Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8c40_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N GLY 1.A O no hydrogen 2.991 N/A MET 6.A N MET 3.A O no hydrogen 3.073 N/A ARG 8.A NH1 GLU 45.A OE1 no hydrogen 3.502 N/A ARG 8.A NH1 GLU 45.A OE2 no hydrogen 2.940 N/A ARG 8.A NH2 GLU 45.A OE1 no hydrogen 2.761 N/A LEU 11.A N GLU 7.A O no hydrogen 2.937 N/A ILE 12.A N.A ARG 8.A O no hydrogen 3.074 N/A ILE 12.A N.B ARG 8.A O no hydrogen 3.086 N/A GLN 13.A N ALA 9.A O no hydrogen 2.908 N/A LYS 14.A N SER 10.A O no hydrogen 2.861 N/A ALA 15.A N LEU 11.A O no hydrogen 2.822 N/A LYS 16.A N ILE 12.A O.A no hydrogen 3.094 N/A LYS 16.A N ILE 12.A O.B no hydrogen 3.079 N/A LYS 16.A NZ GLU 44.A OE1 no hydrogen 3.296 N/A LEU 17.A N GLN 13.A O no hydrogen 3.075 N/A ALA 18.A N LYS 14.A O no hydrogen 2.776 N/A GLU 19.A N ALA 15.A O no hydrogen 2.949 N/A GLN 20.A N LYS 16.A O no hydrogen 3.132 N/A GLN 20.A NE2 LYS 16.A O no hydrogen 3.659 N/A ALA 21.A N LEU 17.A O no hydrogen 2.996 N/A GLU 22.A N GLU 19.A O no hydrogen 3.000 N/A ARG 23.A N ALA 18.A O no hydrogen 2.855 N/A ARG 23.A NE ASP 26.A OD2 no hydrogen 2.978 N/A ARG 23.A NH2 ASP 26.A OD2 no hydrogen 2.851 N/A MET 27.A N ARG 23.A O no hydrogen 2.932 N/A ALA 28.A N TYR 24.A O no hydrogen 2.876 N/A ALA 29.A N GLU 25.A O no hydrogen 3.019 N/A PHE 30.A N ASP 26.A O no hydrogen 2.873 N/A MET 31.A N MET 27.A O no hydrogen 2.951 N/A LYS 32.A N ALA 28.A O no hydrogen 2.805 N/A LYS 32.A NZ GLU 36.A OE2 no hydrogen 2.659 N/A GLY 33.A N ALA 29.A O no hydrogen 3.010 N/A ALA 34.A N PHE 30.A O no hydrogen 2.909 N/A VAL 35.A N MET 31.A O no hydrogen 2.871 N/A GLU 36.A N LYS 32.A O no hydrogen 2.941 N/A LYS 37.A N ALA 34.A O no hydrogen 3.117 N/A LYS 37.A NZ MET 3.A O no hydrogen 3.337 N/A LYS 37.A NZ MET 6.A O no hydrogen 2.703 N/A GLY 38.A N VAL 35.A O no hydrogen 2.971 N/A SER 42.A N GLU 45.A OE1 no hydrogen 2.866 N/A GLU 45.A N SER 42.A OG no hydrogen 3.146 N/A ARG 46.A N SER 42.A O no hydrogen 2.814 N/A ARG 46.A NH1 LEU 41.A O no hydrogen 2.943 N/A ASN 47.A N CYS 43.A O no hydrogen 3.098 N/A ASN 47.A ND2 CYS 43.A O no hydrogen 2.933 N/A LEU 48.A N GLU 44.A O no hydrogen 2.991 N/A LEU 49.A N GLU 45.A O no hydrogen 3.003 N/A SER 50.A N.A ARG 46.A O no hydrogen 2.985 N/A SER 50.A N.B ARG 46.A O no hydrogen 2.981 N/A SER 50.A OG.A ARG 46.A O no hydrogen 3.489 N/A SER 50.A OG.A ASN 47.A O no hydrogen 3.091 N/A VAL 51.A N ASN 47.A O no hydrogen 2.931 N/A ALA 52.A N LEU 48.A O no hydrogen 3.053 N/A TYR 53.A N LEU 49.A O no hydrogen 3.212 N/A LYS 54.A N SER 50.A O.A no hydrogen 2.857 N/A LYS 54.A N SER 50.A O.B no hydrogen 2.847 N/A ASN 55.A N VAL 51.A O no hydrogen 3.129 N/A ASN 55.A ND2 VAL 51.A O no hydrogen 2.869 N/A VAL 56.A N ALA 52.A O no hydrogen 3.079 N/A VAL 57.A N.A TYR 53.A O no hydrogen 2.851 N/A VAL 57.A N.B TYR 53.A O no hydrogen 2.855 N/A GLY 58.A N LYS 54.A O no hydrogen 2.838 N/A GLY 59.A N ASN 55.A O no hydrogen 3.129 N/A GLN 60.A N VAL 56.A O no hydrogen 3.235 N/A GLN 60.A NE2 GLU 96.A OE2.A no hydrogen 2.918 N/A ARG 61.A N VAL 57.A O.A no hydrogen 2.795 N/A ARG 61.A N VAL 57.A O.B no hydrogen 2.750 N/A ARG 61.A NE GLU 138.A OE1 no hydrogen 2.987 N/A ARG 61.A NH2 GLU 138.A OE1 no hydrogen 3.562 N/A ARG 61.A NH2 GLU 138.A OE2 no hydrogen 2.913 N/A ALA 62.A N GLY 58.A O no hydrogen 3.000 N/A ALA 63.A N GLY 59.A O no hydrogen 3.053 N/A TRP 64.A N GLN 60.A O no hydrogen 2.825 N/A TRP 64.A NE1 GLU 94.A OE1 no hydrogen 2.866 N/A ARG 65.A N ARG 61.A O no hydrogen 2.944 N/A VAL 66.A N ALA 62.A O no hydrogen 3.156 N/A LEU 67.A N ALA 63.A O no hydrogen 3.009 N/A SER 68.A N.A TRP 64.A O no hydrogen 2.764 N/A SER 68.A N.B TRP 64.A O no hydrogen 2.777 N/A SER 68.A OG.A GLN 72.A OE1 no hydrogen 2.996 N/A SER 68.A OG.B TRP 64.A O no hydrogen 3.047 N/A SER 69.A N ARG 65.A O no hydrogen 2.991 N/A ILE 70.A N VAL 66.A O no hydrogen 3.120 N/A GLU 71.A N LEU 67.A O no hydrogen 2.907 N/A GLN 72.A N SER 68.A O.A no hydrogen 2.840 N/A GLN 72.A N SER 68.A O.B no hydrogen 2.841 N/A LYS 73.A N SER 69.A O no hydrogen 3.051 N/A SER 74.A N ILE 70.A O no hydrogen 2.992 N/A SER 74.A OG GLU 71.A O no hydrogen 2.614 N/A ASN 75.A N GLN 72.A O no hydrogen 3.078 N/A GLU 76.A N LYS 73.A O no hydrogen 3.106 N/A SER 79.A N GLU 76.A O no hydrogen 3.214 N/A SER 79.A OG LYS 73.A O no hydrogen 2.762 N/A SER 79.A OG GLU 76.A O no hydrogen 3.396 N/A GLY 83.A N GLU 81.A OE2 no hydrogen 2.801 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 2.818 N/A ARG 87.A NH1 GLU 91.A OE2 no hydrogen 3.304 N/A GLU 88.A N PRO 84.A O no hydrogen 2.877 N/A TYR 89.A N GLU 85.A O no hydrogen 2.916 N/A ARG 90.A N VAL 86.A O no hydrogen 2.895 N/A ARG 90.A NE GLU 71.A OE1 no hydrogen 2.692 N/A ARG 90.A NH1 GLU 94.A OE1 no hydrogen 2.921 N/A ARG 90.A NH2 GLU 71.A OE1 no hydrogen 3.377 N/A ARG 90.A NH2 GLU 71.A OE2 no hydrogen 2.912 N/A GLU 91.A N ARG 87.A O no hydrogen 2.822 N/A LYS 92.A N GLU 88.A O no hydrogen 2.901 N/A VAL 93.A N TYR 89.A O no hydrogen 3.031 N/A GLU 94.A N ARG 90.A O no hydrogen 2.837 N/A THR 95.A N GLU 91.A O no hydrogen 2.828 N/A THR 95.A OG1 GLU 91.A O no hydrogen 2.883 N/A GLU 96.A N.A LYS 92.A O no hydrogen 3.100 N/A GLU 96.A N.B LYS 92.A O no hydrogen 3.114 N/A LEU 97.A N VAL 93.A O no hydrogen 2.898 N/A GLN 98.A N GLU 94.A O no hydrogen 2.856 N/A GLY 99.A N THR 95.A O no hydrogen 2.912 N/A VAL 100.A N GLU 96.A O.A no hydrogen 3.042 N/A VAL 100.A N GLU 96.A O.B no hydrogen 3.062 N/A CYS 101.A N LEU 97.A O no hydrogen 3.007 N/A CYS 101.A SG LEU 97.A O no hydrogen 3.512 N/A CYS 101.A SG TYR 132.A O no hydrogen 3.828 N/A ASP 102.A N GLN 98.A O no hydrogen 2.843 N/A THR 103.A N GLY 99.A O no hydrogen 2.908 N/A THR 103.A OG1 GLY 99.A O no hydrogen 3.032 N/A VAL 104.A N VAL 100.A O no hydrogen 2.960 N/A LEU 105.A N CYS 101.A O no hydrogen 2.852 N/A GLY 106.A N ASP 102.A O no hydrogen 2.808 N/A LEU 107.A N THR 103.A O no hydrogen 2.998 N/A LEU 108.A N VAL 104.A O no hydrogen 2.995 N/A ASP 109.A N LEU 105.A O no hydrogen 2.954 N/A SER 110.A N LEU 107.A O no hydrogen 3.313 N/A LEU 112.A N LEU 107.A O no hydrogen 3.345 N/A ILE 113.A N LEU 108.A O no hydrogen 2.960 N/A LYS 114.A NZ HIS 111.A ND1 no hydrogen 2.896 N/A GLU 115.A N.B HIS 111.A O no hydrogen 3.420 N/A ALA 116.A N ILE 113.A O no hydrogen 3.049 N/A SER 121.A OG ASP 118.A O no hydrogen 2.931 N/A ARG 122.A N ASP 118.A O no hydrogen 2.897 N/A ARG 122.A NE GLU 158.A OE2 no hydrogen 3.526 N/A ARG 122.A NH1 ILE 113.A O no hydrogen 2.826 N/A ARG 122.A NH1 ALA 116.A O no hydrogen 3.056 N/A ARG 122.A NH2 GLU 158.A OE2 no hydrogen 3.368 N/A VAL 123.A N ALA 119.A O no hydrogen 2.885 N/A PHE 124.A N GLU 120.A O no hydrogen 3.355 N/A TYR 125.A N SER 121.A O no hydrogen 2.943 N/A LEU 126.A N ARG 122.A O no hydrogen 2.936 N/A LYS 127.A N VAL 123.A O no hydrogen 2.845 N/A LYS 127.A NZ ASP 131.A OD2 no hydrogen 2.939 N/A MET 128.A N.A PHE 124.A O no hydrogen 3.028 N/A MET 128.A N.B PHE 124.A O no hydrogen 3.010 N/A LYS 129.A N TYR 125.A O no hydrogen 2.871 N/A GLY 130.A N LEU 126.A O no hydrogen 2.907 N/A ASP 131.A N LYS 127.A O no hydrogen 2.818 N/A TYR 132.A N MET 128.A O.A no hydrogen 2.916 N/A TYR 132.A N MET 128.A O.B no hydrogen 2.912 N/A TYR 133.A N LYS 129.A O no hydrogen 3.030 N/A ARG 134.A N GLY 130.A O no hydrogen 2.829 N/A ARG 134.A NE TYR 156.A OH no hydrogen 2.857 N/A ARG 134.A NH2 ASP 131.A OD1 no hydrogen 3.134 N/A ARG 134.A NH2 TYR 156.A OH no hydrogen 3.530 N/A TYR 135.A N ASP 131.A O no hydrogen 2.885 N/A LEU 136.A N TYR 132.A O no hydrogen 3.075 N/A ALA 137.A N TYR 133.A O no hydrogen 2.850 N/A GLU 138.A N ARG 134.A O no hydrogen 2.955 N/A VAL 139.A N LEU 136.A O no hydrogen 3.260 N/A ALA 140.A N ALA 137.A O no hydrogen 3.290 N/A LYS 145.A N GLY 142.A O no hydrogen 3.216 N/A ARG 147.A NE ASP 144.A OD1 no hydrogen 3.425 N/A ARG 147.A NH2 ASP 144.A OD1 no hydrogen 3.319 N/A ILE 148.A N ASP 144.A O no hydrogen 2.852 N/A ILE 149.A N LYS 145.A O no hydrogen 2.936 N/A ASP 150.A N LYS 146.A O no hydrogen 2.886 N/A SER 151.A N ARG 147.A O no hydrogen 2.876 N/A SER 151.A OG ARG 147.A O no hydrogen 3.094 N/A ALA 152.A N ILE 148.A O no hydrogen 3.052 N/A ARG 153.A N.A ILE 149.A O no hydrogen 2.944 N/A ARG 153.A N.B ILE 149.A O no hydrogen 2.948 N/A ARG 153.A NE.A ASP 150.A OD1 no hydrogen 2.837 N/A ARG 153.A NH2.A ASP 150.A OD1 no hydrogen 3.421 N/A ARG 153.A NH2.A ASP 150.A OD2 no hydrogen 3.235 N/A SER 154.A N ASP 150.A O no hydrogen 2.855 N/A ALA 155.A N SER 151.A O no hydrogen 3.104 N/A TYR 156.A N ALA 152.A O no hydrogen 2.975 N/A TYR 156.A OH ASP 131.A OD1 no hydrogen 2.565 N/A GLN 157.A N ARG 153.A O.A no hydrogen 2.810 N/A GLN 157.A N ARG 153.A O.B no hydrogen 2.818 N/A GLN 157.A NE2 ASP 161.A OD1 no hydrogen 2.893 N/A GLU 158.A N SER 154.A O no hydrogen 3.020 N/A ALA 159.A N ALA 155.A O no hydrogen 3.052 N/A MET 160.A N.A TYR 156.A O no hydrogen 2.811 N/A MET 160.A N.B TYR 156.A O no hydrogen 2.810 N/A ASP 161.A N GLN 157.A O no hydrogen 2.889 N/A ILE 162.A N GLU 158.A O no hydrogen 3.046 N/A SER 163.A N ALA 159.A O no hydrogen 2.866 N/A SER 163.A OG ALA 159.A O no hydrogen 3.233 N/A SER 163.A OG MET 160.A O.A no hydrogen 3.018 N/A SER 163.A OG MET 160.A O.B no hydrogen 3.011 N/A LYS 164.A N MET 160.A O.A no hydrogen 2.928 N/A LYS 164.A N MET 160.A O.B no hydrogen 2.916 N/A LYS 165.A N.A ASP 161.A O no hydrogen 3.293 N/A LYS 165.A N.B ASP 161.A O no hydrogen 3.299 N/A LYS 165.A N.B ILE 162.A O no hydrogen 3.105 N/A GLU 166.A N ILE 162.A O no hydrogen 2.862 N/A MET 167.A N.A SER 163.A O no hydrogen 2.993 N/A MET 167.A N.B SER 163.A O no hydrogen 3.014 N/A THR 170.A OG1 ASP 209.A OD2 no hydrogen 2.763 N/A ASN 171.A N PRO 168.A O no hydrogen 3.034 N/A ARG 174.A N ASN 171.A OD1 no hydrogen 3.088 N/A ARG 174.A NH1 MET 167.A O.A no hydrogen 2.872 N/A ARG 174.A NH1 MET 167.A O.B no hydrogen 2.748 N/A LEU 175.A N ASN 171.A O no hydrogen 2.872 N/A GLY 176.A N PRO 172.A O no hydrogen 2.933 N/A LEU 177.A N ILE 173.A O no hydrogen 2.854 N/A ALA 178.A N ARG 174.A O no hydrogen 2.999 N/A LEU 179.A N LEU 175.A O no hydrogen 2.884 N/A ASN 180.A N GLY 176.A O no hydrogen 2.985 N/A ASN 180.A ND2 ASP 131.A OD1 no hydrogen 2.902 N/A ASN 180.A ND2 ASP 131.A OD2 no hydrogen 3.335 N/A PHE 181.A N LEU 177.A O no hydrogen 2.838 N/A SER 182.A N ALA 178.A O no hydrogen 2.863 N/A SER 182.A OG ALA 195.A O no hydrogen 2.768 N/A VAL 183.A N LEU 179.A O no hydrogen 3.063 N/A PHE 184.A N ASN 180.A O no hydrogen 2.834 N/A HIS 185.A N PHE 181.A O no hydrogen 2.907 N/A TYR 186.A N SER 182.A O no hydrogen 2.942 N/A GLU 187.A N VAL 183.A O no hydrogen 2.933 N/A ILE 188.A N PHE 184.A O no hydrogen 2.936 N/A ALA 189.A N PHE 184.A O no hydrogen 3.006 N/A SER 191.A N HIS 185.A O no hydrogen 2.799 N/A SER 191.A OG ALA 189.A O no hydrogen 3.047 N/A ALA 195.A N SER 191.A O no hydrogen 3.027 N/A ILE 196.A N PRO 192.A O no hydrogen 2.927 N/A SER 197.A N.A GLU 193.A O no hydrogen 2.922 N/A SER 197.A N.B GLU 193.A O no hydrogen 2.924 N/A SER 197.A OG.B GLU 193.A O no hydrogen 3.091 N/A LEU 198.A N GLU 194.A O no hydrogen 2.908 N/A ALA 199.A N ALA 195.A O no hydrogen 3.062 N/A LYS 200.A N ILE 196.A O no hydrogen 2.936 N/A LYS 200.A NZ ASP 204.A OD2 no hydrogen 2.702 N/A THR 201.A N.A SER 197.A O.A no hydrogen 2.924 N/A THR 201.A N.A SER 197.A O.B no hydrogen 2.932 N/A THR 201.A N.B SER 197.A O.A no hydrogen 2.935 N/A THR 201.A N.B SER 197.A O.B no hydrogen 2.943 N/A THR 201.A OG1.A SER 197.A O.A no hydrogen 3.234 N/A THR 201.A OG1.A SER 197.A O.B no hydrogen 3.222 N/A THR 201.A OG1.B SER 197.A O.A no hydrogen 2.938 N/A THR 201.A OG1.B SER 197.A O.B no hydrogen 2.928 N/A THR 201.A OG1.B LEU 198.A O no hydrogen 3.192 N/A THR 202.A N LEU 198.A O no hydrogen 2.928 N/A THR 202.A OG1 LEU 198.A O no hydrogen 2.715 N/A PHE 203.A N ALA 199.A O no hydrogen 2.963 N/A ASP 204.A N LYS 200.A O no hydrogen 2.939 N/A GLU 205.A N THR 201.A O.A no hydrogen 2.950 N/A GLU 205.A N THR 201.A O.B no hydrogen 2.923 N/A ALA 206.A N THR 202.A O no hydrogen 3.047 N/A MET 207.A N.A PHE 203.A O no hydrogen 2.892 N/A MET 207.A N.B PHE 203.A O no hydrogen 2.898 N/A ALA 208.A N ASP 204.A O no hydrogen 3.222 N/A ASP 209.A N ALA 206.A O no hydrogen 2.920 N/A LEU 210.A N MET 207.A O.A no hydrogen 3.322 N/A LEU 210.A N MET 207.A O.B no hydrogen 3.320 N/A HIS 211.A ND1 ALA 208.A O no hydrogen 3.143 N/A THR 212.A N ASP 209.A O no hydrogen 3.142 N/A THR 212.A OG1 ASP 209.A O no hydrogen 2.748 N/A THR 212.A OG1 ASP 209.A OD1 no hydrogen 3.397 N/A LEU 213.A N LEU 210.A O no hydrogen 3.060 N/A SER 214.A OG SER 217.A OG no hydrogen 3.292 N/A SER 217.A N SER 214.A OG no hydrogen 3.155 N/A SER 217.A OG SER 214.A OG no hydrogen 3.292 N/A TYR 218.A N SER 214.A O no hydrogen 2.853 N/A LYS 219.A N GLU 215.A O no hydrogen 3.088 N/A ASP 220.A N ASP 216.A O no hydrogen 3.145 N/A SER 221.A N SER 217.A O no hydrogen 2.929 N/A SER 221.A OG THR 170.A O no hydrogen 2.637 N/A SER 221.A OG SER 217.A O no hydrogen 3.291 N/A THR 222.A N TYR 218.A O no hydrogen 2.904 N/A THR 222.A OG1 TYR 218.A O no hydrogen 2.828 N/A THR 222.A OG1 LYS 219.A O no hydrogen 3.335 N/A LEU 223.A N LYS 219.A O no hydrogen 3.166 N/A MET 225.A N SER 221.A O no hydrogen 2.984 N/A GLN 226.A N THR 222.A O no hydrogen 2.930 N/A GLN 226.A NE2 ASP 230.A OD1 no hydrogen 2.941 N/A LEU 228.A N ILE 224.A O no hydrogen 3.090 N/A ARG 229.A N MET 225.A O no hydrogen 2.991 N/A ASP 230.A N GLN 226.A O no hydrogen 2.797 N/A ASN 231.A N LEU 227.A O no hydrogen 2.993 N/A LEU 232.A N LEU 228.A O no hydrogen 2.958 N/A THR 233.A N ARG 229.A O no hydrogen 2.852 N/A THR 233.A OG1 ARG 229.A O no hydrogen 3.013 N/A LEU 234.A N ASP 230.A O no hydrogen 2.987 N/A TRP 235.A N ASN 231.A O no hydrogen 2.949 N/A TRP 235.A N LEU 232.A O no hydrogen 3.232 N/A THR 236.A OG1 LEU 232.A O no hydrogen 2.640 N/A