Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4aks_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N ASN 21.A OD1 no hydrogen 3.024 N/A HIS 5.A ND1 GLU 117.A OE1 no hydrogen 2.763 N/A HIS 7.A N ASP 10.A OD2 no hydrogen 2.937 N/A LEU 9.A N HIS 7.A ND1 no hydrogen 2.995 N/A ASP 10.A N HIS 7.A O no hydrogen 2.999 N/A ARG 12.A NH1 GLU 220.A O no hydrogen 3.022 N/A ARG 12.A NH1 GLU 221.A O no hydrogen 3.512 N/A ARG 12.A NH2 GLU 220.A O no hydrogen 2.790 N/A ILE 13.A N LEU 9.A O no hydrogen 2.918 N/A LEU 16.A N ILE 13.A O no hydrogen 3.101 N/A LEU 19.A N GLY 15.A O no hydrogen 2.930 N/A HIS 20.A N LEU 16.A O no hydrogen 2.852 N/A HIS 20.A NE2 ILE 124.A O no hydrogen 2.679 N/A ASN 21.A N ALA 17.A O no hydrogen 2.843 N/A ASN 21.A ND2 VAL 2.A O no hydrogen 3.198 N/A GLN 22.A N LEU 19.A O no hydrogen 2.928 N/A GLN 22.A NE2 ASP 18.A O no hydrogen 3.494 N/A GLN 22.A NE2 GLN 295.A OE1 no hydrogen 3.120 N/A THR 23.A N LEU 19.A O no hydrogen 2.932 N/A THR 23.A OG1 GLN 258.A OE1 no hydrogen 2.805 N/A GLY 25.A N THR 23.A OG1 no hydrogen 2.776 N/A ASP 26.A N SER 254.A OG no hydrogen 2.904 N/A GLN 28.A N ASP 26.A OD1 no hydrogen 2.991 N/A ILE 29.A N ASP 26.A O no hydrogen 2.922 N/A THR 30.A N ASN 160.A OD1 no hydrogen 2.838 N/A ILE 31.A N ARG 129.A O no hydrogen 2.753 N/A VAL 32.A N ILE 161.A O no hydrogen 2.904 N/A ILE 33.A N ILE 131.A O no hydrogen 2.803 N/A ILE 34.A N HIS 163.A O no hydrogen 2.825 N/A GLY 36.A N ASP 35.A OD1 no hydrogen 2.758 N/A ASP 37.A N ASN 103.A OD1 no hydrogen 2.859 N/A TYR 40.A OH ASN 132.A OD1 no hydrogen 2.663 N/A THR 41.A N ASP 39.A OD1 no hydrogen 3.007 N/A THR 41.A OG1 ASP 39.A OD1 no hydrogen 2.474 N/A THR 41.A OG1 ASP 39.A OD2 no hydrogen 3.372 N/A LEU 42.A N ASP 39.A O no hydrogen 3.396 N/A SER 43.A N GLU 230.A OE2 no hydrogen 2.865 N/A SER 43.A OG GLU 230.A OE1 no hydrogen 2.620 N/A PHE 45.A N LEU 42.A O no hydrogen 3.022 N/A GLU 46.A N SER 43.A O no hydrogen 3.082 N/A ALA 48.A N PHE 45.A O no hydrogen 3.189 N/A VAL 50.A N ALA 48.A O no hydrogen 2.979 N/A SER 51.A N VAL 130.A O no hydrogen 3.113 N/A LYS 52.A NZ ASP 37.A OD1 no hydrogen 2.526 N/A LYS 52.A NZ PRO 38.A O no hydrogen 2.871 N/A VAL 53.A N ASN 132.A O no hydrogen 2.788 N/A TRP 57.A NE1 ASN 146.A OD1 no hydrogen 3.132 N/A HIS 58.A N PRO 55.A O no hydrogen 3.108 N/A HIS 58.A NE2 ASN 146.A OD1 no hydrogen 2.900 N/A GLU 67.A N GLU 67.A OE1 no hydrogen 2.844 N/A ASP 68.A N THR 65.A OG1 no hydrogen 3.202 N/A TYR 69.A N THR 65.A O no hydrogen 3.259 N/A ALA 70.A N PRO 66.A O no hydrogen 2.826 N/A ALA 71.A N GLU 67.A O no hydrogen 2.885 N/A PHE 72.A N ASP 68.A O no hydrogen 3.151 N/A GLN 73.A N TYR 69.A O no hydrogen 3.032 N/A GLN 73.A NE2 PRO 227.A O no hydrogen 2.937 N/A SER 74.A N ALA 70.A O no hydrogen 2.857 N/A ILE 75.A N ALA 71.A O no hydrogen 3.174 N/A ARG 76.A N PHE 72.A O no hydrogen 3.078 N/A ARG 76.A NH1 ASP 104.A OD1 no hydrogen 3.501 N/A ARG 76.A NH1 ASP 104.A OD2 no hydrogen 2.801 N/A ARG 76.A NH2 ASP 104.A OD1 no hydrogen 2.924 N/A ARG 76.A NH2 GLN 226.A OE1 no hydrogen 2.886 N/A ASP 77.A N GLN 73.A O no hydrogen 2.912 N/A GLN 78.A N SER 74.A O no hydrogen 2.997 N/A GLN 78.A NE2 SER 74.A O no hydrogen 3.201 N/A GLN 78.A NE2 SER 74.A OG no hydrogen 2.926 N/A GLY 79.A N ARG 76.A O no hydrogen 2.848 N/A LYS 85.A N LYS 81.A O no hydrogen 3.315 N/A GLU 86.A N GLY 82.A O no hydrogen 3.304 N/A GLU 87.A N LYS 83.A O no hydrogen 3.003 N/A ALA 88.A N GLU 84.A O no hydrogen 3.000 N/A LEU 89.A N LYS 85.A O no hydrogen 2.989 N/A GLU 90.A N GLU 86.A O no hydrogen 3.002 N/A ALA 91.A N GLU 87.A O no hydrogen 3.001 N/A VAL 92.A N LEU 89.A O no hydrogen 3.367 N/A ILE 93.A N LEU 89.A O no hydrogen 2.841 N/A THR 96.A OG1 ASP 68.A OD2 no hydrogen 2.802 N/A LYS 97.A N ILE 93.A O no hydrogen 2.993 N/A LYS 97.A NZ GLU 90.A OE1 no hydrogen 2.684 N/A ARG 99.A NE ASP 136.A OD2 no hydrogen 3.129 N/A ARG 99.A NH1 GLU 62.A O no hydrogen 3.028 N/A ARG 99.A NH2 GLU 62.A O no hydrogen 2.765 N/A ARG 99.A NH2 ASP 136.A OD2 no hydrogen 3.167 N/A ILE 100.A N THR 96.A O no hydrogen 2.988 N/A VAL 101.A N LYS 97.A O no hydrogen 2.982 N/A LEU 102.A N ASP 98.A O no hydrogen 3.387 N/A ASN 103.A N ARG 99.A O no hydrogen 2.855 N/A ASN 103.A ND2 TYR 69.A OH no hydrogen 2.863 N/A ASN 103.A ND2 ASP 136.A OD2 no hydrogen 3.482 N/A ASP 104.A N ILE 100.A O no hydrogen 2.776 N/A HIS 105.A N VAL 101.A O no hydrogen 3.001 N/A HIS 105.A ND1 ASP 35.A OD1 no hydrogen 3.259 N/A HIS 105.A ND1 ASP 35.A OD2 no hydrogen 2.783 N/A HIS 105.A NE2 SER 239.A OG no hydrogen 2.616 N/A ALA 106.A N LEU 102.A O no hydrogen 2.968 N/A CYS 107.A N ASN 103.A O no hydrogen 3.040 N/A CYS 107.A SG ASN 103.A O no hydrogen 3.541 N/A HIS 108.A N ASP 104.A O no hydrogen 3.141 N/A HIS 108.A NE2 VAL 233.A O no hydrogen 3.077 N/A VAL 109.A N HIS 105.A O no hydrogen 2.853 N/A THR 110.A N ALA 106.A O no hydrogen 2.890 N/A THR 110.A OG1 ALA 106.A O no hydrogen 2.734 N/A SER 111.A N CYS 107.A O no hydrogen 2.943 N/A SER 111.A OG CYS 107.A O no hydrogen 3.167 N/A SER 111.A OG HIS 108.A O no hydrogen 2.725 N/A THR 112.A N HIS 108.A O no hydrogen 2.945 N/A THR 112.A OG1 HIS 108.A O no hydrogen 3.077 N/A ILE 113.A N VAL 109.A O no hydrogen 3.192 N/A ILE 113.A N THR 110.A O no hydrogen 3.203 N/A VAL 114.A N THR 110.A O no hydrogen 2.876 N/A GLY 115.A N SER 111.A O no hydrogen 2.947 N/A GLN 116.A N CYS 44.A O no hydrogen 2.890 N/A GLN 116.A NE2 VAL 114.A O no hydrogen 2.938 N/A GLN 116.A NE2 PRO 126.A O no hydrogen 2.893 N/A SER 119.A N GLN 116.A O no hydrogen 3.279 N/A SER 119.A OG GLN 116.A O no hydrogen 2.813 N/A VAL 121.A N SER 119.A OG no hydrogen 3.169 N/A GLY 123.A N GLY 115.A O no hydrogen 2.714 N/A ILE 124.A N THR 112.A O no hydrogen 2.885 N/A ALA 125.A N ILE 113.A O no hydrogen 2.713 N/A ASN 127.A N LEU 24.A O no hydrogen 2.989 N/A ASN 127.A ND2 GLY 25.A O no hydrogen 3.308 N/A CYS 128.A N ALA 125.A O no hydrogen 3.215 N/A CYS 128.A SG ASP 26.A O no hydrogen 3.813 N/A CYS 128.A SG SER 254.A OG no hydrogen 3.558 N/A ARG 129.A N ILE 29.A O no hydrogen 3.014 N/A ARG 129.A NH1 THR 30.A OG1 no hydrogen 3.176 N/A VAL 130.A N GLU 49.A O no hydrogen 2.910 N/A ILE 131.A N ILE 31.A O no hydrogen 2.836 N/A ASN 132.A N SER 51.A O no hydrogen 2.809 N/A ASN 132.A ND2 THR 110.A OG1 no hydrogen 2.898 N/A MET 133.A N ILE 33.A O no hydrogen 2.906 N/A GLN 135.A N ASP 35.A O no hydrogen 2.796 N/A GLN 135.A NE2 MET 133.A O no hydrogen 3.000 N/A VAL 138.A N GLN 135.A O no hydrogen 3.067 N/A ILE 139.A N ASP 136.A O no hydrogen 3.020 N/A ARG 140.A NE ALA 137.A O no hydrogen 3.097 N/A ARG 140.A NH2 ALA 137.A O no hydrogen 2.609 N/A LEU 147.A N SER 143.A O no hydrogen 3.101 N/A ALA 148.A N PRO 144.A O no hydrogen 2.875 N/A ARG 149.A N LEU 145.A O no hydrogen 2.976 N/A ALA 150.A N ASN 146.A O no hydrogen 2.996 N/A ILE 151.A N LEU 147.A O no hydrogen 2.800 N/A ASP 152.A N ALA 148.A O no hydrogen 2.964 N/A LEU 153.A N ARG 149.A O no hydrogen 3.044 N/A ALA 154.A N ALA 150.A O no hydrogen 2.904 N/A LEU 155.A N ILE 151.A O no hydrogen 2.974 N/A GLU 156.A N ASP 152.A O no hydrogen 3.171 N/A LEU 157.A N LEU 153.A O no hydrogen 2.810 N/A GLY 158.A N LEU 155.A O no hydrogen 3.099 N/A ALA 159.A N ALA 154.A O no hydrogen 3.189 N/A ASN 160.A N THR 30.A O no hydrogen 2.840 N/A ILE 161.A N THR 30.A O no hydrogen 3.155 N/A ILE 162.A N LEU 184.A O no hydrogen 2.802 N/A HIS 163.A N VAL 32.A O no hydrogen 2.806 N/A HIS 163.A ND1 THR 246.A OG1 no hydrogen 2.756 N/A CYS 164.A N VAL 186.A O no hydrogen 2.945 N/A ALA 165.A N ILE 34.A O no hydrogen 3.312 N/A VAL 172.A N GLU 168.A O no hydrogen 3.193 N/A GLN 173.A N GLU 169.A O no hydrogen 2.893 N/A ALA 174.A N ILE 170.A O no hydrogen 3.169 N/A ILE 175.A N LEU 171.A O no hydrogen 2.979 N/A LYS 176.A N VAL 172.A O no hydrogen 3.037 N/A LYS 176.A NZ GLN 179.A OE1 no hydrogen 3.182 N/A LYS 177.A N GLN 173.A O no hydrogen 2.874 N/A CYS 178.A N ALA 174.A O no hydrogen 3.160 N/A CYS 178.A SG ALA 174.A O no hydrogen 3.471 N/A GLN 179.A N ILE 175.A O no hydrogen 3.183 N/A ASP 180.A N LYS 176.A O no hydrogen 2.917 N/A ASN 181.A N LYS 177.A O no hydrogen 2.987 N/A ASN 181.A N CYS 178.A O no hydrogen 3.131 N/A ASN 182.A N GLN 179.A O no hydrogen 3.263 N/A ASN 182.A ND2 VAL 263.A O no hydrogen 2.900 N/A VAL 183.A N CYS 178.A O no hydrogen 2.807 N/A LEU 184.A N ASN 160.A O no hydrogen 3.089 N/A VAL 186.A N ILE 162.A O no hydrogen 2.959 N/A SER 187.A N LEU 197.A O no hydrogen 3.105 N/A THR 189.A N VAL 199.A O no hydrogen 2.906 N/A THR 196.A N LEU 193.A O no hydrogen 3.384 N/A LEU 197.A N ILE 185.A O no hydrogen 2.734 N/A ALA 198.A N GLU 213.A O no hydrogen 3.299 N/A VAL 199.A N SER 187.A O no hydrogen 2.903 N/A GLY 200.A N ILE 215.A O no hydrogen 2.919 N/A ALA 202.A N ALA 217.A O no hydrogen 2.703 N/A LYS 203.A N THR 207.A O no hydrogen 2.636 N/A LYS 203.A NZ GLU 220.A OE1 no hydrogen 3.379 N/A VAL 204.A N GLU 220.A OE1 no hydrogen 3.058 N/A GLY 206.A N LYS 203.A O no hydrogen 2.877 N/A THR 207.A N ASP 205.A OD1 no hydrogen 3.118 N/A THR 207.A OG1 ASP 205.A OD1 no hydrogen 2.828 N/A CYS 209.A N ALA 201.A O no hydrogen 3.042 N/A CYS 209.A SG ALA 201.A O no hydrogen 3.623 N/A ILE 215.A N ALA 198.A O no hydrogen 2.989 N/A LEU 216.A N GLY 281.A O no hydrogen 2.844 N/A ALA 217.A N GLY 200.A O no hydrogen 3.064 N/A GLY 219.A N ALA 202.A O no hydrogen 2.894 N/A GLU 221.A N THR 236.A OG1 no hydrogen 3.121 N/A ILE 222.A N LEU 235.A O no hydrogen 2.934 N/A GLY 224.A N VAL 233.A O no hydrogen 2.895 N/A ALA 225.A N SER 111.A OG no hydrogen 2.798 N/A GLN 226.A NE2 GLU 231.A O no hydrogen 2.915 N/A CYS 228.A N ASP 39.A OD2 no hydrogen 2.858 N/A GLU 231.A N THR 229.A OG1 no hydrogen 3.089 N/A VAL 233.A N GLY 224.A O no hydrogen 2.838 N/A ARG 234.A NH1 ASP 8.A OD2 no hydrogen 2.956 N/A ARG 234.A NH1 GLU 221.A O no hydrogen 2.926 N/A ARG 234.A NH2 ASP 8.A OD1 no hydrogen 2.839 N/A LEU 235.A N ILE 222.A O no hydrogen 3.031 N/A GLY 237.A N GLY 219.A O no hydrogen 2.818 N/A THR 238.A N ASN 191.A OD1 no hydrogen 2.913 N/A THR 238.A OG1 ASN 191.A OD1 no hydrogen 2.823 N/A SER 239.A OG HIS 105.A NE2 no hydrogen 2.616 N/A MET 240.A N GLY 237.A O no hydrogen 2.926 N/A ALA 241.A N THR 238.A O no hydrogen 3.182 N/A ALA 242.A N THR 238.A O no hydrogen 3.265 N/A MET 245.A N ALA 241.A O no hydrogen 3.351 N/A THR 246.A N ALA 242.A O no hydrogen 2.982 N/A THR 246.A OG1 HIS 163.A ND1 no hydrogen 2.756 N/A THR 246.A OG1 ALA 242.A O no hydrogen 3.463 N/A GLY 247.A N PRO 243.A O no hydrogen 2.990 N/A ILE 248.A N VAL 244.A O no hydrogen 3.000 N/A SER 249.A N MET 245.A O no hydrogen 2.888 N/A SER 249.A OG MET 245.A O no hydrogen 2.735 N/A ALA 250.A N THR 246.A O no hydrogen 2.898 N/A LEU 251.A N GLY 247.A O no hydrogen 2.924 N/A LEU 252.A N ILE 248.A O no hydrogen 3.010 N/A MET 253.A N SER 249.A O no hydrogen 2.996 N/A SER 254.A N ALA 250.A O no hydrogen 2.852 N/A SER 254.A OG ALA 250.A O no hydrogen 2.702 N/A LEU 255.A N LEU 251.A O no hydrogen 2.851 N/A GLN 256.A N LEU 252.A O no hydrogen 3.104 N/A GLN 256.A NE2 ASP 264.A O no hydrogen 3.600 N/A VAL 257.A N MET 253.A O no hydrogen 3.094 N/A GLN 258.A N SER 254.A O no hydrogen 2.872 N/A GLN 258.A NE2 GLN 22.A O no hydrogen 3.194 N/A GLN 259.A N LEU 255.A O no hydrogen 2.962 N/A GLY 260.A N VAL 257.A O no hydrogen 2.948 N/A LYS 261.A N GLN 256.A O no hydrogen 2.733 N/A LYS 261.A NZ GLN 259.A OE1 no hydrogen 3.484 N/A LYS 261.A NZ LEU 292.A O no hydrogen 3.087 N/A ASP 264.A N GLN 256.A OE1 no hydrogen 3.039 N/A ALA 265.A N ASN 182.A OD1 no hydrogen 3.229 N/A ALA 267.A N ASP 264.A OD1 no hydrogen 3.127 N/A VAL 268.A N ASP 264.A O no hydrogen 3.043 N/A ARG 269.A N ALA 265.A O no hydrogen 2.880 N/A ARG 269.A NE GLU 266.A OE1 no hydrogen 3.208 N/A ARG 269.A NH2 GLU 266.A OE2 no hydrogen 2.885 N/A THR 270.A N GLU 266.A O no hydrogen 2.947 N/A THR 270.A OG1 GLU 266.A O no hydrogen 2.785 N/A THR 270.A OG1 ALA 267.A O no hydrogen 3.138 N/A ALA 271.A N ALA 267.A O no hydrogen 2.906 N/A LEU 272.A N VAL 268.A O no hydrogen 3.090 N/A LEU 273.A N ARG 269.A O no hydrogen 3.082 N/A LYS 274.A N THR 270.A O no hydrogen 2.827 N/A THR 275.A N ALA 271.A O no hydrogen 3.224 N/A THR 275.A OG1 ALA 271.A O no hydrogen 2.809 N/A THR 275.A OG1 ASN 284.A O no hydrogen 3.496 N/A ILE 277.A N PHE 282.A O no hydrogen 2.967 N/A ARG 280.A N GLY 214.A O no hydrogen 2.869 N/A ARG 280.A NH1 LYS 212.A O no hydrogen 2.731 N/A PHE 282.A N ILE 277.A O no hydrogen 2.787 N/A VAL 283.A N LEU 216.A O no hydrogen 2.863 N/A ASN 284.A ND2 THR 275.A O no hydrogen 2.804 N/A GLY 287.A N ASN 284.A OD1 no hydrogen 3.190 N/A ALA 288.A N ASN 284.A O no hydrogen 2.986 N/A MET 289.A N ILE 285.A O no hydrogen 2.834 N/A LYS 290.A N PRO 286.A O no hydrogen 3.165 N/A VAL 291.A N GLY 287.A O no hydrogen 3.066 N/A LEU 292.A N ALA 288.A O no hydrogen 2.921 N/A PHE 293.A N MET 289.A O no hydrogen 2.824 N/A GLY 294.A N LYS 290.A O no hydrogen 2.942 N/A GLN 295.A N MET 289.A O no hydrogen 3.491 N/A GLN 295.A NE2 GLN 22.A OE1 no hydrogen 2.743 N/A