Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dab_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N TYR 79.A OH no hydrogen 3.520 N/A SER 1.A OG ILE 4.A O no hydrogen 3.314 N/A SER 1.A OG GLU 74.A OE1 no hydrogen 2.963 N/A HIS 3.A N GLU 74.A OE1 no hydrogen 2.804 N/A HIS 3.A ND1 GLU 74.A OE2 no hydrogen 2.502 N/A ILE 4.A N SER 1.A OG no hydrogen 3.255 N/A GLY 5.A N ASN 39.A OD1 no hydrogen 2.760 N/A GLU 7.A N GLN 10.A OE1 no hydrogen 2.848 N/A GLN 10.A N GLU 7.A O no hydrogen 3.033 N/A ALA 12.A N SER 57.A OG no hydrogen 2.678 N/A VAL 15.A N ASN 83.A O no hydrogen 2.874 N/A LEU 16.A N SER 57.A O no hydrogen 2.798 N/A LEU 17.A N ILE 85.A O no hydrogen 2.576 N/A LEU 22.A N ASP 20.A OD1 no hydrogen 2.781 N/A ARG 23.A N.B ASP 20.A O no hydrogen 2.918 N/A ALA 24.A N ASP 20.A O no hydrogen 3.070 N/A LYS 25.A N PRO 21.A O no hydrogen 3.135 N/A LYS 25.A NZ GLU 29.A OE1.A no hydrogen 3.184 N/A PHE 26.A N LEU 22.A O no hydrogen 3.032 N/A ILE 27.A N ARG 23.A O.A no hydrogen 2.908 N/A ILE 27.A N ARG 23.A O.B no hydrogen 2.837 N/A ALA 28.A N ALA 24.A O no hydrogen 3.027 N/A GLU 29.A N LYS 25.A O no hydrogen 3.013 N/A THR 30.A N PHE 26.A O no hydrogen 2.940 N/A THR 30.A OG1 PHE 26.A O no hydrogen 2.711 N/A TYR 31.A N ILE 27.A O no hydrogen 2.873 N/A TYR 31.A OH HIS 220.A ND1 no hydrogen 2.694 N/A LEU 32.A N ALA 28.A O no hydrogen 3.058 N/A GLU 33.A N THR 50.A O no hydrogen 2.844 N/A GLU 36.A N THR 48.A O no hydrogen 2.871 N/A CYS 37.A SG ASN 39.A O no hydrogen 3.282 N/A CYS 37.A SG GLY 46.A O no hydrogen 3.618 N/A TYR 38.A N GLY 46.A O no hydrogen 2.901 N/A TYR 38.A OH GLN 59.A OE1 no hydrogen 2.742 N/A ASN 39.A ND2 VAL 41.A O no hydrogen 3.612 N/A ASN 39.A ND2 MET 44.A O no hydrogen 2.761 N/A VAL 41.A N ASN 39.A OD1 no hydrogen 3.163 N/A GLY 43.A N GLU 40.A O no hydrogen 2.804 N/A MET 44.A N VAL 41.A O no hydrogen 3.003 N/A GLY 46.A N ASN 39.A O no hydrogen 3.328 N/A PHE 47.A N VAL 58.A O no hydrogen 2.876 N/A THR 48.A N GLU 36.A O no hydrogen 2.882 N/A THR 48.A OG1 GLN 10.A O no hydrogen 2.770 N/A THR 48.A OG1 SER 57.A OG no hydrogen 2.632 N/A GLY 49.A N ILE 56.A O no hydrogen 3.069 N/A THR 50.A N GLU 33.A O no hydrogen 2.844 N/A THR 50.A OG1 GLU 33.A O no hydrogen 3.502 N/A TYR 51.A N LYS 54.A O no hydrogen 2.769 N/A LYS 54.A N TYR 51.A O no hydrogen 3.028 N/A LYS 54.A NZ VAL 230.A O.A no hydrogen 3.203 N/A ILE 56.A N GLY 49.A O no hydrogen 2.879 N/A SER 57.A N THR 14.A O no hydrogen 2.991 N/A SER 57.A OG THR 48.A OG1 no hydrogen 2.632 N/A VAL 58.A N PHE 47.A O no hydrogen 2.839 N/A GLN 59.A N LEU 16.A O no hydrogen 2.910 N/A GLN 59.A NE2 MET 44.A O no hydrogen 3.066 N/A GLN 59.A NE2 GLY 60.A O no hydrogen 2.933 N/A GLY 60.A N TYR 45.A O no hydrogen 3.060 N/A THR 61.A N PRO 18.A O no hydrogen 2.999 N/A THR 61.A OG1 PRO 18.A O no hydrogen 3.548 N/A THR 61.A OG1 GLY 62.A O no hydrogen 2.815 N/A GLY 62.A N GLY 19.A O no hydrogen 2.852 N/A GLY 64.A N GLU 179.A OE1 no hydrogen 3.075 N/A SER 67.A N GLY 64.A O no hydrogen 3.140 N/A SER 67.A OG THR 61.A O no hydrogen 2.651 N/A ILE 68.A N GLY 64.A O no hydrogen 3.118 N/A SER 69.A N VAL 65.A O no hydrogen 2.854 N/A SER 69.A OG VAL 65.A O no hydrogen 2.618 N/A ILE 70.A N PRO 66.A O no hydrogen 3.296 N/A TYR 71.A N SER 67.A O no hydrogen 3.486 N/A VAL 72.A N ILE 68.A O no hydrogen 2.830 N/A ASN 73.A N SER 69.A O no hydrogen 2.983 N/A ASN 73.A ND2 SER 69.A O no hydrogen 3.049 N/A GLU 74.A N ILE 70.A O no hydrogen 3.102 N/A LEU 75.A N TYR 71.A O no hydrogen 2.886 N/A ILE 76.A N VAL 72.A O no hydrogen 3.001 N/A GLN 77.A N ASN 73.A O no hydrogen 2.977 N/A SER 78.A N GLU 74.A O no hydrogen 2.798 N/A TYR 79.A N LEU 75.A O no hydrogen 3.161 N/A TYR 79.A OH ILE 4.A O no hydrogen 3.099 N/A TYR 79.A OH ALA 6.A O no hydrogen 3.033 N/A ASP 80.A N ILE 76.A O no hydrogen 3.149 N/A VAL 81.A N LEU 75.A O no hydrogen 3.268 N/A GLN 82.A N ASP 13.A O no hydrogen 2.801 N/A GLN 82.A NE2 ASP 80.A O no hydrogen 2.884 N/A ASN 83.A N ASP 13.A O no hydrogen 2.911 N/A ASN 83.A ND2 THR 14.A OG1 no hydrogen 3.037 N/A LEU 84.A N LYS 193.A O no hydrogen 2.801 N/A ILE 85.A N VAL 15.A O no hydrogen 2.872 N/A ARG 86.A N LEU 195.A O no hydrogen 2.933 N/A ARG 86.A NE GLU 177.A OE1 no hydrogen 2.779 N/A VAL 87.A N LEU 17.A O no hydrogen 3.295 N/A GLY 88.A N ILE 197.A O no hydrogen 3.061 N/A CYS 90.A N THR 199.A O no hydrogen 2.859 N/A CYS 90.A SG THR 199.A O no hydrogen 3.572 N/A GLY 91.A N VAL 176.A O no hydrogen 2.946 N/A ALA 92.A N ASP 202.A O no hydrogen 2.764 N/A ILE 93.A N LEU 174.A O no hydrogen 2.984 N/A ARG 94.A NE ASP 96.A OD2 no hydrogen 2.883 N/A ARG 94.A NH1 ALA 169.A O no hydrogen 2.773 N/A ARG 94.A NH2 ASP 96.A OD1 no hydrogen 2.897 N/A VAL 97.A N ARG 94.A O no hydrogen 3.228 N/A LYS 98.A N ASP 101.A OD1 no hydrogen 2.809 N/A LYS 98.A NZ LYS 95.A O no hydrogen 3.314 N/A ASP 101.A N LYS 98.A O no hydrogen 3.013 N/A VAL 102.A N PRO 146.A O no hydrogen 2.962 N/A ILE 103.A N LEU 198.A O no hydrogen 2.773 N/A LEU 104.A N THR 148.A O no hydrogen 2.936 N/A ALA 105.A N SER 196.A O no hydrogen 3.171 N/A MET 106.A N GLY 150.A O no hydrogen 2.824 N/A THR 107.A OG1 PRO 126.A O no hydrogen 2.549 N/A SER 108.A OG THR 181.A OG1 no hydrogen 2.658 N/A SER 109.A N VAL 152.A O no hydrogen 2.952 N/A THR 110.A OG1 THR 154.A O no hydrogen 2.897 N/A ASP 111.A N THR 154.A O no hydrogen 3.428 N/A SER 112.A N THR 110.A OG1 no hydrogen 2.924 N/A MET 114.A N SER 112.A OG no hydrogen 3.095 N/A ASN 115.A ND2 THR 185.A OG1 no hydrogen 3.308 N/A VAL 117.A N GLN 113.A O no hydrogen 2.876 N/A PHE 119.A N ASN 115.A O no hydrogen 2.646 N/A GLY 120.A N ARG 116.A O no hydrogen 2.767 N/A VAL 122.A N PHE 119.A O no hydrogen 3.228 N/A CYS 127.A SG ALA 128.A O no hydrogen 3.544 N/A ALA 128.A N MET 106.A O no hydrogen 2.963 N/A ASP 129.A N ALA 194.A O no hydrogen 2.829 N/A LEU 132.A N ASP 129.A OD2 no hydrogen 2.997 N/A LEU 133.A N ASP 129.A O no hydrogen 3.030 N/A LYS 134.A N PHE 130.A O no hydrogen 2.827 N/A ASN 135.A N GLU 131.A O no hydrogen 3.036 N/A ASN 135.A ND2 SER 229.A O.B no hydrogen 2.940 N/A ALA 136.A N LEU 132.A O no hydrogen 3.062 N/A TYR 137.A N LEU 133.A O no hydrogen 2.810 N/A ASP 138.A N LYS 134.A O no hydrogen 2.791 N/A ALA 139.A N ASN 135.A O no hydrogen 2.924 N/A ALA 140.A N ALA 136.A O no hydrogen 3.019 N/A LYS 141.A N TYR 137.A O no hydrogen 2.949 N/A LYS 141.A NZ TYR 137.A OH no hydrogen 3.225 N/A ASP 142.A N ASP 138.A O no hydrogen 2.780 N/A LYS 143.A N ALA 140.A O no hydrogen 3.174 N/A LYS 143.A NZ.B HIS 228.A NE2.A no hydrogen 2.864 N/A GLY 144.A N ALA 140.A O no hydrogen 2.870 N/A GLY 144.A N LYS 141.A O no hydrogen 3.289 N/A VAL 145.A N ALA 140.A O no hydrogen 2.936 N/A THR 148.A N VAL 102.A O no hydrogen 2.927 N/A GLY 150.A N LEU 104.A O no hydrogen 3.257 N/A VAL 152.A N THR 107.A O no hydrogen 3.202 N/A PHE 153.A N GLY 175.A O no hydrogen 2.838 N/A THR 154.A N SER 109.A O no hydrogen 2.788 N/A THR 154.A OG1 GLU 177.A OE2 no hydrogen 2.891 N/A THR 154.A OG1 THR 181.A OG1 no hydrogen 3.286 N/A ALA 155.A N GLU 177.A O no hydrogen 2.684 N/A ASP 156.A N ASP 111.A OD2 no hydrogen 2.765 N/A ASP 162.A N ASN 160.A OD1 no hydrogen 2.799 N/A SER 163.A N ASN 160.A O no hydrogen 3.415 N/A ILE 165.A N SER 163.A OG no hydrogen 3.356 N/A LEU 168.A N GLN 164.A O no hydrogen 2.868 N/A ALA 169.A N ILE 165.A O no hydrogen 2.850 N/A LYS 170.A N GLU 166.A O no hydrogen 3.272 N/A LYS 170.A NZ GLU 166.A OE1.A no hydrogen 3.549 N/A TYR 171.A N LYS 167.A O no hydrogen 3.104 N/A TYR 171.A N LEU 168.A O no hydrogen 3.068 N/A GLY 172.A N ALA 169.A O no hydrogen 2.934 N/A VAL 173.A N LEU 168.A O no hydrogen 3.094 N/A LEU 174.A N SER 151.A O no hydrogen 2.895 N/A VAL 176.A N GLY 91.A O no hydrogen 2.839 N/A GLU 177.A N PHE 153.A O no hydrogen 2.889 N/A GLU 179.A N GLU 177.A OE2 no hydrogen 3.210 N/A THR 180.A N GLU 177.A OE1 no hydrogen 3.193 N/A THR 180.A N GLU 177.A OE2 no hydrogen 2.927 N/A THR 180.A OG1 GLU 177.A OE1 no hydrogen 2.696 N/A THR 180.A OG1 SER 196.A OG no hydrogen 2.747 N/A THR 181.A N THR 154.A OG1 no hydrogen 2.946 N/A THR 181.A OG1 SER 108.A OG no hydrogen 2.658 N/A THR 181.A OG1 SER 109.A O no hydrogen 3.366 N/A THR 181.A OG1 THR 154.A OG1 no hydrogen 3.286 N/A LEU 183.A N GLU 179.A O no hydrogen 3.263 N/A TYR 184.A N THR 180.A O no hydrogen 2.853 N/A TYR 184.A OH ALA 105.A O no hydrogen 2.608 N/A THR 185.A N THR 181.A O no hydrogen 2.930 N/A THR 185.A OG1 THR 181.A O no hydrogen 2.759 N/A LEU 186.A N ALA 182.A O no hydrogen 2.949 N/A ALA 187.A N LEU 183.A O no hydrogen 3.030 N/A ALA 188.A N TYR 184.A O no hydrogen 3.214 N/A LYS 189.A N THR 185.A O no hydrogen 3.006 N/A HIS 190.A N LEU 186.A O no hydrogen 3.292 N/A HIS 190.A N ALA 187.A O no hydrogen 3.148 N/A GLY 191.A N ALA 188.A O no hydrogen 3.125 N/A ARG 192.A N ALA 187.A O no hydrogen 2.904 N/A ARG 192.A NE HIS 190.A O no hydrogen 3.115 N/A ARG 192.A NH1 ILE 76.A O no hydrogen 3.268 N/A ARG 192.A NH1 VAL 81.A O no hydrogen 2.878 N/A LYS 193.A N GLN 82.A O no hydrogen 2.990 N/A LYS 193.A NZ GLU 131.A OE1 no hydrogen 2.741 N/A LEU 195.A N LEU 84.A O no hydrogen 3.094 N/A SER 196.A N TYR 184.A OH no hydrogen 2.643 N/A SER 196.A OG THR 180.A OG1 no hydrogen 2.747 N/A ILE 197.A N ARG 86.A O no hydrogen 2.917 N/A LEU 198.A N ILE 103.A O no hydrogen 2.833 N/A THR 199.A N GLY 88.A O no hydrogen 2.915 N/A SER 201.A N CYS 90.A O no hydrogen 2.922 N/A SER 201.A OG CYS 90.A O no hydrogen 3.288 N/A HIS 203.A N GLU 208.A O no hydrogen 3.051 N/A HIS 203.A NE2 VAL 97.A O no hydrogen 2.704 N/A VAL 204.A N ALA 92.A O no hydrogen 3.095 N/A THR 206.A OG1 GLU 208.A OE2 no hydrogen 3.390 N/A GLU 208.A N THR 206.A OG1 no hydrogen 3.331 N/A THR 210.A N SER 201.A O no hydrogen 3.245 N/A THR 210.A OG1 SER 201.A O no hydrogen 2.724 N/A THR 211.A N GLU 214.A OE1 no hydrogen 3.207 N/A GLU 214.A N THR 211.A OG1 no hydrogen 3.012 N/A ARG 215.A N THR 211.A O no hydrogen 3.000 N/A ARG 215.A NH1 GLU 209.A OE2 no hydrogen 2.585 N/A GLN 216.A N ALA 212.A O no hydrogen 2.984 N/A THR 217.A N GLU 213.A O no hydrogen 3.034 N/A THR 217.A OG1 GLU 213.A O no hydrogen 3.018 N/A THR 218.A N GLU 214.A O no hydrogen 2.934 N/A THR 218.A OG1 GLU 214.A O no hydrogen 3.148 N/A THR 218.A OG1 ARG 215.A O no hydrogen 3.319 N/A PHE 219.A N ARG 215.A O no hydrogen 2.928 N/A HIS 220.A N GLN 216.A O no hydrogen 3.130 N/A HIS 220.A ND1 TYR 31.A OH no hydrogen 2.694 N/A ASP 221.A N THR 217.A O no hydrogen 3.085 N/A MET 222.A N THR 218.A O no hydrogen 2.864 N/A ILE 223.A N PHE 219.A O no hydrogen 2.991 N/A ASP 224.A N HIS 220.A O no hydrogen 2.856 N/A VAL 225.A N ASP 221.A O no hydrogen 2.883 N/A ALA 226.A N MET 222.A O no hydrogen 2.813 N/A LEU 227.A N ILE 223.A O no hydrogen 2.814 N/A HIS 228.A N.A ASP 224.A O no hydrogen 2.807 N/A HIS 228.A N.B VAL 225.A O no hydrogen 2.963 N/A SER 229.A N.A VAL 225.A O no hydrogen 2.966 N/A SER 229.A N.B ALA 226.A O no hydrogen 2.874 N/A SER 229.A OG.A VAL 225.A O no hydrogen 2.845 N/A SER 229.A OG.A ALA 226.A O no hydrogen 2.510 N/A SER 229.A OG.B LEU 132.A O no hydrogen 2.830 N/A VAL 230.A N.A LEU 227.A O no hydrogen 3.250 N/A SER 231.A N.A HIS 228.A O.A no hydrogen 3.047 N/A