Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4d98_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ILE 4.A O no hydrogen 2.889 N/A SER 1.A OG TYR 79.A OH no hydrogen 2.527 N/A HIS 3.A N GLU 74.A OE1 no hydrogen 2.971 N/A HIS 3.A N GLU 74.A OE2 no hydrogen 3.370 N/A HIS 3.A ND1 GLU 74.A OE2 no hydrogen 2.805 N/A GLY 5.A N ASN 39.A OD1 no hydrogen 2.785 N/A GLU 7.A N GLN 10.A OE1 no hydrogen 2.855 N/A GLN 10.A N GLU 7.A O no hydrogen 3.081 N/A ALA 12.A N SER 57.A OG no hydrogen 2.844 N/A THR 14.A OG1 ASP 13.A OD1.B no hydrogen 3.114 N/A VAL 15.A N ASN 83.A O no hydrogen 2.902 N/A LEU 16.A N SER 57.A O no hydrogen 2.819 N/A LEU 17.A N ILE 85.A O no hydrogen 2.759 N/A LEU 22.A N ASP 20.A OD1 no hydrogen 2.874 N/A ALA 24.A N ASP 20.A O no hydrogen 3.004 N/A LYS 25.A N PRO 21.A O no hydrogen 3.098 N/A LYS 25.A NZ GLU 29.A OE1 no hydrogen 3.424 N/A PHE 26.A N LEU 22.A O no hydrogen 2.995 N/A ILE 27.A N ARG 23.A O no hydrogen 2.798 N/A ALA 28.A N ALA 24.A O no hydrogen 2.977 N/A GLU 29.A N LYS 25.A O no hydrogen 2.921 N/A THR 30.A N PHE 26.A O no hydrogen 2.994 N/A THR 30.A OG1 PHE 26.A O no hydrogen 2.720 N/A TYR 31.A N ILE 27.A O no hydrogen 2.952 N/A TYR 31.A OH HIS 220.A ND1 no hydrogen 2.761 N/A LEU 32.A N ALA 28.A O no hydrogen 2.991 N/A GLU 33.A N THR 50.A O no hydrogen 2.872 N/A GLU 36.A N THR 48.A O no hydrogen 2.875 N/A CYS 37.A SG ASN 39.A O no hydrogen 3.306 N/A CYS 37.A SG GLY 46.A O no hydrogen 3.599 N/A TYR 38.A N GLY 46.A O no hydrogen 2.976 N/A TYR 38.A OH GLN 59.A OE1 no hydrogen 2.747 N/A ASN 39.A ND2 HIS 3.A O no hydrogen 3.656 N/A ASN 39.A ND2 VAL 41.A O no hydrogen 3.527 N/A ASN 39.A ND2 MET 44.A O no hydrogen 2.769 N/A VAL 41.A N ASN 39.A OD1 no hydrogen 3.040 N/A GLY 43.A N GLU 40.A O no hydrogen 2.822 N/A MET 44.A N VAL 41.A O no hydrogen 3.012 N/A GLY 46.A N ASN 39.A O no hydrogen 3.305 N/A PHE 47.A N VAL 58.A O no hydrogen 2.842 N/A THR 48.A N GLU 36.A O no hydrogen 2.875 N/A THR 48.A OG1 GLN 10.A O no hydrogen 2.650 N/A THR 48.A OG1 SER 57.A OG no hydrogen 2.668 N/A GLY 49.A N ILE 56.A O no hydrogen 3.013 N/A THR 50.A N GLU 33.A O no hydrogen 2.853 N/A TYR 51.A N LYS 54.A O no hydrogen 2.800 N/A LYS 54.A N TYR 51.A O no hydrogen 2.995 N/A ILE 56.A N GLY 49.A O no hydrogen 2.844 N/A SER 57.A N THR 14.A O no hydrogen 2.973 N/A SER 57.A OG THR 48.A OG1 no hydrogen 2.668 N/A VAL 58.A N PHE 47.A O no hydrogen 2.843 N/A GLN 59.A N LEU 16.A O no hydrogen 2.946 N/A GLN 59.A NE2 MET 44.A O no hydrogen 3.054 N/A GLN 59.A NE2 GLY 60.A O no hydrogen 2.867 N/A GLY 60.A N TYR 45.A O no hydrogen 3.008 N/A THR 61.A N PRO 18.A O no hydrogen 2.901 N/A THR 61.A OG1 PRO 18.A O no hydrogen 3.486 N/A THR 61.A OG1 GLY 62.A O no hydrogen 2.850 N/A GLY 62.A N GLY 19.A O no hydrogen 2.884 N/A GLY 64.A N GLU 179.A OE2 no hydrogen 3.079 N/A SER 67.A OG THR 61.A O no hydrogen 2.592 N/A ILE 68.A N GLY 64.A O no hydrogen 3.031 N/A SER 69.A N VAL 65.A O no hydrogen 2.906 N/A SER 69.A OG VAL 65.A O no hydrogen 2.674 N/A ILE 70.A N PRO 66.A O no hydrogen 3.265 N/A TYR 71.A N SER 67.A O no hydrogen 3.398 N/A VAL 72.A N ILE 68.A O no hydrogen 2.826 N/A ASN 73.A N SER 69.A O no hydrogen 2.908 N/A ASN 73.A ND2 GLN 77.A OE1 no hydrogen 3.205 N/A GLU 74.A N ILE 70.A O no hydrogen 3.045 N/A LEU 75.A N TYR 71.A O no hydrogen 2.827 N/A ILE 76.A N VAL 72.A O no hydrogen 2.862 N/A GLN 77.A N ASN 73.A O no hydrogen 2.816 N/A SER 78.A N GLU 74.A O no hydrogen 2.881 N/A TYR 79.A N LEU 75.A O no hydrogen 3.305 N/A TYR 79.A OH SER 1.A OG no hydrogen 2.527 N/A TYR 79.A OH ILE 4.A O no hydrogen 3.417 N/A TYR 79.A OH ALA 6.A O no hydrogen 2.901 N/A VAL 81.A N LEU 75.A O no hydrogen 3.147 N/A GLN 82.A N ASP 13.A O no hydrogen 2.841 N/A GLN 82.A NE2 ASP 80.A O no hydrogen 2.937 N/A ASN 83.A N ASP 13.A O no hydrogen 2.978 N/A ASN 83.A ND2 THR 14.A OG1 no hydrogen 3.065 N/A LEU 84.A N LYS 193.A O no hydrogen 2.865 N/A ILE 85.A N VAL 15.A O no hydrogen 2.905 N/A ARG 86.A N LEU 195.A O no hydrogen 2.856 N/A ARG 86.A NE GLU 177.A OE1 no hydrogen 2.966 N/A VAL 87.A N LEU 17.A O no hydrogen 3.291 N/A GLY 88.A N ILE 197.A O no hydrogen 3.131 N/A SER 89.A OG THR 199.A OG1 no hydrogen 2.843 N/A CYS 90.A N THR 199.A O no hydrogen 2.747 N/A CYS 90.A SG THR 199.A O no hydrogen 3.768 N/A GLY 91.A N VAL 176.A O no hydrogen 2.907 N/A ALA 92.A N ASP 202.A O no hydrogen 2.950 N/A ILE 93.A N LEU 174.A O no hydrogen 2.926 N/A ARG 94.A NE.A ASP 96.A OD2 no hydrogen 2.795 N/A ARG 94.A NE.B ASP 96.A OD2 no hydrogen 3.213 N/A ARG 94.A NH1.A GLY 172.A O no hydrogen 2.725 N/A ARG 94.A NH1.B ALA 169.A O no hydrogen 2.781 N/A ARG 94.A NH2.A ASP 96.A OD1 no hydrogen 2.732 N/A ARG 94.A NH2.A ASP 96.A OD2 no hydrogen 3.321 N/A ARG 94.A NH2.B ASP 96.A OD1 no hydrogen 3.254 N/A VAL 97.A N ARG 94.A O no hydrogen 2.979 N/A LYS 98.A N ASP 101.A OD2 no hydrogen 2.771 N/A LYS 98.A NZ LYS 95.A O no hydrogen 3.375 N/A ASP 101.A N LYS 98.A O no hydrogen 3.078 N/A VAL 102.A N PRO 146.A O no hydrogen 3.218 N/A ILE 103.A N LEU 198.A O no hydrogen 2.828 N/A LEU 104.A N THR 148.A O no hydrogen 2.933 N/A ALA 105.A N SER 196.A O no hydrogen 3.112 N/A MET 106.A N GLY 150.A O no hydrogen 2.716 N/A THR 107.A OG1 PRO 126.A O no hydrogen 2.465 N/A SER 108.A OG THR 181.A OG1 no hydrogen 2.880 N/A SER 109.A N VAL 152.A O no hydrogen 2.928 N/A THR 110.A OG1 THR 154.A O no hydrogen 2.719 N/A SER 112.A N THR 110.A OG1 no hydrogen 2.891 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 3.185 N/A VAL 117.A N GLN 113.A O no hydrogen 2.923 N/A PHE 119.A N ASN 115.A O no hydrogen 2.745 N/A GLY 120.A N ARG 116.A O no hydrogen 2.698 N/A VAL 122.A N PHE 119.A O no hydrogen 3.177 N/A CYS 127.A SG ALA 128.A O no hydrogen 3.556 N/A ALA 128.A N MET 106.A O no hydrogen 2.999 N/A ASP 129.A N ALA 194.A O no hydrogen 2.925 N/A LEU 132.A N ASP 129.A OD2 no hydrogen 3.020 N/A LEU 133.A N ASP 129.A O no hydrogen 2.965 N/A LYS 134.A N PHE 130.A O no hydrogen 2.778 N/A LYS 134.A NZ.A ASP 138.A OD1 no hydrogen 3.017 N/A LYS 134.A NZ.A ASP 138.A OD2 no hydrogen 2.727 N/A ASN 135.A N GLU 131.A O no hydrogen 3.004 N/A ASN 135.A ND2 SER 229.A O no hydrogen 2.977 N/A ALA 136.A N LEU 132.A O no hydrogen 2.894 N/A TYR 137.A N LEU 133.A O no hydrogen 2.894 N/A ASP 138.A N LYS 134.A O no hydrogen 2.977 N/A ALA 139.A N ASN 135.A O no hydrogen 2.868 N/A ALA 140.A N ALA 136.A O no hydrogen 2.794 N/A LYS 141.A N TYR 137.A O no hydrogen 2.910 N/A ASP 142.A N ASP 138.A O no hydrogen 2.848 N/A LYS 143.A N ALA 139.A O no hydrogen 3.153 N/A LYS 143.A N ALA 140.A O no hydrogen 3.314 N/A LYS 143.A NZ ASP 142.A OD2.B no hydrogen 3.346 N/A GLY 144.A N LYS 141.A O no hydrogen 3.210 N/A VAL 145.A N ALA 140.A O no hydrogen 2.812 N/A THR 148.A N VAL 102.A O no hydrogen 2.865 N/A GLY 150.A N LEU 104.A O no hydrogen 3.211 N/A VAL 152.A N THR 107.A O no hydrogen 3.293 N/A PHE 153.A N GLY 175.A O no hydrogen 2.870 N/A THR 154.A N SER 109.A O no hydrogen 2.752 N/A THR 154.A OG1 GLU 177.A OE2 no hydrogen 2.788 N/A THR 154.A OG1 THR 181.A OG1 no hydrogen 3.326 N/A ALA 155.A N GLU 177.A O no hydrogen 2.795 N/A ASP 156.A N ASP 111.A OD1 no hydrogen 2.769 N/A ASP 162.A N ASN 160.A OD1 no hydrogen 2.841 N/A SER 163.A N ASN 160.A O no hydrogen 3.362 N/A ILE 165.A N SER 163.A OG no hydrogen 3.270 N/A LEU 168.A N GLN 164.A O no hydrogen 2.879 N/A ALA 169.A N ILE 165.A O no hydrogen 2.896 N/A LYS 170.A N GLU 166.A O no hydrogen 3.074 N/A TYR 171.A N LYS 167.A O no hydrogen 2.946 N/A GLY 172.A N ALA 169.A O no hydrogen 2.865 N/A VAL 173.A N LEU 168.A O no hydrogen 2.966 N/A LEU 174.A N SER 151.A O no hydrogen 2.828 N/A VAL 176.A N GLY 91.A O no hydrogen 2.732 N/A GLU 177.A N PHE 153.A O no hydrogen 2.855 N/A MET 178.A N GLU 179.A OE1 no hydrogen 3.009 N/A GLU 179.A N GLU 177.A OE1 no hydrogen 3.280 N/A GLU 179.A N GLU 177.A OE2 no hydrogen 3.147 N/A THR 180.A N GLU 177.A OE1 no hydrogen 3.101 N/A THR 180.A N GLU 177.A OE2 no hydrogen 3.062 N/A THR 180.A OG1 GLU 177.A OE1 no hydrogen 2.709 N/A THR 180.A OG1 SER 196.A OG no hydrogen 2.930 N/A THR 181.A N THR 154.A OG1 no hydrogen 3.007 N/A THR 181.A OG1 SER 108.A OG no hydrogen 2.880 N/A THR 181.A OG1 SER 109.A O no hydrogen 3.440 N/A THR 181.A OG1 THR 154.A OG1 no hydrogen 3.326 N/A LEU 183.A N GLU 179.A O no hydrogen 3.192 N/A TYR 184.A N THR 180.A O no hydrogen 2.885 N/A TYR 184.A OH ALA 105.A O no hydrogen 2.504 N/A THR 185.A N THR 181.A O no hydrogen 2.998 N/A THR 185.A OG1 THR 181.A O no hydrogen 2.723 N/A LEU 186.A N ALA 182.A O no hydrogen 2.879 N/A ALA 187.A N LEU 183.A O no hydrogen 2.916 N/A ALA 188.A N TYR 184.A O no hydrogen 3.113 N/A LYS 189.A N THR 185.A O no hydrogen 2.914 N/A HIS 190.A N LEU 186.A O no hydrogen 3.206 N/A HIS 190.A N ALA 187.A O no hydrogen 3.213 N/A GLY 191.A N ALA 188.A O no hydrogen 3.121 N/A ARG 192.A N ALA 187.A O no hydrogen 2.801 N/A ARG 192.A NE HIS 190.A O no hydrogen 3.008 N/A ARG 192.A NH1 ILE 76.A O no hydrogen 3.030 N/A ARG 192.A NH1 VAL 81.A O no hydrogen 2.818 N/A LYS 193.A N GLN 82.A O no hydrogen 2.849 N/A LEU 195.A N LEU 84.A O no hydrogen 3.139 N/A SER 196.A N TYR 184.A OH no hydrogen 2.780 N/A SER 196.A OG THR 180.A OG1 no hydrogen 2.930 N/A ILE 197.A N ARG 86.A O no hydrogen 2.896 N/A LEU 198.A N ILE 103.A O no hydrogen 2.839 N/A THR 199.A N GLY 88.A O no hydrogen 2.822 N/A THR 199.A OG1 GLY 88.A O no hydrogen 3.438 N/A THR 199.A OG1 SER 89.A OG no hydrogen 2.843 N/A SER 201.A N CYS 90.A O no hydrogen 2.788 N/A SER 201.A OG CYS 90.A O no hydrogen 3.255 N/A SER 201.A OG ASP 202.A OD2 no hydrogen 2.698 N/A HIS 203.A N GLU 208.A O no hydrogen 2.863 N/A HIS 203.A NE2 ARG 94.A O no hydrogen 2.911 N/A VAL 204.A N ALA 92.A O no hydrogen 2.833 N/A LEU 205.A N HIS 203.A ND1 no hydrogen 3.360 N/A THR 206.A N HIS 203.A ND1 no hydrogen 3.273 N/A GLY 207.A N HIS 203.A O no hydrogen 2.759 N/A GLU 208.A N THR 206.A OG1.B no hydrogen 3.176 N/A THR 211.A N GLU 214.A OE1 no hydrogen 2.995 N/A ARG 215.A N THR 211.A O no hydrogen 3.003 N/A ARG 215.A NH1 THR 210.A OG1 no hydrogen 2.981 N/A GLN 216.A N ALA 212.A O no hydrogen 2.987 N/A THR 217.A N GLU 213.A O no hydrogen 2.772 N/A THR 217.A OG1 GLU 213.A O no hydrogen 2.788 N/A THR 218.A N GLU 214.A O no hydrogen 2.773 N/A THR 218.A OG1 GLU 214.A O no hydrogen 2.677 N/A THR 218.A OG1 ARG 215.A O no hydrogen 3.560 N/A PHE 219.A N ARG 215.A O no hydrogen 3.077 N/A HIS 220.A N GLN 216.A O no hydrogen 2.962 N/A HIS 220.A ND1 TYR 31.A OH no hydrogen 2.761 N/A ASP 221.A N THR 217.A O no hydrogen 2.888 N/A MET 222.A N THR 218.A O no hydrogen 2.871 N/A ILE 223.A N PHE 219.A O no hydrogen 3.035 N/A ASP 224.A N HIS 220.A O no hydrogen 2.906 N/A VAL 225.A N ASP 221.A O no hydrogen 2.948 N/A ALA 226.A N MET 222.A O no hydrogen 2.914 N/A LEU 227.A N ILE 223.A O no hydrogen 2.845 N/A HIS 228.A N VAL 225.A O no hydrogen 2.907 N/A HIS 228.A ND1 ASP 224.A O no hydrogen 2.651 N/A SER 229.A N ALA 226.A O no hydrogen 3.078 N/A SER 229.A OG VAL 225.A O no hydrogen 3.031 N/A SER 229.A OG ALA 226.A O no hydrogen 3.524 N/A