Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3x36_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 8.A N GLN 11.A OE1 no hydrogen 2.907 N/A GLN 11.A N SER 8.A OG no hydrogen 2.947 N/A GLN 12.A N SER 8.A O no hydrogen 3.076 N/A ARG 13.A N.A GLU 9.A O no hydrogen 3.150 N/A ARG 13.A N.B GLU 9.A O no hydrogen 3.126 N/A ILE 14.A N GLU 10.A O no hydrogen 2.900 N/A ILE 15.A N GLN 11.A O no hydrogen 3.026 N/A ALA 16.A N GLN 12.A O no hydrogen 2.922 N/A ILE 17.A N ARG 13.A O.A no hydrogen 2.940 N/A ILE 17.A N ARG 13.A O.B no hydrogen 2.780 N/A LEU 18.A N ILE 14.A O no hydrogen 2.899 N/A LEU 19.A N ILE 15.A O no hydrogen 2.880 N/A ASP 20.A N ALA 16.A O no hydrogen 2.959 N/A ALA 21.A N ILE 17.A O no hydrogen 2.877 N/A HIS 22.A N LEU 18.A O no hydrogen 3.038 N/A HIS 22.A NE2 GLU 108.A OE2 no hydrogen 2.838 N/A HIS 23.A N LEU 19.A O no hydrogen 2.960 N/A HIS 23.A NE2 GLU 158.A OE1 no hydrogen 2.763 N/A HIS 23.A NE2 GLU 158.A OE2 no hydrogen 3.232 N/A LYS 24.A N ASP 20.A O no hydrogen 2.983 N/A LYS 24.A N ALA 21.A O no hydrogen 3.214 N/A LYS 24.A NZ ASP 20.A OD1 no hydrogen 2.782 N/A THR 25.A N HIS 22.A O no hydrogen 3.115 N/A THR 25.A OG1 ALA 21.A O no hydrogen 2.749 N/A TYR 26.A OH TYR 30.A OH no hydrogen 2.719 N/A THR 29.A N ASP 27.A OD1 no hydrogen 3.010 N/A THR 29.A OG1 ASP 27.A OD1 no hydrogen 2.636 N/A THR 29.A OG1 ASP 27.A OD2 no hydrogen 3.300 N/A TYR 30.A N ASP 27.A O no hydrogen 3.046 N/A TYR 30.A OH TYR 26.A OH no hydrogen 2.719 N/A SER 31.A N ASP 27.A OD2 no hydrogen 3.014 N/A SER 31.A OG ASP 27.A OD2 no hydrogen 2.764 N/A PHE 33.A N TYR 30.A O no hydrogen 3.191 N/A CYS 34.A SG SER 31.A O no hydrogen 3.628 N/A GLN 35.A N ASP 32.A O no hydrogen 2.814 N/A PHE 36.A N PHE 33.A O no hydrogen 3.105 N/A ARG 37.A N ASP 63.A OD1 no hydrogen 2.899 N/A ARG 37.A NE ASP 63.A OD1 no hydrogen 2.863 N/A ARG 37.A NE ASP 63.A OD2 no hydrogen 3.399 N/A ARG 37.A NH1 MET 243.A O no hydrogen 2.968 N/A ARG 37.A NH2 ASP 63.A OD2 no hydrogen 2.648 N/A ARG 37.A NH2 LYS 244.A O no hydrogen 3.350 N/A ARG 37.A NH2 LEU 245.A O no hydrogen 2.981 N/A ARG 41.A NE ASP 130.A OD1 no hydrogen 2.791 N/A ARG 41.A NH1 ASP 123.A O no hydrogen 2.794 N/A ARG 41.A NH2 ASP 123.A O no hydrogen 2.954 N/A ARG 41.A NH2 ASP 130.A OD2 no hydrogen 3.377 N/A ASN 43.A ND2 ASN 43.A O no hydrogen 3.136 N/A LEU 50.A N SER 47.A OG no hydrogen 3.254 N/A LEU 52.A N VAL 48.A O no hydrogen 2.925 N/A SER 53.A N THR 49.A O no hydrogen 2.863 N/A LEU 55.A N GLU 51.A O no hydrogen 2.644 N/A SER 56.A OG VAL 40.A O no hydrogen 2.683 N/A MET 57.A N LYS 133.A O no hydrogen 3.393 N/A LEU 58.A N LEU 55.A O no hydrogen 3.073 N/A HIS 60.A ND1 ARG 37.A O no hydrogen 2.766 N/A HIS 60.A NE2 TYR 126.A OH no hydrogen 2.730 N/A LEU 61.A N MET 57.A O no hydrogen 3.014 N/A ALA 62.A N LEU 58.A O no hydrogen 2.717 N/A ASP 63.A N PRO 59.A O no hydrogen 3.032 N/A LEU 64.A N HIS 60.A O no hydrogen 2.896 N/A VAL 65.A N LEU 61.A O no hydrogen 2.958 N/A SER 66.A N ALA 62.A O no hydrogen 2.728 N/A SER 66.A OG THR 246.A OG1 no hydrogen 2.773 N/A TYR 67.A N ASP 63.A O no hydrogen 2.936 N/A TYR 67.A OH ASP 32.A OD2 no hydrogen 2.801 N/A SER 68.A N LEU 64.A O no hydrogen 3.017 N/A SER 68.A OG LEU 64.A O no hydrogen 2.828 N/A ILE 69.A N VAL 65.A O no hydrogen 2.851 N/A GLN 70.A N SER 66.A O no hydrogen 3.153 N/A LYS 71.A N TYR 67.A O no hydrogen 3.122 N/A VAL 72.A N SER 68.A O no hydrogen 2.892 N/A ILE 73.A N ILE 69.A O no hydrogen 2.870 N/A GLY 74.A N GLN 70.A O no hydrogen 2.985 N/A PHE 75.A N LYS 71.A O no hydrogen 2.740 N/A ALA 76.A N VAL 72.A O no hydrogen 2.859 N/A LYS 77.A N ILE 73.A O no hydrogen 3.157 N/A LYS 77.A NZ.C ILE 73.A O no hydrogen 2.974 N/A MET 78.A N PHE 75.A O no hydrogen 3.025 N/A ILE 79.A N ALA 76.A O no hydrogen 2.887 N/A PHE 82.A N ILE 79.A O no hydrogen 2.923 N/A ASP 84.A N GLY 81.A O no hydrogen 2.845 N/A LEU 85.A N PHE 82.A O no hydrogen 3.095 N/A ASP 89.A N THR 86.A OG1 no hydrogen 3.167 N/A GLN 90.A N THR 86.A O no hydrogen 2.875 N/A GLN 90.A NE2 LEU 85.A O no hydrogen 2.889 N/A ILE 91.A N SER 87.A O no hydrogen 2.955 N/A VAL 92.A N GLU 88.A O.A no hydrogen 3.035 N/A VAL 92.A N GLU 88.A O.B no hydrogen 3.185 N/A LEU 93.A N ASP 89.A O no hydrogen 2.946 N/A LEU 94.A N GLN 90.A O no hydrogen 3.011 N/A LYS 95.A N ILE 91.A O no hydrogen 2.958 N/A LYS 95.A NZ GLU 251.A OE1 no hydrogen 2.597 N/A SER 96.A N VAL 92.A O no hydrogen 3.031 N/A SER 96.A OG VAL 92.A O no hydrogen 2.867 N/A SER 96.A OG LEU 93.A O no hydrogen 3.317 N/A SER 97.A N LEU 93.A O no hydrogen 2.915 N/A SER 97.A OG LEU 93.A O no hydrogen 2.692 N/A ALA 98.A N LEU 94.A O no hydrogen 2.953 N/A VAL 101.A N SER 97.A O no hydrogen 2.872 N/A ILE 102.A N ALA 98.A O no hydrogen 2.898 N/A MET 103.A N ILE 99.A O no hydrogen 2.963 N/A LEU 104.A N GLU 100.A O no hydrogen 2.920 N/A ARG 105.A N VAL 101.A O no hydrogen 2.861 N/A ARG 105.A NH2 THR 25.A O no hydrogen 2.968 N/A SER 106.A N ILE 102.A O no hydrogen 2.885 N/A SER 106.A OG MET 103.A O no hydrogen 2.647 N/A ASN 107.A N LEU 104.A O no hydrogen 2.951 N/A ASN 107.A ND2 GLN 148.A O no hydrogen 3.044 N/A ASN 107.A ND2 GLN 148.A OE1 no hydrogen 2.774 N/A GLU 108.A N ARG 105.A O no hydrogen 3.162 N/A SER 109.A N SER 106.A O no hydrogen 3.030 N/A SER 109.A OG SER 106.A O no hydrogen 3.061 N/A PHE 110.A N SER 106.A O no hydrogen 3.189 N/A THR 111.A N SER 116.A O no hydrogen 2.766 N/A ASP 113.A N THR 111.A OG1 no hydrogen 2.981 N/A SER 116.A N THR 111.A O no hydrogen 3.282 N/A SER 116.A OG ASP 114.A OD1 no hydrogen 2.771 N/A SER 116.A OG THR 118.A OG1 no hydrogen 2.616 N/A TRP 117.A N TYR 126.A O no hydrogen 3.080 N/A TRP 117.A NE1 SER 106.A OG no hydrogen 3.071 N/A THR 118.A N SER 109.A O no hydrogen 2.899 N/A THR 118.A OG1 SER 116.A OG no hydrogen 2.616 N/A CYS 119.A N TYR 124.A O no hydrogen 2.908 N/A ASN 121.A ND2 ASN 121.A O no hydrogen 3.223 N/A LYS 125.A N GLN 122.A O no hydrogen 3.377 N/A LYS 125.A NZ ASP 114.A OD2 no hydrogen 2.811 N/A LYS 125.A NZ THR 118.A OG1 no hydrogen 3.018 N/A TYR 126.A N TRP 117.A O no hydrogen 2.871 N/A TYR 126.A OH HIS 60.A NE2 no hydrogen 2.730 N/A ARG 127.A N ASP 130.A OD2 no hydrogen 2.800 N/A ASP 130.A N ARG 127.A O no hydrogen 2.844 N/A VAL 131.A N ARG 127.A O no hydrogen 3.319 N/A VAL 131.A N VAL 128.A O no hydrogen 3.031 N/A THR 132.A N VAL 128.A O no hydrogen 3.206 N/A THR 132.A OG1 SER 129.A O no hydrogen 2.846 N/A LYS 133.A N SER 129.A O no hydrogen 3.191 N/A LYS 133.A NZ VAL 42.A O no hydrogen 3.231 N/A LYS 133.A NZ ASP 44.A OD1 no hydrogen 2.857 N/A ALA 134.A N VAL 131.A O no hydrogen 3.288 N/A GLY 135.A N THR 132.A O no hydrogen 3.096 N/A HIS 136.A N VAL 131.A O no hydrogen 3.409 N/A HIS 136.A ND1 GLN 231.A OE1 no hydrogen 2.957 N/A SER 137.A N GLN 231.A OE1 no hydrogen 2.927 N/A GLU 139.A N.A GLU 139.A OE2.A no hydrogen 3.074 N/A LEU 140.A N SER 137.A O no hydrogen 2.962 N/A ILE 141.A N SER 137.A O no hydrogen 3.133 N/A GLU 142.A N LEU 138.A O no hydrogen 2.878 N/A LEU 144.A N LEU 140.A O no hydrogen 3.031 N/A ILE 145.A N ILE 141.A O no hydrogen 2.963 N/A LYS 146.A N.A GLU 142.A O no hydrogen 3.068 N/A LYS 146.A N.B GLU 142.A O no hydrogen 3.105 N/A LYS 146.A NZ.A GLU 142.A O no hydrogen 2.622 N/A PHE 147.A N PRO 143.A O no hydrogen 3.005 N/A GLN 148.A N LEU 144.A O no hydrogen 3.036 N/A GLN 148.A NE2 MET 103.A O no hydrogen 3.024 N/A VAL 149.A N ILE 145.A O no hydrogen 2.949 N/A GLY 150.A N LYS 146.A O.A no hydrogen 2.891 N/A GLY 150.A N LYS 146.A O.B no hydrogen 2.860 N/A LEU 151.A N PHE 147.A O no hydrogen 2.960 N/A LYS 152.A N GLN 148.A O no hydrogen 2.948 N/A LYS 152.A NZ ASN 107.A O no hydrogen 2.818 N/A LYS 152.A NZ PHE 110.A O no hydrogen 2.858 N/A LYS 153.A N VAL 149.A O no hydrogen 3.015 N/A LEU 154.A N LEU 151.A O no hydrogen 3.163 N/A ASN 155.A N LYS 152.A O no hydrogen 3.107 N/A HIS 157.A N GLU 160.A OE2 no hydrogen 2.824 N/A HIS 157.A ND1 TYR 197.A OH no hydrogen 2.587 N/A GLU 159.A N GLU 159.A OE2 no hydrogen 2.715 N/A HIS 161.A N HIS 157.A O no hydrogen 3.088 N/A VAL 162.A N GLU 158.A O no hydrogen 3.016 N/A LEU 163.A N GLU 159.A O no hydrogen 3.101 N/A LEU 164.A N GLU 160.A O no hydrogen 2.829 N/A MET 165.A N HIS 161.A O no hydrogen 2.966 N/A ALA 166.A N VAL 162.A O no hydrogen 3.070 N/A ILE 167.A N LEU 163.A O no hydrogen 2.943 N/A CYS 168.A N LEU 164.A O no hydrogen 2.974 N/A CYS 168.A SG GLU 100.A OE1 no hydrogen 3.325 N/A ILE 169.A N MET 165.A O no hydrogen 3.057 N/A VAL 170.A N ALA 166.A O no hydrogen 2.951 N/A SER 171.A OG ILE 167.A O no hydrogen 3.387 N/A SER 171.A OG CYS 168.A O no hydrogen 2.735 N/A ARG 174.A NH1 GLU 100.A OE1 no hydrogen 3.482 N/A ARG 174.A NH1 GLU 100.A OE2 no hydrogen 2.907 N/A ARG 174.A NH2 GLU 100.A OE1 no hydrogen 2.945 N/A ARG 174.A NH2 CYS 168.A O no hydrogen 3.092 N/A VAL 177.A N ARG 174.A O no hydrogen 3.470 N/A GLN 178.A N.A ASP 89.A OD2 no hydrogen 2.752 N/A GLN 178.A N.B ASP 89.A OD2 no hydrogen 2.788 N/A GLN 178.A NE2.A GLY 176.A O no hydrogen 3.386 N/A ASP 179.A N ASP 89.A OD1 no hydrogen 3.093 N/A ALA 180.A N GLN 178.A O.A no hydrogen 2.933 N/A LEU 182.A N ASP 179.A OD2 no hydrogen 2.940 N/A ILE 183.A N ASP 179.A O no hydrogen 3.176 N/A GLU 184.A N ALA 180.A O no hydrogen 2.876 N/A ALA 185.A N ALA 181.A O no hydrogen 2.909 N/A ILE 186.A N LEU 182.A O no hydrogen 2.912 N/A GLN 187.A N ILE 183.A O no hydrogen 2.923 N/A GLN 187.A NE2 ILE 167.A O no hydrogen 3.144 N/A ASP 188.A N GLU 184.A O no hydrogen 2.799 N/A ARG 189.A N ALA 185.A O no hydrogen 3.265 N/A LEU 190.A N ILE 186.A O no hydrogen 3.305 N/A SER 191.A N GLN 187.A O no hydrogen 2.748 N/A SER 191.A OG GLN 187.A O no hydrogen 2.950 N/A ASN 192.A N ASP 188.A O no hydrogen 2.761 N/A THR 193.A N ARG 189.A O no hydrogen 3.072 N/A THR 193.A OG1 ARG 189.A O no hydrogen 2.644 N/A LEU 194.A N LEU 190.A O no hydrogen 2.908 N/A GLN 195.A N SER 191.A O no hydrogen 2.880 N/A THR 196.A N ASN 192.A O no hydrogen 3.065 N/A THR 196.A OG1 ASN 192.A O no hydrogen 2.792 N/A TYR 197.A N THR 193.A O no hydrogen 2.923 N/A TYR 197.A OH HIS 157.A ND1 no hydrogen 2.587 N/A ILE 198.A N LEU 194.A O no hydrogen 2.948 N/A ARG 199.A N GLN 195.A O no hydrogen 3.111 N/A CYS 200.A N THR 196.A O no hydrogen 2.846 N/A CYS 200.A SG PRO 5.A O no hydrogen 3.797 N/A CYS 200.A SG THR 196.A O no hydrogen 3.378 N/A ARG 201.A N TYR 197.A O no hydrogen 2.652 N/A HIS 202.A N ILE 198.A O no hydrogen 3.107 N/A HIS 202.A ND1 GLU 160.A OE1 no hydrogen 2.536 N/A SER 207.A OG PRO 203.A O no hydrogen 3.247 N/A LEU 210.A N SER 207.A O no hydrogen 2.995 N/A LYS 213.A N LEU 209.A O no hydrogen 3.117 N/A MET 214.A N LEU 210.A O no hydrogen 3.002 N/A ILE 215.A N TYR 211.A O no hydrogen 3.040 N/A GLN 216.A N ALA 212.A O no hydrogen 2.981 N/A LYS 217.A N LYS 213.A O no hydrogen 3.150 N/A LEU 218.A N MET 214.A O no hydrogen 3.303 N/A LEU 218.A N ILE 215.A O no hydrogen 3.107 N/A ALA 219.A N ILE 215.A O no hydrogen 3.209 N/A ASP 220.A N GLN 216.A O no hydrogen 2.860 N/A LEU 221.A N LYS 217.A O no hydrogen 2.995 N/A ARG 222.A N LEU 218.A O no hydrogen 3.159 N/A ARG 222.A NH2 ASP 173.A OD2 no hydrogen 2.938 N/A SER 223.A N ALA 219.A O no hydrogen 3.363 N/A LEU 224.A N ASP 220.A O no hydrogen 3.082 N/A ASN 225.A N LEU 221.A O no hydrogen 2.799 N/A ASN 225.A ND2 SER 96.A O no hydrogen 3.103 N/A ASN 225.A ND2 GLU 100.A OE2 no hydrogen 2.985 N/A GLU 226.A N.A ARG 222.A O no hydrogen 3.138 N/A GLU 226.A N.B ARG 222.A O no hydrogen 3.092 N/A GLU 227.A N SER 223.A O no hydrogen 3.104 N/A HIS 228.A N LEU 224.A O no hydrogen 2.841 N/A SER 229.A N ASN 225.A O no hydrogen 3.039 N/A LYS 230.A N GLU 226.A O.A no hydrogen 3.016 N/A LYS 230.A N GLU 226.A O.B no hydrogen 3.151 N/A LYS 230.A NZ GLU 226.A OE2.A no hydrogen 2.621 N/A GLN 231.A N GLU 227.A O no hydrogen 2.987 N/A GLN 231.A NE2 GLU 227.A OE1 no hydrogen 2.728 N/A TYR 232.A N HIS 228.A O no hydrogen 2.792 N/A ARG 233.A N.A SER 229.A O no hydrogen 3.033 N/A ARG 233.A N.B SER 229.A O no hydrogen 3.035 N/A CYS 234.A N LYS 230.A O no hydrogen 3.385 N/A CYS 234.A SG LYS 230.A O no hydrogen 3.398 N/A LEU 235.A N GLN 231.A O no hydrogen 2.821 N/A SER 236.A N TYR 232.A O no hydrogen 2.782 N/A SER 236.A OG ARG 233.A O.A no hydrogen 2.576 N/A SER 236.A OG ARG 233.A O.B no hydrogen 2.547 N/A PHE 237.A N CYS 234.A O no hydrogen 2.968 N/A GLN 238.A N LEU 235.A O no hydrogen 2.955 N/A CYS 241.A N GLN 238.A O no hydrogen 2.887 N/A CYS 241.A SG LEU 235.A O no hydrogen 3.655 N/A LYS 244.A N CYS 241.A O no hydrogen 2.888 N/A LEU 245.A N SER 242.A O no hydrogen 3.039 N/A THR 246.A OG1 SER 66.A OG no hydrogen 2.773 N/A VAL 249.A N THR 246.A OG1 no hydrogen 3.056 N/A LEU 250.A N THR 246.A O no hydrogen 2.900 N/A GLU 251.A N PRO 247.A O no hydrogen 3.023 N/A VAL 252.A N LEU 248.A O no hydrogen 3.010 N/A PHE 253.A N VAL 249.A O no hydrogen 2.936 N/A