Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6c6i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N PHE 10.A O no hydrogen 2.850 N/A ARG 4.A NE GLY 6.A O no hydrogen 3.212 N/A PHE 5.A N LEU 8.A O no hydrogen 3.285 N/A ASP 7.A N GLN 59.A OE1 no hydrogen 2.905 N/A LEU 8.A N PHE 5.A O no hydrogen 3.075 N/A VAL 9.A N THR 21.A O no hydrogen 3.008 N/A PHE 10.A N GLN 3.A O no hydrogen 2.784 N/A ARG 11.A N GLN 19.A O no hydrogen 2.967 N/A ARG 11.A NE ASP 2.A OD1 no hydrogen 2.684 N/A ARG 11.A NH1 ASP 2.A OD1 no hydrogen 3.225 N/A ARG 11.A NH1 ASP 2.A OD2 no hydrogen 3.160 N/A GLN 12.A NE2 ALA 14.A O no hydrogen 3.158 N/A GLN 12.A NE2 PRO 15.A O no hydrogen 3.061 N/A LEU 13.A N VAL 17.A O no hydrogen 2.815 N/A ALA 14.A N VAL 17.A O no hydrogen 3.165 N/A VAL 17.A N ALA 14.A O no hydrogen 3.142 N/A TRP 18.A N ILE 38.A O no hydrogen 2.868 N/A GLN 19.A N ARG 11.A O no hydrogen 2.754 N/A HIS 20.A N GLY 36.A O no hydrogen 2.854 N/A HIS 20.A NE2 ASP 49.A O no hydrogen 2.883 N/A THR 21.A N VAL 9.A O no hydrogen 2.776 N/A THR 21.A OG1 ASN 35.A OD1 no hydrogen 2.694 N/A SER 22.A N SER 34.A O no hydrogen 3.124 N/A GLU 24.A N VAL 32.A O no hydrogen 3.336 N/A VAL 26.A N GLY 30.A O no hydrogen 2.774 N/A TRP 29.A N VAL 26.A O no hydrogen 2.977 N/A GLY 30.A N VAL 26.A O no hydrogen 3.055 N/A VAL 32.A N GLU 24.A O no hydrogen 2.930 N/A SER 34.A N SER 22.A O no hydrogen 2.799 N/A SER 34.A OG ASP 83.A O no hydrogen 3.253 N/A ASN 35.A N SER 208.A O no hydrogen 2.763 N/A ASN 35.A ND2 MET 207.A O no hydrogen 2.974 N/A GLY 36.A N HIS 20.A O no hydrogen 2.851 N/A LEU 37.A N VAL 48.A O no hydrogen 2.956 N/A ILE 38.A N TRP 18.A O no hydrogen 2.815 N/A VAL 39.A N LEU 46.A O no hydrogen 2.780 N/A ARG 40.A N ASN 16.A O no hydrogen 2.890 N/A ARG 40.A NE ASN 16.A OD1 no hydrogen 2.851 N/A ARG 40.A NH2 ASN 16.A OD1 no hydrogen 3.184 N/A ASP 41.A N ARG 44.A O no hydrogen 2.786 N/A ARG 44.A N ASP 41.A O no hydrogen 3.268 N/A ARG 44.A NE ASP 41.A OD2 no hydrogen 3.004 N/A ARG 44.A NH1 ASN 135.A O no hydrogen 2.916 N/A ARG 44.A NH2 ASP 41.A OD2 no hydrogen 2.881 N/A ARG 44.A NH2 ASN 135.A O no hydrogen 2.803 N/A VAL 45.A N PRO 71.A O no hydrogen 2.828 N/A LEU 46.A N VAL 39.A O no hydrogen 2.795 N/A VAL 47.A N LEU 74.A O no hydrogen 3.028 N/A VAL 48.A N LEU 37.A O no hydrogen 2.853 N/A ASP 49.A N VAL 76.A O no hydrogen 2.771 N/A THR 50.A N LYS 84.A O no hydrogen 2.931 N/A THR 50.A OG1 ALA 51.A O no hydrogen 2.701 N/A ALA 51.A N THR 57.A OG1 no hydrogen 3.071 N/A TRP 52.A NE1 SER 22.A O no hydrogen 3.156 N/A THR 53.A N GLN 56.A OE1 no hydrogen 3.163 N/A GLN 56.A N THR 53.A OG1 no hydrogen 3.061 N/A GLN 56.A NE2 PHE 23.A O no hydrogen 2.989 N/A THR 57.A N THR 53.A O no hydrogen 2.954 N/A THR 57.A OG1 THR 53.A O no hydrogen 2.807 N/A ALA 58.A N ASP 54.A O no hydrogen 2.917 N/A GLN 59.A N ASP 55.A O no hydrogen 3.200 N/A GLN 59.A NE2 ASP 7.A OD2 no hydrogen 3.448 N/A GLN 59.A NE2 ASP 55.A OD2 no hydrogen 3.233 N/A ILE 60.A N GLN 56.A O no hydrogen 3.166 N/A LEU 61.A N THR 57.A O no hydrogen 3.093 N/A ASN 62.A N ALA 58.A O no hydrogen 2.937 N/A ASN 62.A ND2 ALA 58.A O no hydrogen 2.813 N/A TRP 63.A N GLN 59.A O no hydrogen 2.973 N/A ILE 64.A N ILE 60.A O no hydrogen 2.942 N/A LYS 65.A N LEU 61.A O no hydrogen 3.031 N/A LYS 65.A NZ ASN 69.A OD1 no hydrogen 2.910 N/A GLN 66.A N ASN 62.A O no hydrogen 3.051 N/A GLN 66.A NE2 GLU 67.A OE2 no hydrogen 3.351 N/A GLU 67.A N TRP 63.A O no hydrogen 2.851 N/A ILE 68.A N ILE 64.A O no hydrogen 2.850 N/A ASN 69.A N ILE 64.A O no hydrogen 2.885 N/A ALA 73.A N VAL 45.A O no hydrogen 2.923 N/A ALA 75.A N ALA 97.A O no hydrogen 3.008 N/A VAL 76.A N VAL 47.A O no hydrogen 2.932 N/A VAL 77.A N TYR 99.A O no hydrogen 3.036 N/A THR 78.A N ASP 49.A OD1 no hydrogen 2.744 N/A THR 78.A OG1 ASP 49.A OD1 no hydrogen 2.973 N/A THR 78.A OG1 ASP 49.A OD2 no hydrogen 3.036 N/A HIS 79.A NE2 HIS 81.A ND1 no hydrogen 3.128 N/A ALA 80.A N ASP 151.A OD2 no hydrogen 2.915 N/A HIS 81.A N HIS 79.A O no hydrogen 3.038 N/A HIS 81.A NE2 ASP 182.A OD2 no hydrogen 2.808 N/A GLN 82.A NE2 GLU 24.A OE2 no hydrogen 2.800 N/A GLN 82.A NE2 TRP 52.A O no hydrogen 3.074 N/A LYS 84.A N HIS 81.A O no hydrogen 3.042 N/A LYS 84.A NZ ASP 49.A OD2 no hydrogen 2.881 N/A LYS 84.A NZ SER 208.A OG no hydrogen 2.900 N/A MET 85.A N HIS 81.A O no hydrogen 2.933 N/A GLY 86.A N GLN 82.A O no hydrogen 2.827 N/A GLY 87.A N THR 50.A OG1 no hydrogen 3.034 N/A MET 88.A N MET 85.A O no hydrogen 3.491 N/A ALA 90.A N ASP 54.A OD1 no hydrogen 3.273 N/A ALA 90.A N GLY 87.A O no hydrogen 3.010 N/A LEU 91.A N GLY 87.A O no hydrogen 3.404 N/A HIS 92.A N MET 88.A O no hydrogen 2.988 N/A HIS 92.A NE2 THR 98.A OG1 no hydrogen 2.749 N/A ALA 93.A N ASP 89.A O no hydrogen 2.846 N/A ALA 94.A N ALA 90.A O no hydrogen 3.253 N/A ALA 94.A N LEU 91.A O no hydrogen 3.229 N/A GLY 95.A N HIS 92.A O no hydrogen 2.955 N/A ILE 96.A N LEU 91.A O no hydrogen 3.069 N/A THR 98.A N GLN 117.A OE1 no hydrogen 3.299 N/A THR 98.A OG1 HIS 92.A NE2 no hydrogen 2.749 N/A TYR 99.A N ALA 75.A O no hydrogen 2.918 N/A ALA 100.A N HIS 118.A O no hydrogen 3.158 N/A ASN 101.A ND2 ASP 151.A O no hydrogen 3.095 N/A ALA 102.A N LEU 120.A O no hydrogen 2.879 N/A LEU 103.A N ASN 101.A OD1 no hydrogen 3.257 N/A SER 104.A OG ASP 151.A OD2 no hydrogen 2.561 N/A ASN 105.A N ASN 101.A O no hydrogen 3.112 N/A ASN 105.A ND2 HIS 118.A O no hydrogen 3.128 N/A ASN 105.A ND2 SER 119.A OG no hydrogen 2.907 N/A GLN 106.A N ALA 102.A O no hydrogen 2.892 N/A LEU 107.A N LEU 103.A O no hydrogen 2.869 N/A ALA 108.A N SER 104.A O no hydrogen 2.834 N/A GLN 110.A NE2 GLN 106.A O no hydrogen 3.622 N/A GLU 111.A N LEU 107.A O no hydrogen 3.103 N/A GLY 112.A N PRO 109.A O no hydrogen 3.069 N/A MET 113.A N ALA 108.A O no hydrogen 2.895 N/A ALA 116.A N ASN 105.A OD1 no hydrogen 2.888 N/A GLN 117.A N THR 98.A OG1 no hydrogen 2.845 N/A HIS 118.A N THR 98.A O no hydrogen 2.948 N/A LEU 120.A N ALA 100.A O no hydrogen 2.771 N/A THR 121.A N THR 132.A OG1 no hydrogen 3.311 N/A THR 121.A OG1 GLU 129.A OE2 no hydrogen 2.652 N/A ALA 123.A N TRP 127.A O no hydrogen 2.952 N/A GLY 126.A N ALA 123.A O no hydrogen 2.897 N/A TRP 127.A N ASN 125.A OD1 no hydrogen 3.135 N/A VAL 128.A N VAL 141.A O no hydrogen 3.108 N/A GLU 129.A N THR 121.A O no hydrogen 2.804 N/A THR 132.A N GLU 129.A O no hydrogen 2.916 N/A THR 132.A OG1 GLU 129.A O no hydrogen 2.817 N/A ALA 133.A N PRO 130.A O no hydrogen 3.094 N/A LEU 139.A N PHE 136.A O no hydrogen 2.993 N/A LYS 140.A N GLY 156.A O no hydrogen 2.848 N/A PHE 142.A N THR 154.A O no hydrogen 3.008 N/A TYR 143.A N GLY 126.A O no hydrogen 2.713 N/A TYR 143.A OH SER 150.A O no hydrogen 2.713 N/A GLY 147.A N THR 149.A O no hydrogen 2.983 N/A THR 149.A OG1 ASP 151.A OD1 no hydrogen 2.757 N/A ILE 153.A N THR 78.A O no hydrogen 2.915 N/A THR 154.A N PHE 142.A O no hydrogen 2.878 N/A THR 154.A OG1 PHE 142.A O no hydrogen 2.958 N/A VAL 155.A N PHE 164.A O no hydrogen 3.090 N/A GLY 156.A N LYS 140.A O no hydrogen 2.831 N/A ILE 157.A N ILE 162.A O no hydrogen 3.201 N/A ASP 158.A N PRO 138.A O no hydrogen 2.805 N/A THR 160.A N ILE 157.A O no hydrogen 3.272 N/A THR 160.A OG1 ILE 157.A O no hydrogen 2.799 N/A ILE 162.A N THR 160.A OG1 no hydrogen 3.153 N/A ALA 163.A N MET 204.A O no hydrogen 3.069 N/A PHE 164.A N VAL 155.A O no hydrogen 2.753 N/A GLY 165.A N VAL 206.A O no hydrogen 2.884 N/A CYS 167.A SG ASP 83.A OD2 no hydrogen 3.452 N/A CYS 167.A SG SER 208.A OG no hydrogen 3.120 N/A CYS 167.A SG HIS 209.A NE2 no hydrogen 3.529 N/A LEU 168.A N GLY 165.A O no hydrogen 3.177 N/A LYS 170.A N THR 221.A OG1 no hydrogen 2.925 N/A LYS 170.A NZ CYS 167.A O no hydrogen 2.834 N/A SER 172.A N ASP 213.A OD2 no hydrogen 2.798 N/A SER 172.A OG ASP 213.A OD1 no hydrogen 3.523 N/A SER 172.A OG ASP 213.A OD2 no hydrogen 2.841 N/A LYS 173.A N ASP 171.A OD2 no hydrogen 2.979 N/A ALA 174.A N ASP 171.A O no hydrogen 3.097 N/A GLY 178.A N SER 176.A OG no hydrogen 3.125 N/A ALA 183.A N LEU 180.A O no hydrogen 3.126 N/A ASP 184.A N GLY 147.A O no hydrogen 2.820 N/A HIS 187.A N ASP 184.A OD1 no hydrogen 2.991 N/A HIS 187.A ND1 ASP 184.A OD2 no hydrogen 2.861 N/A TYR 188.A OH LEU 168.A O no hydrogen 2.642 N/A SER 191.A N HIS 187.A O no hydrogen 2.861 N/A SER 191.A OG PRO 144.A O no hydrogen 3.498 N/A SER 191.A OG PRO 146.A O no hydrogen 2.735 N/A SER 191.A OG HIS 187.A O no hydrogen 3.073 N/A ALA 192.A N TYR 188.A O no hydrogen 2.830 N/A ARG 193.A N ALA 189.A O no hydrogen 3.010 N/A ARG 193.A NH1 ASP 226.A OD1 no hydrogen 3.088 N/A ARG 193.A NH1 ASP 226.A OD2 no hydrogen 3.404 N/A ARG 193.A NH2 ASP 226.A OD2 no hydrogen 2.780 N/A ALA 194.A N ALA 190.A O no hydrogen 2.812 N/A PHE 195.A N SER 191.A O no hydrogen 3.109 N/A GLY 196.A N ALA 192.A O no hydrogen 3.250 N/A ALA 197.A N ARG 193.A O no hydrogen 2.886 N/A ALA 198.A N ALA 194.A O no hydrogen 2.862 N/A ALA 198.A N PHE 195.A O no hydrogen 3.193 N/A PHE 199.A N PHE 195.A O no hydrogen 3.290 N/A ALA 202.A N PHE 199.A O no hydrogen 3.436 N/A SER 203.A N ASP 161.A O no hydrogen 2.996 N/A MET 204.A N ASP 161.A O no hydrogen 2.884 N/A ILE 205.A N ASP 213.A O no hydrogen 2.793 N/A VAL 206.A N ALA 163.A O no hydrogen 2.936 N/A SER 208.A N GLY 166.A O no hydrogen 2.996 N/A HIS 209.A ND1 PRO 33.A O no hydrogen 2.709 N/A SER 210.A OG ASP 171.A OD1 no hydrogen 2.705 N/A ASP 213.A N ILE 205.A O no hydrogen 2.882 N/A SER 214.A N ASP 213.A OD1 no hydrogen 2.862 N/A ARG 215.A NH1 PHE 199.A O no hydrogen 2.773 N/A ARG 215.A NH1 ALA 202.A O no hydrogen 2.905 N/A ARG 215.A NH2 GLY 196.A O no hydrogen 2.937 N/A ALA 216.A N SER 214.A OG no hydrogen 3.148 N/A ALA 217.A N SER 214.A O no hydrogen 3.100 N/A ILE 218.A N ARG 215.A O no hydrogen 2.910 N/A THR 219.A N ARG 215.A O no hydrogen 3.286 N/A THR 219.A OG1 ARG 215.A O no hydrogen 3.380 N/A HIS 220.A N ALA 216.A O no hydrogen 2.878 N/A HIS 220.A NE2 ALA 174.A O no hydrogen 2.688 N/A THR 221.A N ALA 217.A O no hydrogen 2.946 N/A THR 221.A OG1 ALA 217.A O no hydrogen 2.737 N/A ALA 222.A N ILE 218.A O no hydrogen 2.973 N/A ARG 223.A N THR 219.A O no hydrogen 2.991 N/A MET 224.A N HIS 220.A O no hydrogen 2.919 N/A ALA 225.A N THR 221.A O no hydrogen 2.951 N/A ASP 226.A N ALA 222.A O no hydrogen 2.914 N/A LYS 227.A N MET 224.A O no hydrogen 3.220 N/A LEU 228.A N ALA 225.A O no hydrogen 3.008 N/A