLU 152.A O no hydrogen 3.041 N/A ARG 157.A N VAL 153.A O no hydrogen 2.960 N/A THR 158.A N TRP 154.A O no hydrogen 3.000 N/A THR 158.A OG1 TRP 154.A O no hydrogen 2.651 N/A THR 158.A OG1 ALA 155.A O no hydrogen 3.272 N/A THR 158.A OG1 SER 160.A OG no hydrogen 2.895 N/A GLY 159.A N GLN 156.A O no hydrogen 3.278 N/A SER 160.A N ALA 155.A O no hydrogen 2.798 N/A SER 160.A OG THR 158.A OG1 no hydrogen 2.895 N/A GLU 161.A N VAL 137.A O no hydrogen 3.224 N/A VAL 163.A N MET 139.A O no hydrogen 2.726 N/A VAL 171.A N ARG 167.A O no hydrogen 3.298 N/A LEU 172.A N PRO 168.A O no hydrogen 2.914 N/A SER 173.A N ALA 169.A O no hydrogen 2.934 N/A SER 173.A OG ALA 169.A O no hydrogen 3.283 N/A SER 173.A OG ALA 170.A O no hydrogen 3.178 N/A GLN 174.A N ALA 170.A O no hydrogen 2.962 N/A ALA 175.A N VAL 171.A O no hydrogen 2.966 N/A VAL 176.A N LEU 172.A O no hydrogen 2.938 N/A ARG 177.A N SER 173.A O no hydrogen 2.952 N/A ARG 177.A NH1 SER 173.A OG no hydrogen 3.353 N/A ARG 178.A N GLN 174.A O no hydrogen 3.006 N/A ARG 178.A NE GLU 182.A OE1 no hydrogen 3.297 N/A ALA 179.A N ALA 175.A O no hydrogen 2.978 N/A VAL 180.A N VAL 176.A O no hydrogen 3.014 N/A GLU 181.A N ARG 177.A O no hydrogen 2.976 N/A GLU 182.A N ARG 178.A O no hydrogen 2.869 N/A PHE 184.A N ALA 179.A O no hydrogen 3.146 N/A ASP 185.A N LYS 136.A O no hydrogen 2.889 N/A VAL 186.A N LYS 136.A O no hydrogen 3.253 N/A VAL 187.A N ALA 107.A O no hydrogen 2.801 N/A LEU 188.A N LEU 138.A O no hydrogen 2.874 N/A CYS 189.A N LEU 109.A O no hydrogen 2.816 N/A ASP 190.A N ALA 140.A O no hydrogen 2.872 N/A THR 191.A N ASP 190.A OD1 no hydrogen 2.844 N/A THR 191.A OG1 ILE 111.A O no hydrogen 2.701 N/A SER 192.A OG ASP 143.A OD1 no hydrogen 3.337 N/A SER 192.A OG GLU 204.A OE2 no hydrogen 3.178 N/A THR 197.A OG1 ASN 198.A O no hydrogen 3.253 N/A LEU 201.A N ASN 198.A OD1 no hydrogen 2.724 N/A MET 202.A N ASN 198.A O no hydrogen 2.846 N/A GLU 203.A N TYR 199.A O no hydrogen 2.894 N/A GLU 204.A N ASN 200.A O no hydrogen 2.922 N/A LEU 205.A N LEU 201.A O no hydrogen 2.986 N/A ARG 206.A N MET 202.A O no hydrogen 3.082 N/A ARG 206.A NE VAL 245.A O no hydrogen 2.990 N/A ARG 206.A NH2 GLN 244.A O no hydrogen 3.022 N/A GLY 207.A N GLU 203.A O no hydrogen 2.866 N/A CYS 208.A N GLU 204.A O no hydrogen 2.918 N/A CYS 208.A SG GLU 204.A O no hydrogen 3.383 N/A LYS 209.A N LEU 205.A O no hydrogen 3.020 N/A LYS 209.A NZ SER 213.A OG no hydrogen 2.841 N/A ARG 210.A N ARG 206.A O no hydrogen 2.955 N/A ARG 210.A NH1 GLU 203.A OE2 no hydrogen 2.956 N/A ALA 211.A N GLY 207.A O no hydrogen 2.979 N/A VAL 212.A N CYS 208.A O no hydrogen 2.998 N/A SER 213.A N LYS 209.A O no hydrogen 2.993 N/A SER 213.A OG LYS 209.A O no hydrogen 3.426 N/A SER 213.A OG ALA 219.A O no hydrogen 2.484 N/A LYS 214.A N ARG 210.A O no hydrogen 2.896 N/A ALA 215.A N ALA 211.A O no hydrogen 3.099 N/A LEU 216.A N VAL 212.A O no hydrogen 2.973 N/A ALA 219.A N LEU 216.A O no hydrogen 2.944 N/A ASN 221.A N VAL 108.A O no hydrogen 2.769 N/A GLU 222.A N VAL 108.A O no hydrogen 3.417 N/A VAL 223.A N THR 249.A OG1 no hydrogen 2.850 N/A LEU 224.A N MET 110.A O no hydrogen 2.820 N/A LEU 225.A N GLY 250.A O no hydrogen 2.973 N/A VAL 226.A N VAL 112.A O no hydrogen 2.902 N/A LEU 227.A N ILE 252.A O no hydrogen 2.740 N/A GLY 229.A N THR 254.A O no hydrogen 2.772 N/A THR 230.A N ASP 228.A OD1 no hydrogen 2.838 N/A THR 230.A OG1 ASP 228.A OD1 no hydrogen 2.689 N/A THR 231.A N ASP 228.A O no hydrogen 2.978 N/A THR 231.A OG1 ASP 228.A O no hydrogen 2.799 N/A GLY 232.A N GLY 229.A O no hydrogen 2.971 N/A LEU 233.A N ASP 50.A OD2 no hydrogen 2.748 N/A ASN 234.A N THR 231.A O no hydrogen 3.063 N/A ASN 234.A ND2 THR 231.A O no hydrogen 3.550 N/A MET 235.A N GLY 232.A O no hydrogen 2.960 N/A LEU 236.A N LEU 233.A O no hydrogen 3.027 N/A ALA 239.A N MET 235.A O no hydrogen 3.047 N/A ARG 240.A N LEU 236.A O no hydrogen 2.978 N/A GLU 241.A N ALA 237.A O no hydrogen 3.158 N/A PHE 242.A N GLN 238.A O no hydrogen 2.934 N/A ASN 243.A N ALA 239.A O no hydrogen 3.113 N/A GLN 244.A N ARG 240.A O no hydrogen 3.156 N/A GLN 244.A N GLU 241.A O no hydrogen 3.168 N/A VAL 245.A N GLU 241.A O no hydrogen 3.306 N/A ILE 246.A N PHE 242.A O no hydrogen 2.983 N/A VAL 248.A N ASN 243.A OD1 no hydrogen 3.299 N/A THR 249.A N VAL 223.A O no hydrogen 2.836 N/A THR 249.A OG1 GLU 222.A OE1 no hydrogen 2.538 N/A THR 249.A OG1 VAL 223.A O no hydrogen 3.152 N/A GLY 250.A N VAL 223.A O no hydrogen 3.378 N/A PHE 251.A N PRO 275.A O no hydrogen 2.877 N/A ILE 252.A N LEU 225.A O no hydrogen 2.835 N/A LEU 253.A N PHE 278.A O no hydrogen 3.147 N/A THR 254.A N LEU 227.A O no hydrogen 2.922 N/A THR 254.A OG1 LEU 227.A O no hydrogen 3.374 N/A LYS 255.A NZ ASP 228.A OD2 no hydrogen 2.881 N/A LEU 256.A N GLY 280.A O no hydrogen 3.026 N/A GLY 258.A N LYS 255.A O no hydrogen 3.197 N/A THR 259.A N LEU 256.A O no hydrogen 3.461 N/A ARG 261.A N THR 259.A OG1 no hydrogen 3.034 N/A ARG 261.A NE ASP 50.A OD2 no hydrogen 2.785 N/A ARG 261.A NH2 ASP 50.A OD2 no hydrogen 2.895 N/A GLY 262.A N THR 16.A OG1 no hydrogen 2.917 N/A GLY 263.A N SER 49.A O no hydrogen 2.875 N/A CYS 264.A N ARG 261.A O no hydrogen 3.075 N/A CYS 264.A SG ARG 261.A O no hydrogen 3.323 N/A VAL 265.A N GLY 262.A O no hydrogen 3.196 N/A VAL 266.A N GLY 263.A O no hydrogen 2.906 N/A SER 267.A N GLY 263.A O no hydrogen 3.113 N/A SER 267.A OG ASP 50.A O no hydrogen 2.993 N/A SER 267.A OG GLY 263.A O no hydrogen 3.438 N/A VAL 268.A N CYS 264.A O no hydrogen 2.910 N/A VAL 269.A N VAL 265.A O no hydrogen 3.316 N/A ASP 270.A N VAL 266.A O no hydrogen 2.863 N/A GLU 271.A N SER 267.A O no hydrogen 2.852 N/A LEU 272.A N VAL 268.A O no hydrogen 2.946 N/A SER 273.A N VAL 269.A O no hydrogen 2.943 N/A LYS 277.A N PHE 251.A O no hydrogen 2.773 N/A LYS 277.A NZ GLU 98.A O no hydrogen 2.955 N/A LYS 277.A NZ GLU 222.A OE1 no hydrogen 3.055 N/A LYS 277.A NZ GLU 222.A OE2 no hydrogen 2.969 N/A PHE 278.A N PHE 251.A O no hydrogen 3.502 N/A VAL 279.A N GLN 289.A O no hydrogen 2.833 N/A GLY 280.A N LEU 253.A O no hydrogen 2.773 N/A VAL 281.A N ASP 287.A O no hydrogen 2.872 N/A GLY 284.A N ASP 287.A OD2 no hydrogen 2.621 N/A ASP 287.A N GLY 284.A O no hydrogen 2.965 N/A GLN 289.A N VAL 279.A O no hydrogen 2.901 N/A GLN 289.A NE2 ASP 286.A O no hydrogen 2.795 N/A PHE 291.A N LYS 277.A O no hydrogen 2.891 N/A GLN 294.A NE2 GLN 294.A O no hydrogen 3.350 N/A GLN 294.A NE2 ASP 298.A OD1 no hydrogen 3.250 N/A SER 295.A N ASP 292.A OD2 no hydrogen 3.015 N/A SER 295.A OG ASP 292.A OD2 no hydrogen 2.794 N/A PHE 296.A N ASP 292.A O no hydrogen 2.955 N/A VAL 297.A N ALA 293.A O no hydrogen 2.995 N/A ASP 298.A N GLN 294.A O no hydrogen 2.938 N/A ALA 299.A N SER 295.A O no hydrogen 2.941 N/A LEU 300.A N PHE 296.A O no hydrogen 3.051 N/A PHE 301.A N VAL 297.A O no hydrogen 2.845 N/A