Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6s39_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N GLY 1.A O no hydrogen 3.251 N/A MET 6.A N MET 3.A O no hydrogen 3.000 N/A ARG 8.A NH1 GLU 45.A OE1 no hydrogen 3.514 N/A ARG 8.A NH1 GLU 45.A OE2 no hydrogen 2.893 N/A ARG 8.A NH2 GLU 45.A OE1 no hydrogen 2.926 N/A LEU 11.A N GLU 7.A O no hydrogen 2.959 N/A ILE 12.A N ARG 8.A O no hydrogen 3.110 N/A GLN 13.A N ALA 9.A O no hydrogen 2.846 N/A LYS 14.A N SER 10.A O no hydrogen 2.856 N/A ALA 15.A N LEU 11.A O no hydrogen 2.760 N/A LYS 16.A N ILE 12.A O no hydrogen 3.062 N/A LEU 17.A N GLN 13.A O no hydrogen 3.091 N/A ALA 18.A N LYS 14.A O no hydrogen 2.975 N/A GLU 19.A N ALA 15.A O no hydrogen 3.062 N/A GLN 20.A N LYS 16.A O no hydrogen 3.240 N/A ALA 21.A N LEU 17.A O no hydrogen 2.948 N/A GLU 22.A N GLU 19.A O no hydrogen 3.011 N/A ARG 23.A N ALA 18.A O no hydrogen 2.841 N/A ARG 23.A NE ASP 26.A OD2 no hydrogen 2.878 N/A ARG 23.A NH2 ASP 26.A OD2 no hydrogen 2.747 N/A MET 27.A N ARG 23.A O no hydrogen 2.956 N/A ALA 28.A N TYR 24.A O no hydrogen 2.879 N/A ALA 29.A N GLU 25.A O no hydrogen 2.936 N/A PHE 30.A N ASP 26.A O no hydrogen 2.951 N/A MET 31.A N MET 27.A O no hydrogen 3.017 N/A LYS 32.A N ALA 28.A O no hydrogen 2.867 N/A LYS 32.A NZ GLU 36.A OE2 no hydrogen 2.916 N/A GLY 33.A N ALA 29.A O no hydrogen 3.038 N/A ALA 34.A N PHE 30.A O no hydrogen 2.800 N/A VAL 35.A N MET 31.A O no hydrogen 2.911 N/A GLU 36.A N LYS 32.A O no hydrogen 2.948 N/A LYS 37.A N GLY 33.A O no hydrogen 3.240 N/A LYS 37.A N ALA 34.A O no hydrogen 3.271 N/A LYS 37.A NZ MET 3.A O no hydrogen 3.481 N/A LYS 37.A NZ MET 6.A O no hydrogen 2.884 N/A GLY 38.A N VAL 35.A O no hydrogen 2.780 N/A SER 42.A N GLU 45.A OE1 no hydrogen 2.766 N/A GLU 45.A N SER 42.A OG no hydrogen 3.267 N/A ARG 46.A N SER 42.A O no hydrogen 2.886 N/A ASN 47.A N CYS 43.A O no hydrogen 3.067 N/A ASN 47.A ND2 CYS 43.A O no hydrogen 2.840 N/A LEU 48.A N GLU 44.A O no hydrogen 2.930 N/A LEU 49.A N GLU 45.A O no hydrogen 3.116 N/A SER 50.A N ARG 46.A O no hydrogen 3.007 N/A VAL 51.A N ASN 47.A O no hydrogen 2.880 N/A ALA 52.A N LEU 48.A O no hydrogen 2.991 N/A TYR 53.A N LEU 49.A O no hydrogen 3.209 N/A LYS 54.A N SER 50.A O no hydrogen 2.855 N/A ASN 55.A N VAL 51.A O no hydrogen 3.020 N/A ASN 55.A ND2 VAL 51.A O no hydrogen 2.957 N/A VAL 56.A N ALA 52.A O no hydrogen 3.120 N/A VAL 57.A N TYR 53.A O no hydrogen 2.727 N/A GLY 58.A N LYS 54.A O no hydrogen 2.933 N/A GLY 59.A N ASN 55.A O no hydrogen 3.314 N/A GLN 60.A N VAL 56.A O no hydrogen 3.386 N/A GLN 60.A NE2 GLU 89.A OE2.B no hydrogen 2.935 N/A ARG 61.A N VAL 57.A O no hydrogen 2.894 N/A ARG 61.A NE GLU 131.A OE1 no hydrogen 2.984 N/A ARG 61.A NH2 GLU 131.A OE1 no hydrogen 3.472 N/A ARG 61.A NH2 GLU 131.A OE2 no hydrogen 2.931 N/A ALA 62.A N GLY 58.A O no hydrogen 2.972 N/A ALA 63.A N GLY 59.A O no hydrogen 2.974 N/A TRP 64.A N GLN 60.A O no hydrogen 2.790 N/A TRP 64.A NE1 GLU 87.A OE1 no hydrogen 3.002 N/A ARG 65.A N ARG 61.A O no hydrogen 3.035 N/A VAL 66.A N ALA 62.A O no hydrogen 3.297 N/A LEU 67.A N ALA 63.A O no hydrogen 3.151 N/A SER 68.A N TRP 64.A O no hydrogen 2.763 N/A SER 68.A OG.B TRP 64.A O no hydrogen 2.739 N/A SER 69.A N ARG 65.A O no hydrogen 3.017 N/A ILE 70.A N VAL 66.A O no hydrogen 3.137 N/A GLU 71.A N LEU 67.A O no hydrogen 2.838 N/A GLN 72.A N SER 68.A O no hydrogen 2.880 N/A LYS 73.A N SER 69.A O no hydrogen 2.968 N/A SER 74.A N ILE 70.A O no hydrogen 2.816 N/A SER 74.A OG GLU 71.A O no hydrogen 2.748 N/A ASN 75.A N GLN 72.A O no hydrogen 3.056 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.730 N/A ARG 80.A NH1 GLU 84.A OE1.A no hydrogen 3.400 N/A GLU 81.A N PRO 77.A O no hydrogen 2.928 N/A TYR 82.A N GLU 78.A O no hydrogen 2.835 N/A ARG 83.A N VAL 79.A O no hydrogen 2.893 N/A ARG 83.A NE GLU 71.A OE1 no hydrogen 2.626 N/A ARG 83.A NH1 GLU 84.A OE2.B no hydrogen 3.023 N/A ARG 83.A NH1 GLU 87.A OE1 no hydrogen 3.008 N/A ARG 83.A NH2 GLU 71.A OE2 no hydrogen 2.915 N/A GLU 84.A N.A ARG 80.A O no hydrogen 2.897 N/A GLU 84.A N.B ARG 80.A O no hydrogen 2.928 N/A LYS 85.A N GLU 81.A O no hydrogen 3.012 N/A VAL 86.A N TYR 82.A O no hydrogen 2.980 N/A GLU 87.A N ARG 83.A O no hydrogen 2.846 N/A THR 88.A N GLU 84.A O.A no hydrogen 2.936 N/A THR 88.A N GLU 84.A O.B no hydrogen 2.894 N/A THR 88.A OG1 GLU 84.A O.A no hydrogen 2.596 N/A THR 88.A OG1 GLU 84.A O.B no hydrogen 2.687 N/A GLU 89.A N LYS 85.A O no hydrogen 3.082 N/A LEU 90.A N VAL 86.A O no hydrogen 2.893 N/A GLN 91.A N GLU 87.A O no hydrogen 2.867 N/A GLY 92.A N THR 88.A O no hydrogen 2.967 N/A VAL 93.A N GLU 89.A O no hydrogen 3.022 N/A CYS 94.A N LEU 90.A O no hydrogen 2.985 N/A CYS 94.A SG LEU 90.A O no hydrogen 3.464 N/A CYS 94.A SG TYR 125.A O no hydrogen 3.481 N/A ASP 95.A N GLN 91.A O no hydrogen 2.687 N/A THR 96.A N GLY 92.A O no hydrogen 2.869 N/A THR 96.A OG1 GLY 92.A O no hydrogen 2.900 N/A VAL 97.A N VAL 93.A O no hydrogen 3.021 N/A LEU 98.A N CYS 94.A O no hydrogen 3.051 N/A GLY 99.A N ASP 95.A O no hydrogen 2.942 N/A LEU 100.A N THR 96.A O no hydrogen 3.047 N/A LEU 101.A N VAL 97.A O no hydrogen 2.994 N/A ASP 102.A N LEU 98.A O no hydrogen 2.886 N/A SER 103.A N GLY 99.A O no hydrogen 2.776 N/A LEU 105.A N LEU 100.A O no hydrogen 3.353 N/A ILE 106.A N LEU 101.A O no hydrogen 2.996 N/A LYS 107.A NZ ASP 102.A O no hydrogen 2.992 N/A LYS 107.A NZ HIS 104.A ND1 no hydrogen 3.127 N/A ALA 109.A N ILE 106.A O no hydrogen 2.989 N/A SER 114.A OG ASP 111.A O no hydrogen 3.013 N/A ARG 115.A N ASP 111.A O no hydrogen 2.905 N/A ARG 115.A NH1 ALA 109.A O no hydrogen 3.182 N/A ARG 115.A NH2 GLU 149.A OE2 no hydrogen 3.208 N/A VAL 116.A N ALA 112.A O no hydrogen 2.891 N/A TYR 118.A N SER 114.A O no hydrogen 3.017 N/A LEU 119.A N ARG 115.A O no hydrogen 2.941 N/A LYS 120.A N VAL 116.A O no hydrogen 2.924 N/A LYS 120.A NZ ASP 124.A OD2 no hydrogen 2.925 N/A MET 121.A N PHE 117.A O no hydrogen 3.096 N/A LYS 122.A N TYR 118.A O no hydrogen 2.936 N/A GLY 123.A N LEU 119.A O no hydrogen 2.898 N/A ASP 124.A N LYS 120.A O no hydrogen 2.706 N/A TYR 125.A N MET 121.A O no hydrogen 2.798 N/A TYR 126.A N LYS 122.A O no hydrogen 3.133 N/A ARG 127.A N GLY 123.A O no hydrogen 2.923 N/A ARG 127.A NE TYR 147.A OH no hydrogen 2.934 N/A ARG 127.A NH2 ASP 124.A OD1 no hydrogen 3.140 N/A ARG 127.A NH2 TYR 147.A OH no hydrogen 3.333 N/A TYR 128.A N ASP 124.A O no hydrogen 3.008 N/A LEU 129.A N TYR 125.A O no hydrogen 3.174 N/A ALA 130.A N TYR 126.A O no hydrogen 2.802 N/A GLU 131.A N ARG 127.A O no hydrogen 2.939 N/A VAL 132.A N LEU 129.A O no hydrogen 3.054 N/A ALA 133.A N ALA 130.A O no hydrogen 3.203 N/A ILE 139.A N ASP 135.A O no hydrogen 3.246 N/A ILE 140.A N LYS 136.A O no hydrogen 2.962 N/A ASP 141.A N LYS 137.A O no hydrogen 2.831 N/A SER 142.A N ARG 138.A O no hydrogen 2.774 N/A SER 142.A OG ARG 138.A O no hydrogen 3.243 N/A ALA 143.A N ILE 139.A O no hydrogen 2.952 N/A ARG 144.A N ILE 140.A O no hydrogen 3.000 N/A ARG 144.A NE.B ASP 141.A OD1 no hydrogen 3.096 N/A SER 145.A N ASP 141.A O no hydrogen 2.965 N/A SER 145.A OG.B ASP 141.A O no hydrogen 3.015 N/A ALA 146.A N SER 142.A O no hydrogen 3.096 N/A TYR 147.A N ALA 143.A O no hydrogen 2.890 N/A TYR 147.A OH ASP 124.A OD1 no hydrogen 2.525 N/A GLN 148.A N ARG 144.A O no hydrogen 2.739 N/A GLN 148.A NE2 GLN 148.A O no hydrogen 3.481 N/A GLN 148.A NE2 ASP 152.A OD1 no hydrogen 3.078 N/A GLU 149.A N SER 145.A O no hydrogen 3.012 N/A ALA 150.A N ALA 146.A O no hydrogen 3.031 N/A MET 151.A N TYR 147.A O no hydrogen 2.767 N/A ASP 152.A N GLN 148.A O no hydrogen 2.891 N/A ILE 153.A N GLU 149.A O no hydrogen 3.178 N/A SER 154.A N ALA 150.A O no hydrogen 2.970 N/A SER 154.A OG MET 151.A O no hydrogen 2.947 N/A LYS 155.A N MET 151.A O no hydrogen 2.919 N/A LYS 156.A N ASP 152.A O no hydrogen 3.250 N/A GLU 157.A N ILE 153.A O no hydrogen 2.820 N/A MET 158.A N SER 154.A O no hydrogen 2.902 N/A THR 161.A OG1 ASP 200.A OD2 no hydrogen 2.720 N/A ASN 162.A N PRO 159.A O no hydrogen 2.957 N/A ASN 162.A ND2 GLU 113.A OE1.B no hydrogen 3.275 N/A ASN 162.A ND2 GLU 113.A OE2.B no hydrogen 3.246 N/A ILE 164.A N ASN 162.A OD1 no hydrogen 3.033 N/A ARG 165.A N ASN 162.A OD1 no hydrogen 3.326 N/A ARG 165.A NH1 MET 158.A O no hydrogen 2.918 N/A LEU 166.A N ASN 162.A O no hydrogen 2.817 N/A GLY 167.A N PRO 163.A O no hydrogen 2.871 N/A LEU 168.A N ILE 164.A O no hydrogen 2.918 N/A ALA 169.A N ARG 165.A O no hydrogen 3.102 N/A LEU 170.A N LEU 166.A O no hydrogen 2.901 N/A ASN 171.A N GLY 167.A O no hydrogen 3.045 N/A ASN 171.A ND2 ASP 124.A OD1 no hydrogen 2.824 N/A ASN 171.A ND2 ASP 124.A OD2 no hydrogen 3.201 N/A PHE 172.A N LEU 168.A O no hydrogen 2.905 N/A SER 173.A N ALA 169.A O no hydrogen 2.949 N/A SER 173.A OG.A ALA 186.A O no hydrogen 2.641 N/A SER 173.A OG.B ALA 169.A O no hydrogen 3.279 N/A SER 173.A OG.B LEU 170.A O no hydrogen 2.451 N/A VAL 174.A N LEU 170.A O no hydrogen 3.172 N/A PHE 175.A N ASN 171.A O no hydrogen 2.803 N/A HIS 176.A N PHE 172.A O no hydrogen 2.808 N/A TYR 177.A N SER 173.A O no hydrogen 2.800 N/A GLU 178.A N VAL 174.A O no hydrogen 3.011 N/A ILE 179.A N PHE 175.A O no hydrogen 2.775 N/A ALA 180.A N PHE 175.A O no hydrogen 3.112 N/A SER 182.A N HIS 176.A O no hydrogen 2.857 N/A SER 182.A OG ALA 180.A O no hydrogen 3.351 N/A ALA 186.A N SER 182.A O no hydrogen 3.094 N/A ILE 187.A N PRO 183.A O no hydrogen 2.957 N/A SER 188.A N GLU 184.A O no hydrogen 3.019 N/A SER 188.A OG.B GLU 184.A O no hydrogen 3.311 N/A LEU 189.A N GLU 185.A O no hydrogen 2.853 N/A ALA 190.A N ALA 186.A O no hydrogen 2.910 N/A LYS 191.A N ILE 187.A O no hydrogen 2.940 N/A THR 192.A N SER 188.A O no hydrogen 3.010 N/A THR 192.A OG1.A SER 188.A O no hydrogen 2.963 N/A THR 192.A OG1.B SER 188.A O no hydrogen 2.758 N/A THR 192.A OG1.B LEU 189.A O no hydrogen 3.049 N/A THR 193.A N LEU 189.A O no hydrogen 2.892 N/A THR 193.A OG1 LEU 189.A O no hydrogen 2.711 N/A PHE 194.A N ALA 190.A O no hydrogen 3.018 N/A ASP 195.A N LYS 191.A O no hydrogen 2.895 N/A GLU 196.A N THR 192.A O no hydrogen 3.033 N/A ALA 197.A N THR 193.A O no hydrogen 3.138 N/A MET 198.A N PHE 194.A O no hydrogen 2.965 N/A ALA 199.A N ASP 195.A O no hydrogen 3.136 N/A ASP 200.A N ALA 197.A O no hydrogen 2.937 N/A LEU 201.A N MET 198.A O no hydrogen 3.420 N/A THR 203.A N ASP 200.A O no hydrogen 2.996 N/A THR 203.A OG1 ASP 200.A O no hydrogen 2.638 N/A LEU 204.A N LEU 201.A O no hydrogen 2.936 N/A SER 205.A OG SER 208.A OG no hydrogen 3.354 N/A SER 208.A N SER 205.A OG no hydrogen 3.114 N/A SER 208.A OG SER 205.A OG no hydrogen 3.354 N/A TYR 209.A N SER 205.A O no hydrogen 2.877 N/A LYS 210.A N GLU 206.A O no hydrogen 3.086 N/A ASP 211.A N ASP 207.A O no hydrogen 3.227 N/A SER 212.A N SER 208.A O no hydrogen 2.996 N/A SER 212.A OG THR 161.A O no hydrogen 2.902 N/A SER 212.A OG SER 208.A O no hydrogen 2.964 N/A THR 213.A N TYR 209.A O no hydrogen 2.945 N/A THR 213.A OG1 TYR 209.A O no hydrogen 2.805 N/A THR 213.A OG1 LYS 210.A O no hydrogen 3.121 N/A LEU 214.A N LYS 210.A O no hydrogen 3.064 N/A MET 216.A N SER 212.A O no hydrogen 2.875 N/A GLN 217.A N THR 213.A O no hydrogen 2.901 N/A GLN 217.A NE2 GLN 217.A O no hydrogen 3.323 N/A GLN 217.A NE2 ASP 221.A OD1 no hydrogen 2.855 N/A LEU 218.A N LEU 214.A O no hydrogen 3.439 N/A LEU 219.A N ILE 215.A O no hydrogen 3.202 N/A ARG 220.A N MET 216.A O no hydrogen 2.968 N/A ASP 221.A N GLN 217.A O no hydrogen 2.806 N/A ASN 222.A N LEU 218.A O no hydrogen 3.237 N/A LEU 223.A N LEU 219.A O no hydrogen 3.008 N/A THR 224.A N ARG 220.A O no hydrogen 2.932 N/A THR 224.A OG1 ARG 220.A O no hydrogen 2.974 N/A LEU 225.A N ASP 221.A O no hydrogen 3.281 N/A TRP 226.A N ASN 222.A O no hydrogen 2.903 N/A THR 227.A N LEU 223.A O no hydrogen 2.842 N/A THR 227.A OG1 LEU 223.A O no hydrogen 2.732 N/A