Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e3y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 108.A OE1 no hydrogen 2.621 N/A SER 1.A OG GLU 108.A OE2 no hydrogen 3.506 N/A PHE 2.A N GLU 108.A OE2 no hydrogen 2.931 N/A ILE 3.A N SER 1.A OG no hydrogen 3.107 N/A LYS 4.A N SER 1.A OG no hydrogen 3.059 N/A ILE 6.A N ILE 3.A O no hydrogen 2.784 N/A TYR 7.A N LYS 4.A O no hydrogen 3.256 N/A TYR 7.A OH THR 169.A OG1 no hydrogen 2.763 N/A ILE 10.A N ILE 6.A O no hydrogen 2.868 N/A ASN 11.A N TYR 7.A O no hydrogen 2.596 N/A SER 12.A N GLN 8.A O no hydrogen 3.083 N/A SER 12.A OG GLN 8.A O no hydrogen 3.433 N/A ILE 13.A N ASP 9.A O no hydrogen 2.874 N/A LEU 14.A N ILE 10.A O no hydrogen 2.998 N/A ILE 15.A N ASN 11.A O no hydrogen 3.205 N/A GLY 16.A N CYS 166.A O no hydrogen 3.083 N/A GLN 17.A N LEU 14.A O no hydrogen 2.982 N/A GLN 17.A NE2 ILE 13.A O no hydrogen 3.058 N/A VAL 19.A N LEU 164.A O no hydrogen 2.887 N/A ARG 21.A N GLU 162.A O no hydrogen 3.321 N/A VAL 26.A N PHE 22.A O no hydrogen 2.959 N/A TYR 27.A N GLU 23.A O no hydrogen 2.939 N/A TYR 27.A OH GLU 43.A OE2 no hydrogen 2.714 N/A LYS 28.A N LYS 24.A O no hydrogen 2.895 N/A PHE 29.A N LEU 25.A O no hydrogen 2.970 N/A LEU 30.A N VAL 26.A O no hydrogen 3.040 N/A LYS 31.A N TYR 27.A O no hydrogen 2.819 N/A LYS 31.A NZ SER 35.A O no hydrogen 3.154 N/A LYS 31.A NZ THR 38.A O no hydrogen 3.181 N/A GLU 32.A N LYS 28.A O no hydrogen 3.019 N/A ASN 33.A N PHE 29.A O no hydrogen 2.983 N/A ASN 33.A N LEU 30.A O no hydrogen 3.241 N/A ASN 33.A ND2 PHE 29.A O no hydrogen 2.795 N/A LEU 34.A N LEU 30.A O no hydrogen 2.599 N/A LEU 37.A N LEU 34.A O no hydrogen 2.923 N/A THR 38.A OG1 LEU 30.A O no hydrogen 3.365 N/A THR 38.A OG1 LEU 34.A O no hydrogen 2.874 N/A PHE 39.A N LEU 100.A O no hydrogen 2.909 N/A LYS 40.A N GLU 43.A OE2 no hydrogen 2.836 N/A LYS 40.A NZ GLU 23.A OE2 no hydrogen 2.860 N/A LYS 40.A NZ ASP 98.A O no hydrogen 2.755 N/A GLN 41.A NE2 LEU 73.A O no hydrogen 3.679 N/A GLN 41.A NE2 LEU 74.A O no hydrogen 2.837 N/A TYR 44.A N LYS 40.A O no hydrogen 2.914 N/A LEU 45.A N GLN 41.A O no hydrogen 3.081 N/A ASN 46.A N TYR 42.A O no hydrogen 2.821 N/A ASN 46.A ND2 PHE 90.A O no hydrogen 2.932 N/A ASP 47.A N GLU 43.A O no hydrogen 2.895 N/A LEU 48.A N TYR 44.A O no hydrogen 2.981 N/A PHE 49.A N LEU 45.A O no hydrogen 3.074 N/A MET 50.A N ASN 46.A O no hydrogen 2.986 N/A LYS 51.A N ASP 47.A O no hydrogen 3.234 N/A ASN 52.A N PHE 49.A O no hydrogen 3.149 N/A ASN 52.A ND2 LEU 48.A O no hydrogen 2.752 N/A ILE 55.A N ASN 52.A O no hydrogen 2.784 N/A ARG 61.A N GLY 57.A O no hydrogen 3.256 N/A ARG 61.A NE ILE 55.A O no hydrogen 2.894 N/A ARG 61.A NH1 THR 81.A O no hydrogen 2.822 N/A ARG 61.A NH1 TRP 84.A O no hydrogen 3.187 N/A ARG 61.A NH2 ILE 55.A O no hydrogen 3.543 N/A TYR 62.A N HIS 58.A O no hydrogen 2.744 N/A TYR 62.A OH ARG 76.A O no hydrogen 2.768 N/A LYS 63.A N GLU 59.A O no hydrogen 3.174 N/A LEU 64.A N ARG 61.A O no hydrogen 3.144 N/A PHE 65.A N TYR 62.A O no hydrogen 3.232 N/A SER 67.A OG GLU 144.A OE1 no hydrogen 2.868 N/A SER 67.A OG GLU 144.A OE2 no hydrogen 3.361 N/A THR 69.A N GLU 144.A OE2 no hydrogen 3.321 N/A THR 69.A OG1 GLU 144.A OE2 no hydrogen 2.698 N/A LEU 70.A N SER 67.A OG no hydrogen 3.037 N/A LEU 71.A N SER 67.A O no hydrogen 2.905 N/A PHE 72.A N PRO 68.A O no hydrogen 2.928 N/A LEU 73.A N THR 69.A O no hydrogen 2.849 N/A LEU 74.A N LEU 70.A O no hydrogen 2.769 N/A SER 75.A N LEU 71.A O no hydrogen 3.045 N/A SER 75.A OG LEU 71.A O no hydrogen 2.545 N/A ARG 76.A NE ASP 95.A OD2 no hydrogen 3.115 N/A ARG 76.A NH1 GLU 91.A O no hydrogen 2.827 N/A ARG 76.A NH1 ASP 95.A OD1 no hydrogen 2.770 N/A ARG 76.A NH2 GLU 91.A O no hydrogen 3.337 N/A THR 81.A N GLY 77.A O no hydrogen 2.930 N/A THR 81.A OG1 ARG 76.A O no hydrogen 3.176 N/A THR 81.A OG1 GLY 77.A O no hydrogen 2.721 N/A GLU 82.A N LYS 78.A O no hydrogen 2.930 N/A ASN 83.A N ALA 79.A O no hydrogen 2.952 N/A TRP 84.A NE1 ASN 46.A OD1 no hydrogen 2.851 N/A SER 85.A N ASN 88.A O no hydrogen 3.411 N/A SER 85.A OG GLU 87.A OE1 no hydrogen 2.748 N/A GLU 87.A N SER 85.A OG no hydrogen 3.175 N/A ASN 88.A N SER 85.A O no hydrogen 2.945 N/A PHE 90.A N ASN 46.A OD1 no hydrogen 2.853 N/A ASP 95.A N LYS 93.A O no hydrogen 3.227 N/A THR 96.A OG1 LEU 73.A O no hydrogen 2.732 N/A ALA 97.A N GLN 41.A OE1 no hydrogen 3.012 N/A ASP 98.A N LEU 110.A O no hydrogen 3.002 N/A ILE 99.A N LEU 110.A O no hydrogen 3.041 N/A LEU 100.A N PHE 39.A O no hydrogen 2.719 N/A LEU 101.A N GLU 108.A O no hydrogen 2.901 N/A VAL 102.A N LEU 37.A O no hydrogen 2.914 N/A LYS 103.A N PHE 106.A O no hydrogen 3.091 N/A PHE 106.A N LYS 103.A O no hydrogen 2.950 N/A TYR 107.A N LEU 147.A O no hydrogen 2.786 N/A TYR 107.A OH TYR 44.A OH no hydrogen 2.347 N/A GLU 108.A N LEU 101.A O no hydrogen 2.775 N/A LEU 109.A N ASP 149.A O no hydrogen 2.871 N/A LEU 110.A N ILE 99.A O no hydrogen 2.763 N/A ASP 111.A N ASN 151.A O no hydrogen 3.008 N/A VAL 112.A N ASP 98.A OD1 no hydrogen 2.908 N/A LYS 113.A N LEU 153.A O no hydrogen 2.739 N/A LYS 113.A NZ ASN 125.A O no hydrogen 3.004 N/A ARG 115.A N VAL 155.A O no hydrogen 2.992 N/A ARG 115.A NH1 GLU 154.A OE2 no hydrogen 2.811 N/A ILE 117.A N TRP 157.A O no hydrogen 2.843 N/A LYS 119.A N ASN 116.A O no hydrogen 3.375 N/A ILE 126.A N ILE 192.A O no hydrogen 2.706 N/A ALA 129.A N MET 190.A O no hydrogen 2.752 N/A LYS 131.A N SER 128.A OG no hydrogen 3.022 N/A LYS 131.A NZ THR 96.A OG1 no hydrogen 2.783 N/A LEU 132.A N SER 128.A O no hydrogen 2.998 N/A ALA 133.A N ALA 129.A O no hydrogen 2.932 N/A GLN 134.A N TYR 130.A O no hydrogen 2.946 N/A GLN 134.A NE2 TYR 130.A O no hydrogen 3.181 N/A THR 135.A N LYS 131.A O no hydrogen 2.879 N/A THR 135.A OG1 LYS 131.A O no hydrogen 2.822 N/A CYS 136.A N LEU 132.A O no hydrogen 2.846 N/A CYS 136.A SG LEU 132.A O no hydrogen 3.431 N/A CYS 136.A SG ALA 211.A O no hydrogen 4.043 N/A ALA 137.A N ALA 133.A O no hydrogen 2.884 N/A LYS 138.A N GLN 134.A O no hydrogen 2.940 N/A MET 139.A N THR 135.A O no hydrogen 2.868 N/A ILE 140.A N CYS 136.A O no hydrogen 3.053 N/A ASP 141.A N ALA 137.A O no hydrogen 2.988 N/A ASN 142.A N LYS 138.A O no hydrogen 3.025 N/A ASN 142.A ND2 LYS 138.A O no hydrogen 2.839 N/A LYS 143.A N ILE 140.A O no hydrogen 3.132 N/A GLU 144.A N MET 139.A O no hydrogen 2.882 N/A ASP 149.A N TYR 107.A O no hydrogen 2.743 N/A ASN 151.A N LEU 109.A O no hydrogen 2.849 N/A ASN 151.A ND2 GLU 108.A OE1 no hydrogen 2.673 N/A TYR 152.A N ALA 172.A O no hydrogen 2.850 N/A LEU 153.A N ASP 111.A O no hydrogen 3.067 N/A GLU 154.A N SER 170.A O no hydrogen 2.919 N/A VAL 155.A N LYS 113.A O no hydrogen 2.885 N/A ASP 156.A N SER 168.A O no hydrogen 2.932 N/A TRP 157.A N ARG 115.A O no hydrogen 2.856 N/A GLU 158.A N VAL 165.A O no hydrogen 2.943 N/A ASN 160.A N ASP 163.A O no hydrogen 2.830 N/A ASP 163.A N ASN 160.A O no hydrogen 3.351 N/A LEU 164.A N VAL 19.A O no hydrogen 2.827 N/A VAL 165.A N GLU 158.A O no hydrogen 2.975 N/A CYS 166.A N GLN 17.A O no hydrogen 3.046 N/A CYS 166.A SG ASP 156.A O no hydrogen 3.599 N/A CYS 166.A SG SER 168.A O no hydrogen 3.562 N/A VAL 167.A N ASP 156.A O no hydrogen 2.859 N/A SER 168.A OG ASP 156.A OD2 no hydrogen 2.777 N/A THR 169.A OG1 TYR 7.A OH no hydrogen 2.763 N/A THR 169.A OG1 ASN 11.A OD1 no hydrogen 2.677 N/A SER 170.A N GLU 154.A O no hydrogen 3.199 N/A ALA 172.A N TYR 152.A O no hydrogen 3.074 N/A GLU 173.A N GLN 201.A OE1 no hydrogen 2.885 N/A LEU 174.A N ILE 150.A O no hydrogen 2.908 N/A LYS 176.A N GLU 173.A O no hydrogen 3.164 N/A LYS 176.A NZ GLU 173.A OE1 no hydrogen 2.824 N/A SER 177.A N LEU 174.A O no hydrogen 3.023 N/A SER 177.A OG LEU 174.A O no hydrogen 2.613 N/A GLU 178.A N ASP 200.A OD2 no hydrogen 3.118 N/A GLU 181.A N GLU 178.A O no hydrogen 3.095 N/A LEU 182.A N PRO 179.A O no hydrogen 3.174 N/A ASN 185.A N GLN 191.A O no hydrogen 2.894 N/A ASN 185.A ND2 GLN 193.A OE1 no hydrogen 2.918 N/A ALA 188.A N ASN 185.A OD1 no hydrogen 3.178 N/A ALA 189.A N ALA 187.A O no hydrogen 2.892 N/A MET 190.A N TRP 186.A O no hydrogen 3.041 N/A GLN 191.A N ALA 188.A O no hydrogen 2.923 N/A GLN 191.A NE2 ALA 189.A O no hydrogen 3.619 N/A ILE 192.A N ILE 127.A O no hydrogen 2.828 N/A GLN 193.A N TYR 183.A O no hydrogen 2.915 N/A GLN 193.A NE2 ASN 125.A OD1 no hydrogen 2.879 N/A ARG 197.A N GLU 154.A OE1 no hydrogen 2.918 N/A ARG 197.A NH2 ASP 156.A OD2 no hydrogen 3.066 N/A ASP 198.A N HIS 195.A O no hydrogen 2.767 N/A LEU 199.A N VAL 196.A O no hydrogen 3.245 N/A GLN 201.A NE2 GLU 173.A O no hydrogen 2.925 N/A GLN 201.A NE2 ASP 200.A O no hydrogen 2.911 N/A PHE 203.A N LYS 176.A O no hydrogen 2.923 N/A THR 206.A N GLU 209.A OE1 no hydrogen 2.872 N/A ARG 207.A NH1 PHE 148.A O no hydrogen 3.026 N/A ARG 207.A NH1 ASP 149.A OD1 no hydrogen 3.231 N/A ARG 207.A NH2 ASP 149.A OD1 no hydrogen 2.818 N/A GLU 209.A N THR 206.A OG1 no hydrogen 3.064 N/A TRP 210.A N THR 206.A O no hydrogen 2.946 N/A TRP 210.A NE1 SER 177.A O no hydrogen 2.728 N/A ALA 211.A N ARG 207.A O no hydrogen 3.042 N/A LYS 212.A N GLU 208.A O no hydrogen 3.094 N/A SER 213.A N GLU 209.A O no hydrogen 2.897 N/A TYR 214.A N TRP 210.A O no hydrogen 2.804 N/A TYR 214.A OH ALA 129.A O no hydrogen 2.698 N/A LEU 215.A N ALA 211.A O no hydrogen 2.951 N/A LYS 216.A N LYS 212.A O no hydrogen 2.968 N/A HIS 217.A N SER 213.A O no hydrogen 2.978 N/A HIS 217.A NE2 LEU 182.A O no hydrogen 2.867 N/A PHE 218.A N TYR 214.A O no hydrogen 2.672 N/A VAL 219.A N LEU 215.A O no hydrogen 2.922 N/A THR 220.A N LYS 216.A O no hydrogen 2.948 N/A THR 220.A OG1 LYS 216.A O no hydrogen 2.767 N/A GLN 221.A N HIS 217.A O no hydrogen 2.860 N/A ALA 222.A N PHE 218.A O no hydrogen 2.942 N/A GLU 223.A N VAL 219.A O no hydrogen 3.108 N/A GLN 224.A N THR 220.A O no hydrogen 3.085 N/A ARG 225.A N GLN 221.A O no hydrogen 2.875 N/A ALA 226.A N ALA 222.A O no hydrogen 2.958 N/A ILE 227.A N GLU 223.A O no hydrogen 3.369 N/A SER 228.A N GLN 224.A O no hydrogen 2.866 N/A SER 228.A OG GLN 224.A O no hydrogen 3.315 N/A MET 229.A N ARG 225.A O no hydrogen 2.892 N/A ILE 230.A N ILE 227.A O no hydrogen 3.216 N/A LYS 232.A N SER 228.A O no hydrogen 2.879 N/A PHE 233.A N MET 229.A O no hydrogen 2.677 N/A VAL 234.A N ILE 230.A O no hydrogen 3.132 N/A LYS 235.A N ILE 230.A O no hydrogen 2.857 N/A PHE 237.A N VAL 234.A O no hydrogen 2.918 N/A LYS 238.A N VAL 234.A O no hydrogen 3.072 N/A LYS 238.A N LYS 235.A O no hydrogen 3.328 N/A TYR 240.A N PHE 237.A O no hydrogen 3.184 N/A ILE 241.A N LYS 238.A O no hydrogen 3.148 N/A