Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8cij_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ARG 22.A O no hydrogen 2.828 N/A LEU 7.A N LYS 20.A O no hydrogen 2.769 N/A GLN 8.A N LYS 20.A O no hydrogen 3.374 N/A LEU 10.A N VAL 18.A O no hydrogen 2.912 N/A THR 14.A N GLY 11.A O no hydrogen 3.445 N/A THR 14.A OG1 GLY 11.A O no hydrogen 2.893 N/A TYR 15.A OH ALA 123.A O no hydrogen 2.705 N/A PHE 19.A N LEU 32.A O no hydrogen 2.890 N/A LYS 20.A N GLN 8.A O no hydrogen 2.829 N/A ALA 21.A N VAL 30.A O no hydrogen 2.964 N/A ARG 22.A N ASP 5.A O no hydrogen 2.990 N/A ASP 23.A N ASP 28.A O no hydrogen 3.114 N/A LYS 24.A N HIS 3.A O no hydrogen 2.906 N/A LYS 24.A NZ ASP 2.A O no hydrogen 2.993 N/A VAL 25.A N ASP 23.A OD1 no hydrogen 2.954 N/A SER 26.A OG ASP 23.A OD2 no hydrogen 2.872 N/A GLY 27.A N ASP 23.A O no hydrogen 2.961 N/A VAL 30.A N ALA 21.A O no hydrogen 2.877 N/A ALA 31.A N MET 73.A O no hydrogen 3.018 N/A LEU 32.A N PHE 19.A O no hydrogen 2.871 N/A LYS 33.A N ILE 71.A O no hydrogen 2.873 N/A MET 34.A N GLU 17.A O no hydrogen 2.890 N/A VAL 35.A N LEU 69.A O no hydrogen 2.951 N/A LYS 36.A NZ GLU 141.A OE2 no hydrogen 3.008 N/A LEU 42.A N VAL 39.A O no hydrogen 3.198 N/A GLN 43.A N VAL 39.A O no hydrogen 3.341 N/A LEU 49.A N ILE 46.A O no hydrogen 2.938 N/A THR 51.A OG1 ILE 48.A O no hydrogen 3.520 N/A ASN 55.A ND2 GLU 102.A OE1 no hydrogen 2.908 N/A ASN 55.A ND2 VAL 133.A O no hydrogen 3.045 N/A ILE 56.A N HIS 53.A O no hydrogen 3.432 N/A VAL 57.A N LEU 135.A O no hydrogen 2.846 N/A ALA 58.A N GLU 74.A OE2 no hydrogen 3.410 N/A HIS 60.A N CYS 72.A O no hydrogen 2.898 N/A TYR 63.A N TRP 70.A O no hydrogen 3.131 N/A TRP 65.A N LYS 68.A O no hydrogen 2.977 N/A LYS 68.A N TRP 65.A O no hydrogen 2.920 N/A LYS 68.A NZ LEU 66.A O no hydrogen 3.336 N/A LEU 69.A N VAL 35.A O no hydrogen 3.275 N/A TRP 70.A N TYR 63.A O no hydrogen 2.796 N/A ILE 71.A N LYS 33.A O no hydrogen 2.885 N/A CYS 72.A N GLY 61.A O no hydrogen 2.886 N/A MET 73.A N ALA 31.A O no hydrogen 2.878 N/A GLY 77.A N ASP 129.A OD1 no hydrogen 3.341 N/A GLY 79.A N CYS 76.A O no hydrogen 3.237 N/A SER 80.A N ASP 83.A OD2 no hydrogen 3.213 N/A LEU 81.A N ILE 125.A O no hydrogen 2.966 N/A ASP 83.A N SER 80.A OG no hydrogen 3.251 N/A ILE 84.A N SER 80.A O no hydrogen 3.149 N/A TYR 85.A N LEU 81.A O no hydrogen 2.791 N/A TYR 85.A OH GLU 177.A OE1 no hydrogen 2.578 N/A GLN 86.A N GLN 82.A O no hydrogen 3.003 N/A VAL 87.A N ILE 84.A O no hydrogen 3.049 N/A THR 88.A N ILE 84.A O no hydrogen 2.912 N/A THR 88.A OG1 ILE 84.A O no hydrogen 3.282 N/A THR 88.A OG1 GLY 89.A O no hydrogen 3.089 N/A GLY 89.A N TYR 85.A O no hydrogen 2.851 N/A LEU 91.A N LEU 178.A O no hydrogen 3.011 N/A SER 92.A N GLN 95.A OE1 no hydrogen 2.837 N/A GLN 95.A N SER 92.A OG no hydrogen 2.917 N/A GLN 95.A NE2 LEU 253.A O no hydrogen 3.177 N/A ILE 96.A N SER 92.A O no hydrogen 2.976 N/A SER 97.A N GLU 93.A O no hydrogen 2.900 N/A SER 97.A OG GLU 93.A O no hydrogen 2.365 N/A TYR 98.A N LEU 94.A O no hydrogen 3.003 N/A VAL 99.A N GLN 95.A O no hydrogen 2.927 N/A CYS 100.A N ILE 96.A O no hydrogen 2.830 N/A CYS 100.A SG ILE 96.A O no hydrogen 3.458 N/A ARG 101.A N SER 97.A O no hydrogen 3.081 N/A ARG 101.A NE GLU 102.A OE2 no hydrogen 3.253 N/A ARG 101.A NH1 LEU 249.A O no hydrogen 3.171 N/A ARG 101.A NH2 GLU 102.A OE2 no hydrogen 3.161 N/A GLU 102.A N TYR 98.A O no hydrogen 3.078 N/A VAL 103.A N VAL 99.A O no hydrogen 2.961 N/A LEU 104.A N CYS 100.A O no hydrogen 2.870 N/A GLN 105.A N ARG 101.A O no hydrogen 2.909 N/A GLN 105.A N GLU 102.A O no hydrogen 3.142 N/A GLN 105.A NE2 ASN 55.A OD1 no hydrogen 3.137 N/A GLN 105.A NE2 GLU 102.A OE2 no hydrogen 2.711 N/A GLY 106.A N GLU 102.A O no hydrogen 3.146 N/A LEU 107.A N VAL 103.A O no hydrogen 2.857 N/A ALA 108.A N LEU 104.A O no hydrogen 3.021 N/A TYR 109.A N GLN 105.A O no hydrogen 3.276 N/A LEU 110.A N GLY 106.A O no hydrogen 2.903 N/A HIS 111.A N LEU 107.A O no hydrogen 2.843 N/A HIS 111.A NE2 ASP 167.A OD2 no hydrogen 2.909 N/A SER 112.A N ALA 108.A O no hydrogen 3.105 N/A SER 112.A OG TYR 109.A O no hydrogen 2.611 N/A GLN 113.A N TYR 109.A O no hydrogen 3.075 N/A GLN 113.A NE2 SER 112.A OG no hydrogen 3.107 N/A LYS 114.A N HIS 111.A O no hydrogen 3.216 N/A LYS 115.A N LEU 110.A O no hydrogen 3.037 N/A LYS 115.A NZ ASP 137.A OD2 no hydrogen 2.728 N/A HIS 117.A N ASP 167.A OD2 no hydrogen 2.931 N/A ARG 118.A N ASP 167.A OD1 no hydrogen 3.031 N/A ASP 119.A N HIS 117.A ND1 no hydrogen 3.098 N/A GLY 122.A N GLU 177.A OE2 no hydrogen 2.923 N/A ASN 124.A N LYS 121.A O no hydrogen 2.874 N/A ASN 124.A ND2 ASP 119.A O no hydrogen 3.163 N/A ILE 125.A N GLY 122.A O no hydrogen 3.461 N/A LEU 126.A N ARG 134.A O no hydrogen 2.838 N/A ILE 127.A N GLY 79.A O no hydrogen 2.864 N/A ASN 128.A N GLU 132.A O no hydrogen 3.095 N/A GLY 131.A N ASN 128.A O no hydrogen 2.923 N/A GLU 132.A N ASN 128.A OD1 no hydrogen 2.834 N/A ARG 134.A N LEU 126.A O no hydrogen 2.846 N/A ARG 134.A NH1 ILE 56.A O no hydrogen 3.459 N/A ARG 134.A NH2 GLU 132.A OE1 no hydrogen 2.912 N/A LEU 135.A N ASN 55.A O no hydrogen 2.910 N/A THR 145.A OG1 ASP 119.A OD1 no hydrogen 3.016 N/A TYR 147.A OH VAL 188.A O no hydrogen 2.676 N/A TRP 148.A N THR 145.A O no hydrogen 2.904 N/A TRP 148.A NE1 GLU 177.A OE2 no hydrogen 2.737 N/A MET 149.A N PRO 146.A O no hydrogen 3.006 N/A GLU 152.A N GLU 152.A OE1 no hydrogen 2.825 N/A VAL 153.A N ALA 150.A O no hydrogen 2.992 N/A ALA 154.A N ALA 150.A O no hydrogen 2.993 N/A ALA 155.A N PRO 151.A O no hydrogen 2.880 N/A ALA 157.A N ALA 154.A O no hydrogen 3.346 N/A LEU 158.A N ALA 155.A O no hydrogen 2.843 N/A LYS 159.A N ALA 155.A O no hydrogen 3.165 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.903 N/A LEU 165.A N ASN 163.A OD1 no hydrogen 3.208 N/A CYS 166.A N ASN 163.A O no hydrogen 3.199 N/A CYS 166.A SG ASN 163.A O no hydrogen 3.171 N/A ASP 167.A N GLU 164.A O no hydrogen 3.338 N/A ILE 168.A N LEU 165.A O no hydrogen 3.348 N/A SER 170.A N CYS 166.A O no hydrogen 2.940 N/A SER 170.A OG TRP 148.A O no hydrogen 3.155 N/A SER 170.A OG CYS 166.A O no hydrogen 3.244 N/A LEU 171.A N ASP 167.A O no hydrogen 3.047 N/A GLY 172.A N ILE 168.A O no hydrogen 3.104 N/A ILE 173.A N TRP 169.A O no hydrogen 2.953 N/A THR 174.A N SER 170.A O no hydrogen 2.902 N/A THR 174.A OG1 SER 170.A O no hydrogen 2.538 N/A ALA 175.A N LEU 171.A O no hydrogen 2.882 N/A ALA 175.A N GLY 172.A O no hydrogen 3.145 N/A ILE 176.A N GLY 172.A O no hydrogen 3.304 N/A GLU 177.A N ILE 173.A O no hydrogen 2.832 N/A LEU 178.A N THR 174.A O no hydrogen 2.854 N/A ALA 179.A N ALA 175.A O no hydrogen 3.255 N/A ALA 179.A N ILE 176.A O no hydrogen 3.159 N/A GLU 180.A N ILE 176.A O no hydrogen 2.883 N/A PHE 186.A N PRO 183.A O no hydrogen 3.265 N/A ASP 187.A N ASP 187.A OD1 no hydrogen 2.731 N/A VAL 188.A N LEU 185.A O no hydrogen 2.930 N/A LEU 191.A N HIS 189.A ND1 no hydrogen 3.047 N/A VAL 193.A N HIS 189.A O no hydrogen 2.910 N/A LEU 194.A N PRO 190.A O no hydrogen 3.065 N/A PHE 195.A N ARG 192.A O no hydrogen 3.152 N/A LEU 196.A N ARG 192.A O no hydrogen 2.891 N/A MET 197.A N VAL 193.A O no hydrogen 3.369 N/A THR 198.A N PHE 195.A O no hydrogen 3.241 N/A THR 198.A OG1 PHE 195.A O no hydrogen 2.530 N/A LYS 199.A N LEU 196.A O no hydrogen 3.332 N/A ARG 206.A NH2 GLN 203.A OE1 no hydrogen 2.907 N/A LYS 208.A N GLU 180.A OE2 no hydrogen 2.892 N/A TRP 213.A N LYS 210.A O no hydrogen 3.490 N/A SER 214.A N GLU 93.A OE1 no hydrogen 2.948 N/A SER 214.A OG GLU 93.A OE2 no hydrogen 2.622 N/A PHE 217.A N SER 214.A OG no hydrogen 3.220 N/A HIS 218.A N SER 214.A O no hydrogen 3.157 N/A HIS 218.A NE2 LYS 210.A O no hydrogen 3.057 N/A ASN 219.A N ALA 215.A O no hydrogen 2.815 N/A PHE 220.A N ALA 216.A O no hydrogen 2.892 N/A ILE 221.A N PHE 217.A O no hydrogen 3.125 N/A LYS 222.A N HIS 218.A O no hydrogen 3.108 N/A VAL 223.A N ASN 219.A O no hydrogen 2.812 N/A THR 224.A N PHE 220.A O no hydrogen 2.913 N/A THR 224.A OG1 PHE 220.A O no hydrogen 2.390 N/A THR 224.A OG1 ILE 221.A O no hydrogen 3.559 N/A LEU 225.A N ILE 221.A O no hydrogen 3.016 N/A THR 226.A OG1 VAL 223.A O no hydrogen 2.363 N/A LYS 231.A N SER 228.A O no hydrogen 3.226 N/A ARG 232.A N PRO 229.A O no hydrogen 3.066 N/A ARG 232.A NE THR 226.A O no hydrogen 2.899 N/A ARG 232.A NH1 GLU 152.A OE1 no hydrogen 3.373 N/A ARG 232.A NH1 GLU 152.A OE2 no hydrogen 2.753 N/A ARG 232.A NH1 LEU 165.A O no hydrogen 3.011 N/A ARG 232.A NH2 GLU 152.A OE1 no hydrogen 2.852 N/A ARG 232.A NH2 THR 226.A O no hydrogen 2.929 N/A SER 234.A OG THR 236.A OG1 no hydrogen 3.239 N/A THR 236.A OG1 SER 234.A OG no hydrogen 3.239 N/A LYS 237.A N SER 234.A OG no hydrogen 3.101 N/A MET 238.A N SER 234.A O no hydrogen 2.909 N/A LEU 239.A N ALA 235.A O no hydrogen 3.162 N/A LEU 239.A N THR 236.A O no hydrogen 3.240 N/A SER 240.A N LYS 237.A O no hydrogen 3.304 N/A SER 240.A OG LYS 237.A O no hydrogen 2.805 N/A HIS 241.A N MET 238.A O no hydrogen 2.946 N/A HIS 241.A NE2 ASN 219.A OD1 no hydrogen 2.764 N/A LEU 243.A N HIS 241.A ND1 no hydrogen 3.173 N/A SER 245.A N HIS 241.A O no hydrogen 2.894 N/A SER 245.A OG HIS 241.A O no hydrogen 3.039 N/A GLN 246.A NE2 LEU 243.A O no hydrogen 2.899 N/A ARG 251.A NE ALA 130.A O no hydrogen 2.782 N/A GLY 252.A N ASN 250.A OD1 no hydrogen 2.904 N/A LEU 253.A N ASN 250.A O no hydrogen 3.093 N/A ILE 254.A N ARG 251.A O no hydrogen 3.021 N/A LEU 255.A N ARG 251.A O no hydrogen 3.039 N/A ASP 256.A N GLY 252.A O no hydrogen 2.894 N/A LEU 257.A N LEU 253.A O no hydrogen 3.323 N/A LEU 258.A N ILE 254.A O no hydrogen 2.824 N/A ASP 259.A N ASP 256.A O no hydrogen 3.089 N/A LYS 260.A N ASP 256.A O no hydrogen 3.195 N/A LEU 261.A N LEU 257.A O no hydrogen 3.075 N/A LYS 262.A N LEU 258.A O no hydrogen 3.319 N/A ASN 263.A N ASP 259.A O no hydrogen 3.032 N/A