Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5est_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N LEU 134.A O no hydrogen 3.073 N/A VAL 1.A N ASP 187.A OD1 no hydrogen 3.443 N/A VAL 1.A N ASP 187.A OD2 no hydrogen 2.571 N/A VAL 2.A N SER 182.A O no hydrogen 2.841 N/A THR 5.A N GLN 147.A O no hydrogen 2.807 N/A THR 5.A OG1 GLN 147.A O no hydrogen 3.506 N/A ALA 7.A N LEU 145.A O no hydrogen 2.723 N/A SER 11.A N GLN 8.A O no hydrogen 2.980 N/A TRP 12.A NE1 GLN 147.A OE1 no hydrogen 2.896 N/A GLN 15.A N TRP 12.A O no hydrogen 3.146 N/A GLN 15.A NE2 ILE 16.A O no hydrogen 2.835 N/A ILE 16.A N GLY 32.A O no hydrogen 3.187 N/A SER 17.A N VAL 56.A O no hydrogen 3.079 N/A SER 17.A OG HIS 28.A ND1 no hydrogen 2.788 N/A LEU 18.A N CYS 30.A O no hydrogen 2.837 N/A GLN 19.A N ARG 54A.A O no hydrogen 2.981 N/A GLN 19.A NE2 SER 17.A OG no hydrogen 2.724 N/A TYR 20.A N ALA 27.A O no hydrogen 2.997 N/A ARG 21.A N THR 52.A O no hydrogen 3.072 N/A SER 25.A N SER 22A.A O no hydrogen 2.869 N/A SER 25.A OG TRP 26.A O no hydrogen 3.444 N/A TRP 26.A N SER 25.A OG no hydrogen 2.697 N/A ALA 27.A N TYR 20.A O no hydrogen 2.947 N/A HIS 28.A ND1 SER 17.A OG no hydrogen 2.788 N/A HIS 28.A NE2 GLY 186.A O no hydrogen 2.937 N/A THR 29.A N LEU 18.A O no hydrogen 2.754 N/A CYS 30.A N LEU 18.A O no hydrogen 3.065 N/A CYS 30.A SG THR 29.A O no hydrogen 3.059 N/A GLY 31.A N SER 188.A O no hydrogen 2.773 N/A THR 33.A N MET 41.A O no hydrogen 3.002 N/A LEU 34.A N SER 14.A O no hydrogen 2.917 N/A ILE 35.A N TRP 39.A O no hydrogen 2.985 N/A ARG 36.A N TRP 39.A O no hydrogen 3.101 N/A ARG 36.A NH1 ILE 35.A O no hydrogen 3.230 N/A GLN 37.A NE2 VAL 103.A O no hydrogen 2.846 N/A TRP 39.A N ARG 36.A O no hydrogen 3.242 N/A VAL 40.A N LEU 97.A O no hydrogen 2.892 N/A MET 41.A N THR 33.A O no hydrogen 2.862 N/A THR 42.A N ALA 95.A O no hydrogen 2.766 N/A THR 42.A OG1 GLY 31.A O no hydrogen 2.875 N/A HIS 45.A N ASP 93.A OD1 no hydrogen 3.072 N/A HIS 45.A ND1 ASP 93.A OD1 no hydrogen 3.270 N/A HIS 45.A ND1 ASP 93.A OD2 no hydrogen 2.633 N/A HIS 45.A NE2 SER 188.A OG no hydrogen 2.791 N/A CYS 46.A N ALA 43.A O no hydrogen 3.379 N/A VAL 47.A N ALA 44.A O no hydrogen 2.859 N/A ASP 48.A N HIS 45.A O no hydrogen 3.390 N/A VAL 55.A N VAL 72.A O no hydrogen 2.835 N/A VAL 56.A N SER 17.A O no hydrogen 2.776 N/A VAL 57.A N GLN 70.A O no hydrogen 2.906 N/A HIS 60.A N ASN 66.A OD1 no hydrogen 3.208 N/A HIS 60.A NE2 GLU 6.A OE2 no hydrogen 3.070 N/A ASN 61.A N ASN 66.A OD1 no hydrogen 2.837 N/A LEU 62.A N GLN 143.A O no hydrogen 2.661 N/A ASN 63.A N ASN 61.A OD1 no hydrogen 2.666 N/A ASN 66.A N GLU 69.A OE2 no hydrogen 2.707 N/A GLY 67.A N ASN 65.A OD1 no hydrogen 3.066 N/A THR 68.A N GLU 69.A OE1 no hydrogen 2.975 N/A THR 68.A OG1 GLY 58.A O no hydrogen 2.592 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 2.597 N/A GLN 70.A N VAL 57.A O no hydrogen 2.834 N/A GLN 70.A NE2 THR 104.A O no hydrogen 2.810 N/A VAL 72.A N VAL 55.A O no hydrogen 2.833 N/A VAL 74.A N PHE 53.A O no hydrogen 3.376 N/A GLN 75.A N ARG 98.A O no hydrogen 2.908 N/A LYS 76.A N ARG 98.A O no hydrogen 3.235 N/A LYS 76.A NZ ASN 240.A OD1 no hydrogen 2.785 N/A VAL 78.A N LEU 96.A O no hydrogen 2.880 N/A HIS 80.A N ILE 94.A O no hydrogen 3.185 N/A TYR 82.A N HIS 80.A ND1 no hydrogen 3.146 N/A TRP 83.A N HIS 80.A O no hydrogen 2.906 N/A TRP 83.A NE1 ASP 48.A OD1 no hydrogen 3.065 N/A THR 85.A OG1 ASP 48.A OD1 no hydrogen 3.281 N/A THR 85.A OG1 ASP 48.A OD2 no hydrogen 3.513 N/A ASP 86.A N ASN 84.A OD1 no hydrogen 2.871 N/A ASP 87.A N ASN 84.A O no hydrogen 2.792 N/A GLY 91.A N VAL 88.A O no hydrogen 3.072 N/A ILE 94.A N TYR 92.A O no hydrogen 2.857 N/A ALA 95.A N THR 42.A O no hydrogen 2.818 N/A LEU 96.A N VAL 78.A O no hydrogen 2.976 N/A LEU 97.A N VAL 40.A O no hydrogen 2.813 N/A ARG 98.A N LYS 76.A O no hydrogen 2.805 N/A ARG 98.A NH1 GLN 75.A OE1 no hydrogen 3.507 N/A LEU 99.A N ASN 38.A O no hydrogen 2.734 N/A ALA 100.A N GLY 73.A O no hydrogen 2.825 N/A VAL 103.A N GLN 37.A O no hydrogen 2.912 N/A THR 104.A N GLN 70.A OE1 no hydrogen 3.068 N/A ASN 106.A N VAL 109.A O no hydrogen 2.879 N/A TYR 108.A N ASN 106.A OD1 no hydrogen 2.712 N/A VAL 109.A N ASN 106.A O no hydrogen 3.183 N/A GLN 110.A N PRO 13.A O no hydrogen 3.070 N/A GLN 110.A NE2 ASN 106.A O no hydrogen 2.642 N/A GLY 112.A N LEU 34.A O no hydrogen 2.679 N/A GLY 118.A N SER 227.A O no hydrogen 2.954 N/A THR 119.A N ARG 116.A O no hydrogen 3.126 N/A THR 119.A OG1 ARG 116.A O no hydrogen 2.699 N/A ASN 124.A N THR 152.A O no hydrogen 2.735 N/A SER 125.A N ALA 122.A O no hydrogen 3.242 N/A SER 125.A N THR 152.A OG1 no hydrogen 3.024 N/A SER 125.A OG ALA 122.A O no hydrogen 2.626 N/A CYS 127.A SG SER 125.A O no hydrogen 3.758 N/A TYR 128.A N HIS 193.A O no hydrogen 2.747 N/A ILE 129.A N ALA 148.A O no hydrogen 2.953 N/A THR 130.A OG1 GLN 15.A OE1 no hydrogen 2.696 N/A THR 130.A OG1 HIS 193.A NE2 no hydrogen 3.030 N/A GLY 131.A N GLN 146.A O no hydrogen 3.145 N/A TRP 132.A NE1 HIS 60.A O no hydrogen 2.956 N/A GLY 133.A N ASP 187.A OD1 no hydrogen 2.922 N/A LEU 134.A N GLN 185.A O no hydrogen 2.825 N/A THR 135.A N GLN 140.A O no hydrogen 3.226 N/A THR 135.A OG1 GLN 140.A O no hydrogen 3.529 N/A THR 137.A OG1 ASN 215.A OD1 no hydrogen 3.413 N/A GLY 139.A N ARG 136.A O no hydrogen 2.986 N/A ALA 142.A N TRP 132.A O no hydrogen 3.111 N/A ALA 142.A N GLY 133.A O no hydrogen 3.300 N/A GLN 143.A NE2 ASN 61.A OD1 no hydrogen 3.576 N/A LEU 145.A N HIS 60.A O no hydrogen 3.256 N/A GLN 146.A N GLY 131.A O no hydrogen 3.383 N/A GLN 146.A NE2 THR 144.A O no hydrogen 2.807 N/A GLN 147.A N THR 5.A O no hydrogen 2.768 N/A ALA 148.A N ILE 129.A O no hydrogen 3.081 N/A LEU 150.A N CYS 127.A O no hydrogen 2.642 N/A THR 152.A N SER 125.A O no hydrogen 2.981 N/A THR 152.A OG1 ALA 122.A O no hydrogen 3.035 N/A VAL 153.A N CYS 174.A O no hydrogen 3.036 N/A ASP 154.A N ASN 123.A OD1 no hydrogen 2.944 N/A ILE 157.A N ASP 154.A OD1 no hydrogen 3.097 N/A CYS 158.A N ASP 154.A O no hydrogen 2.729 N/A SER 159.A N TYR 155.A O no hydrogen 2.751 N/A SER 159.A OG TYR 155.A O no hydrogen 2.677 N/A SER 160.A N ILE 157.A O no hydrogen 2.970 N/A SER 160.A OG ILE 157.A O no hydrogen 2.781 N/A TYR 163.A N SER 160.A O no hydrogen 2.879 N/A TRP 164.A N CYS 158.A O no hydrogen 2.919 N/A TRP 164.A NE1 PRO 220.A O no hydrogen 2.967 N/A GLY 165.A N SER 160.A O no hydrogen 2.905 N/A THR 167.A N TRP 164.A O no hydrogen 3.218 N/A VAL 168.A N GLY 165.A O no hydrogen 3.311 N/A LYS 169.A NZ SER 166.A O no hydrogen 2.710 N/A LYS 169.A NZ THR 167.A O no hydrogen 2.966 N/A LYS 169.A NZ ALA 89A.A O no hydrogen 2.756 N/A MET 172.A N LYS 169.A O no hydrogen 2.969 N/A VAL 173.A N PHE 223.A O no hydrogen 2.859 N/A ALA 175.A N THR 221.A O no hydrogen 3.043 N/A GLY 176.A N PRO 151.A O no hydrogen 2.821 N/A VAL 180.A N ASP 178.A OD1 no hydrogen 2.679 N/A SER 182.A N VAL 2.A O no hydrogen 3.016 N/A SER 182.A OG GLY 183.A O no hydrogen 2.652 N/A GLY 183.A N THR 221.A OG1 no hydrogen 3.073 N/A CYS 184.A N ASP 187.A OD2 no hydrogen 2.801 N/A CYS 184.A SG ARG 136.A O no hydrogen 3.806 N/A CYS 184.A SG GLN 185.A OE1 no hydrogen 3.547 N/A ASP 187.A N CYS 184.A O no hydrogen 2.831 N/A SER 188.A OG HIS 45.A NE2 no hydrogen 2.791 N/A GLY 189.A N THR 206.A O no hydrogen 2.956 N/A GLY 190.A N ASP 187.A O no hydrogen 3.174 N/A LEU 192.A N GLY 204.A O no hydrogen 3.119 N/A HIS 193.A N TYR 128.A O no hydrogen 2.839 N/A HIS 193.A NE2 THR 130.A OG1 no hydrogen 3.030 N/A CYS 194.A N ALA 201.A O no hydrogen 2.955 N/A LEU 195.A N PRO 126.A O no hydrogen 3.491 N/A VAL 196.A N GLN 199.A O no hydrogen 2.877 N/A GLN 199.A N VAL 196.A O no hydrogen 2.931 N/A ALA 201.A N CYS 194.A O no hydrogen 2.847 N/A VAL 202.A N VAL 113.A O no hydrogen 2.847 N/A HIS 203.A N LEU 192.A O no hydrogen 2.877 N/A GLY 204.A N LEU 192.A O no hydrogen 3.441 N/A VAL 205.A N THR 224.A O no hydrogen 3.014 N/A THR 206.A N GLY 190.A O no hydrogen 2.774 N/A THR 206.A OG1 ASP 187.A O no hydrogen 3.539 N/A THR 206.A OG1 GLY 190.A O no hydrogen 3.101 N/A SER 207.A N VAL 222.A O no hydrogen 2.769 N/A SER 207.A OG ASP 93.A OD2 no hydrogen 2.760 N/A PHE 208.A N VAL 222.A O no hydrogen 3.068 N/A LEU 212.A N SER 210.A OG no hydrogen 2.898 N/A GLY 213.A N SER 210.A O no hydrogen 3.308 N/A CYS 214.A N THR 137.A OG1 no hydrogen 3.046 N/A CYS 214.A SG GLN 185.A OE1 no hydrogen 3.471 N/A ASN 215.A ND2 GLY 179.A O no hydrogen 2.937 N/A ARG 218.A N GLY 177.A O no hydrogen 2.860 N/A LYS 219.A N VAL 216A.A O no hydrogen 3.143 N/A LYS 219.A NZ TYR 163.A O no hydrogen 2.972 N/A LYS 219.A NZ ARG 218.A O no hydrogen 3.278 N/A THR 221.A N ALA 175.A O no hydrogen 3.112 N/A VAL 222.A N PHE 208.A O no hydrogen 3.089 N/A PHE 223.A N VAL 173.A O no hydrogen 3.019 N/A THR 224.A N VAL 205.A O no hydrogen 2.788 N/A THR 224.A OG1 ASP 93.A O no hydrogen 2.663 N/A ARG 225.A N SER 171.A O no hydrogen 3.077 N/A ARG 225.A NE ASN 170.A O no hydrogen 2.958 N/A ARG 225.A NH1 SER 227.A OG no hydrogen 3.160 N/A ARG 225.A NH2 ASN 170.A O no hydrogen 2.989 N/A ARG 225.A NH2 ASN 170.A OD1 no hydrogen 3.428 N/A VAL 226.A N HIS 203.A O no hydrogen 3.071 N/A SER 227.A OG THR 119.A O no hydrogen 2.580 N/A ALA 228.A N ARG 225.A O no hydrogen 3.017 N/A TYR 229.A N VAL 226.A O no hydrogen 2.783 N/A ILE 233.A N TYR 229.A O no hydrogen 2.750 N/A ASN 234.A N ILE 230.A O no hydrogen 2.911 N/A ASN 235.A N SER 231.A O no hydrogen 2.937 N/A VAL 236.A N TRP 232.A O no hydrogen 2.872 N/A ILE 237.A N ILE 233.A O no hydrogen 3.090 N/A ALA 238.A N ASN 234.A O no hydrogen 2.907 N/A SER 239.A N VAL 236.A O no hydrogen 3.052 N/A SER 239.A OG ASN 235.A O no hydrogen 2.703 N/A SER 239.A OG VAL 236.A O no hydrogen 3.447 N/A ASN 240.A N ILE 237.A O no hydrogen 3.050 N/A ASN 240.A ND2 VAL 236.A O no hydrogen 2.696 N/A SER 22A.A N SER 25.A O no hydrogen 2.827 N/A ARG 54A.A N GLN 19.A O no hydrogen 2.824 N/A ARG 54A.A NE GLN 19.A OE1 no hydrogen 2.994 N/A ARG 54A.A NH2 GLN 19.A OE1 no hydrogen 2.966 N/A ARG 181A.A N ASP 178.A OD1 no hydrogen 2.919 N/A ARG 181A.A NH1 ASP 178.A OD2 no hydrogen 3.191 N/A ALA 90B.A N ASP 87.A O no hydrogen 3.028 N/A