Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4hes_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N GLU 4.A OE2 no hydrogen 3.044 N/A LYS 5.A N ASN 2.A O no hydrogen 3.018 N/A LYS 5.A NZ GLN 35.A OE1 no hydrogen 2.815 N/A LYS 5.A NZ PRO 262.A O no hydrogen 2.816 N/A LEU 6.A N ALA 3.A O no hydrogen 2.998 N/A VAL 8.A N GLU 4.A O no hydrogen 2.974 N/A GLY 9.A N LYS 5.A O no hydrogen 2.863 N/A LYS 10.A N ILE 7.A O no hydrogen 3.098 N/A SER 11.A N.A VAL 8.A O no hydrogen 2.997 N/A SER 11.A N.B VAL 8.A O no hydrogen 2.996 N/A GLU 13.A N GLY 9.A O no hydrogen 3.046 N/A HIS 14.A N LYS 10.A O no hydrogen 2.940 N/A GLN 15.A N SER 11.A O.A no hydrogen 2.925 N/A GLN 15.A N SER 11.A O.B no hydrogen 3.058 N/A GLN 15.A NE2 SER 11.A O.B no hydrogen 3.480 N/A GLN 15.A NE2 SER 11.A OG.A no hydrogen 3.332 N/A LEU 16.A N LEU 12.A O no hydrogen 2.907 N/A ASP 17.A N GLU 13.A O no hydrogen 2.789 N/A THR 18.A N HIS 14.A O no hydrogen 2.979 N/A THR 18.A OG1 HIS 14.A O no hydrogen 2.807 N/A VAL 19.A N GLN 15.A O no hydrogen 3.252 N/A ILE 20.A N LEU 16.A O no hydrogen 2.947 N/A LYS 21.A N ASP 17.A O no hydrogen 2.931 N/A GLU 22.A N THR 18.A O no hydrogen 3.049 N/A LEU 23.A N VAL 19.A O no hydrogen 2.882 N/A ALA 24.A N ILE 20.A O no hydrogen 2.797 N/A GLY 27.A N ALA 24.A O no hydrogen 3.026 N/A ASN 28.A N SER 236.A O no hydrogen 2.820 N/A SER 30.A N LEU 235.A O no hydrogen 2.765 N/A SER 30.A OG GLY 49.A O no hydrogen 2.741 N/A SER 30.A OG HIS 54.A NE2 no hydrogen 2.827 N/A TYR 31.A N ARG 48.A O no hydrogen 2.965 N/A TYR 31.A OH ASP 17.A OD1 no hydrogen 2.738 N/A ALA 32.A N ILE 233.A O no hydrogen 3.034 N/A VAL 33.A N ALA 46.A O no hydrogen 2.807 N/A LEU 34.A N CYS 231.A O no hydrogen 2.948 N/A GLN 35.A N THR 43.A O no hydrogen 2.804 N/A PHE 36.A N HIS 229.A O no hydrogen 2.910 N/A GLU 39.A N GLU 173.A OE1 no hydrogen 3.243 N/A GLU 39.A N GLU 173.A OE2 no hydrogen 2.893 N/A GLU 40.A N ASP 37.A O no hydrogen 3.125 N/A THR 43.A N GLN 35.A O no hydrogen 2.994 N/A ILE 45.A N VAL 33.A O no hydrogen 2.764 N/A ALA 46.A N VAL 33.A O no hydrogen 3.231 N/A ALA 47.A N GLU 13.A OE2 no hydrogen 2.860 N/A ARG 48.A N TYR 31.A O no hydrogen 2.897 N/A ARG 48.A NE ILE 29.A O no hydrogen 2.911 N/A ARG 48.A NH2 ASP 17.A OD1 no hydrogen 2.961 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.754 N/A THR 52.A N GLY 49.A O no hydrogen 3.135 N/A THR 52.A OG1 GLY 49.A O no hydrogen 3.182 N/A HIS 54.A N ILE 160.A O.A no hydrogen 2.877 N/A HIS 54.A N ILE 160.A O.B no hydrogen 2.900 N/A HIS 54.A ND1 SER 236.A OG no hydrogen 2.774 N/A HIS 54.A NE2 SER 30.A OG no hydrogen 2.827 N/A SER 55.A OG.A ASP 157.A OD2 no hydrogen 2.743 N/A SER 55.A OG.B ASP 157.A OD2 no hydrogen 2.886 N/A SER 56.A N ASN 158.A O no hydrogen 2.892 N/A SER 56.A OG ALA 57.A O no hydrogen 2.439 N/A SER 58.A OG SER 116.A OG no hydrogen 3.242 N/A LEU 59.A N SER 56.A O no hydrogen 3.006 N/A LYS 61.A N SER 58.A O no hydrogen 3.005 N/A LYS 61.A NZ SER 58.A OG no hydrogen 3.129 N/A LYS 61.A NZ SER 116.A O no hydrogen 3.080 N/A LYS 61.A NZ SER 116.A OG no hydrogen 2.933 N/A LYS 61.A NZ ASN 118.A OD1 no hydrogen 2.834 N/A VAL 62.A N LEU 59.A O no hydrogen 3.071 N/A ILE 64.A N ILE 60.A O no hydrogen 3.328 N/A TYR 66.A N LEU 63.A O no hydrogen 2.949 N/A VAL 67.A N ILE 64.A O no hydrogen 3.114 N/A HIS 69.A N GLU 65.A O no hydrogen 2.867 N/A LEU 70.A N TYR 66.A O no hydrogen 2.975 N/A ALA 71.A N VAL 67.A O no hydrogen 2.987 N/A ARG 72.A N PHE 68.A O no hydrogen 2.875 N/A ARG 72.A NH1 ASP 178.A OD2 no hydrogen 2.613 N/A THR 73.A N HIS 69.A O no hydrogen 2.984 N/A THR 73.A OG1 HIS 69.A O no hydrogen 2.935 N/A THR 73.A OG1 LEU 70.A O no hydrogen 3.385 N/A GLU 74.A N ALA 71.A O no hydrogen 2.964 N/A GLN 75.A N LEU 70.A O no hydrogen 2.794 N/A GLN 75.A NE2 THR 73.A OG1 no hydrogen 2.887 N/A LEU 76.A N LEU 70.A O no hydrogen 3.366 N/A ASN 79.A N ASP 77.A OD1 no hydrogen 2.832 N/A ASP 80.A N ASP 77.A O no hydrogen 2.903 N/A VAL 82.A N PHE 105.A O no hydrogen 2.763 N/A LEU 84.A N HIS 103.A O no hydrogen 2.887 N/A ARG 86.A N PRO 83.A O no hydrogen 3.105 N/A ARG 89.A NE GLN 97.A O no hydrogen 2.888 N/A ARG 89.A NH1 GLU 91.A OE2 no hydrogen 2.958 N/A ARG 89.A NH2 GLU 91.A OE2 no hydrogen 3.339 N/A ARG 89.A NH2 GLN 97.A O no hydrogen 3.048 N/A GLY 93.A N GLN 97.A OE1 no hydrogen 2.899 N/A ALA 95.A N ASP 117.A OD2 no hydrogen 2.818 N/A LEU 96.A N ASP 117.A OD2 no hydrogen 2.899 N/A GLU 98.A N ALA 95.A O no hydrogen 3.024 N/A LEU 99.A N LEU 96.A O no hydrogen 3.025 N/A PHE 105.A N VAL 82.A O no hydrogen 3.014 N/A THR 106.A N GLU 109.A OE1 no hydrogen 2.892 N/A TYR 107.A N ASP 80.A O no hydrogen 3.176 N/A LEU 108.A N ILE 78.A O no hydrogen 3.118 N/A GLU 109.A N THR 106.A OG1 no hydrogen 3.000 N/A LEU 110.A N THR 106.A O no hydrogen 2.899 N/A CYS 111.A N TYR 107.A O no hydrogen 2.916 N/A CYS 111.A SG TYR 107.A O no hydrogen 3.433 N/A ARG 112.A N LEU 108.A O no hydrogen 3.015 N/A ARG 112.A NE GLU 183.A OE2 no hydrogen 2.891 N/A ARG 112.A NH2 GLU 183.A OE2 no hydrogen 2.950 N/A LEU 113.A N GLU 109.A O no hydrogen 2.984 N/A LEU 115.A N LEU 113.A O no hydrogen 3.270 N/A SER 116.A OG SER 58.A OG no hydrogen 3.242 N/A ASP 117.A N LEU 113.A O no hydrogen 3.111 N/A ASN 118.A N GLY 93.A O no hydrogen 3.257 N/A ASN 118.A ND2 GLU 91.A O no hydrogen 3.045 N/A ALA 120.A N ASP 117.A OD1 no hydrogen 2.960 N/A THR 121.A N ASP 117.A O no hydrogen 3.112 N/A THR 121.A OG1 ASP 117.A O no hydrogen 2.787 N/A ASN 122.A N ASN 118.A O no hydrogen 2.977 N/A LEU 123.A N ILE 119.A O no hydrogen 2.821 N/A LEU 124.A N ALA 120.A O no hydrogen 3.078 N/A ILE 125.A N THR 121.A O no hydrogen 2.926 N/A THR 126.A N ASN 122.A O no hydrogen 2.914 N/A THR 126.A OG1 ASN 122.A O no hydrogen 2.780 N/A VAL 127.A N LEU 123.A O no hydrogen 3.082 N/A LEU 128.A N LEU 124.A O no hydrogen 2.870 N/A GLY 129.A N ILE 125.A O no hydrogen 2.830 N/A ASN 131.A ND2 LEU 128.A O no hydrogen 2.848 N/A ILE 132.A N GLY 129.A O no hydrogen 3.115 N/A ASN 133.A ND2 LEU 145.A O no hydrogen 2.853 N/A ALA 134.A N GLU 130.A O no hydrogen 2.951 N/A ARG 135.A N ASN 131.A O no hydrogen 3.049 N/A ARG 135.A NE GLU 65.A OE1 no hydrogen 2.755 N/A ARG 135.A NH2 GLU 65.A OE2 no hydrogen 2.798 N/A ALA 136.A N ILE 132.A O no hydrogen 3.196 N/A GLU 137.A N ASN 133.A O no hydrogen 3.072 N/A LYS 138.A N ALA 134.A O no hydrogen 3.021 N/A LEU 139.A N ARG 135.A O no hydrogen 2.957 N/A GLY 140.A N GLU 137.A O no hydrogen 3.028 N/A VAL 141.A N ALA 136.A O no hydrogen 2.905 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.787 N/A LEU 145.A N ASN 133.A OD1 no hydrogen 2.880 N/A ASN 146.A N ASN 158.A OD1 no hydrogen 2.661 N/A ASN 146.A ND2 GLU 144.A OE1 no hydrogen 3.060 N/A ASN 146.A ND2 ASP 157.A O no hydrogen 2.931 N/A ARG 147.A N ASN 158.A OD1 no hydrogen 2.929 N/A ARG 147.A NE ASP 157.A OD1 no hydrogen 2.959 N/A ALA 151.A N ASP 148.A OD1 no hydrogen 2.995 N/A LEU 152.A N ASP 148.A O no hydrogen 3.406 N/A ALA 153.A N PHE 149.A O no hydrogen 3.174 N/A GLU 154.A N ASN 150.A O no hydrogen 2.799 N/A ARG 156.A N ALA 151.A O no hydrogen 2.859 N/A ARG 156.A NH1 GLU 154.A OE1 no hydrogen 2.686 N/A ASN 158.A N ASP 157.A OD1 no hydrogen 2.829 N/A ASN 158.A ND2 ARG 147.A O no hydrogen 3.081 N/A HIS 159.A N GLU 144.A O no hydrogen 3.103 N/A ILE 160.A N.A HIS 54.A O no hydrogen 2.928 N/A ILE 160.A N.B HIS 54.A O no hydrogen 2.921 N/A THR 161.A N SER 163.A OG no hydrogen 3.186 N/A THR 161.A OG1 SER 163.A OG no hydrogen 2.646 N/A SER 163.A OG THR 161.A O no hydrogen 3.131 N/A SER 163.A OG THR 161.A OG1 no hydrogen 2.646 N/A LEU 164.A N THR 161.A O no hydrogen 3.151 N/A ALA 165.A N ALA 162.A O no hydrogen 2.929 N/A ARG 166.A NE GLY 140.A O no hydrogen 3.195 N/A ARG 166.A NH1 GLY 140.A O no hydrogen 2.857 N/A ARG 166.A NH1 GLU 143.A OE2 no hydrogen 3.168 N/A LEU 167.A N SER 163.A O no hydrogen 3.021 N/A TYR 168.A N LEU 164.A O no hydrogen 2.889 N/A TYR 168.A OH GLY 220.A O no hydrogen 2.729 N/A LYS 169.A N ALA 165.A O no hydrogen 2.901 N/A LYS 169.A NZ ASP 37.A O no hydrogen 3.442 N/A LYS 169.A NZ GLU 40.A O no hydrogen 2.777 N/A LYS 169.A NZ GLU 173.A OE2 no hydrogen 2.839 N/A HIS 170.A N ARG 166.A O no hydrogen 2.991 N/A HIS 170.A NE2 GLU 65.A OE2 no hydrogen 2.828 N/A ILE 171.A N LEU 167.A O no hydrogen 2.980 N/A PHE 172.A N TYR 168.A O no hydrogen 2.819 N/A GLU 173.A N LYS 169.A O no hydrogen 2.879 N/A CYS 174.A N HIS 170.A O no hydrogen 3.163 N/A CYS 174.A N ILE 171.A O no hydrogen 3.023 N/A CYS 174.A SG HIS 170.A O no hydrogen 3.343 N/A ARG 175.A N PHE 172.A O no hydrogen 3.248 N/A ARG 175.A NH1 ASP 38.A OD1 no hydrogen 2.885 N/A ARG 175.A NH1 PHE 172.A O no hydrogen 2.842 N/A ARG 175.A NH2 ASP 38.A OD2 no hydrogen 2.961 N/A ARG 177.A N.A CYS 174.A O no hydrogen 3.062 N/A ARG 177.A N.B CYS 174.A O no hydrogen 3.082 N/A ARG 177.A NE.A ASP 178.A OD2 no hydrogen 3.473 N/A GLY 181.A N ASP 178.A OD1 no hydrogen 2.706 N/A ARG 182.A N ASP 178.A O no hydrogen 3.076 N/A ARG 182.A NE ARG 175.A O no hydrogen 2.907 N/A ARG 182.A NH2 ASP 176.A OD1 no hydrogen 2.875 N/A GLU 183.A N VAL 179.A O no hydrogen 3.012 N/A ASN 185.A N ARG 182.A O no hydrogen 2.855 N/A ILE 186.A N GLU 183.A O no hydrogen 2.796 N/A GLY 188.A N TRP 184.A O no hydrogen 3.129 N/A ARG 189.A N ILE 186.A O no hydrogen 3.002 N/A ARG 189.A NH2 GLU 183.A OE2 no hydrogen 3.263 N/A GLN 190.A N LEU 187.A O no hydrogen 3.362 N/A GLN 190.A NE2 HIS 208.A O no hydrogen 3.391 N/A GLN 191.A N VAL 114.A O no hydrogen 3.097 N/A PHE 192.A N GLN 190.A OE1 no hydrogen 2.982 N/A ARG 193.A NH1 ILE 204.A O no hydrogen 2.954 N/A ARG 193.A NH2 ILE 204.A O no hydrogen 2.805 N/A LEU 196.A N ASP 219.A OD2 no hydrogen 2.985 N/A PHE 198.A N ILE 195.A O no hydrogen 3.115 N/A TRP 200.A N PRO 197.A O no hydrogen 2.897 N/A TRP 200.A NE1 GLY 251.A O no hydrogen 3.074 N/A ILE 204.A N GLY 201.A O no hydrogen 3.191 N/A ARG 205.A NH2 GLY 188.A O no hydrogen 2.987 N/A HIS 207.A N VAL 222.A O no hydrogen 2.928 N/A HIS 207.A ND1 TRP 184.A O no hydrogen 2.937 N/A HIS 208.A N LEU 187.A O no hydrogen 3.009 N/A HIS 208.A ND1 ASP 219.A OD1 no hydrogen 2.755 N/A LYS 209.A N GLY 220.A O no hydrogen 3.086 N/A LYS 209.A NZ SER 116.A OG no hydrogen 2.807 N/A LYS 209.A NZ THR 210.A O no hydrogen 2.611 N/A GLY 211.A N HIS 218.A O no hydrogen 2.926 N/A SER 212.A OG GLU 217.A OE2 no hydrogen 2.933 N/A LEU 213.A N VAL 216.A O no hydrogen 2.990 N/A ARG 215.A N ASN 240.A OD1 no hydrogen 2.807 N/A ARG 215.A NE ASP 237.A OD1 no hydrogen 3.450 N/A ARG 215.A NH1 ASP 237.A OD1 no hydrogen 3.035 N/A ARG 215.A NH2 ASP 239.A OD1 no hydrogen 2.634 N/A VAL 216.A N LEU 213.A O no hydrogen 2.992 N/A HIS 218.A N GLY 211.A O no hydrogen 2.850 N/A HIS 218.A NE2 SER 55.A O.A no hydrogen 2.773 N/A HIS 218.A NE2 SER 55.A O.B no hydrogen 2.742 N/A ASP 219.A N LEU 234.A O no hydrogen 2.890 N/A GLY 220.A N LYS 209.A O no hydrogen 3.185 N/A GLY 221.A N PHE 232.A O no hydrogen 2.834 N/A VAL 222.A N HIS 207.A O no hydrogen 2.761 N/A ILE 223.A N PHE 230.A O no hydrogen 2.760 N/A THR 225.A N GLY 228.A O no hydrogen 2.871 N/A THR 225.A OG1 GLY 228.A O no hydrogen 2.807 N/A ARG 227.A N THR 225.A OG1 no hydrogen 3.053 N/A ARG 227.A NH1 LEU 261.A O no hydrogen 2.871 N/A GLY 228.A N THR 225.A O no hydrogen 3.008 N/A PHE 230.A N ILE 223.A O no hydrogen 2.924 N/A CYS 231.A N LEU 34.A O no hydrogen 2.777 N/A CYS 231.A SG GLY 221.A O no hydrogen 3.715 N/A PHE 232.A N GLY 221.A O no hydrogen 2.780 N/A ILE 233.A N ALA 32.A O no hydrogen 2.918 N/A LEU 234.A N ASP 219.A O no hydrogen 2.835 N/A LEU 235.A N SER 30.A O no hydrogen 2.790 N/A SER 236.A OG HIS 54.A ND1 no hydrogen 2.774 N/A ILE 238.A N ARG 215.A O no hydrogen 3.348 N/A ASN 240.A ND2 LEU 213.A O no hydrogen 2.878 N/A ASN 240.A ND2 GLU 217.A OE2 no hydrogen 2.794 N/A ARG 242.A N ASP 241.A OD1 no hydrogen 2.863 N/A ARG 242.A NH1 LEU 23.A O no hydrogen 2.817 N/A GLY 243.A N ASP 239.A O no hydrogen 2.934 N/A LYS 244.A N ASN 240.A O no hydrogen 3.040 N/A LYS 244.A NZ ASP 194.A OD2 no hydrogen 2.948 N/A LYS 244.A NZ GLU 217.A OE1 no hydrogen 2.867 N/A LYS 244.A NZ GLU 217.A OE2 no hydrogen 3.302 N/A GLU 245.A N ASP 241.A O no hydrogen 3.076 N/A LEU 246.A N ARG 242.A O no hydrogen 2.811 N/A GLY 247.A N GLY 243.A O no hydrogen 2.880 N/A ALA 248.A N LYS 244.A O no hydrogen 2.979 N/A GLN 249.A N GLU 245.A O no hydrogen 3.143 N/A VAL 250.A N LEU 246.A O no hydrogen 2.805 N/A GLY 251.A N GLY 247.A O no hydrogen 2.885 N/A ARG 252.A N ALA 248.A O no hydrogen 3.217 N/A ARG 252.A NH2 GLN 249.A OE1 no hydrogen 2.936 N/A ILE 253.A N GLN 249.A O no hydrogen 3.060 N/A LYS 254.A NZ GLU 258.A OE1 no hydrogen 2.790 N/A GLU 255.A N ARG 252.A O no hydrogen 3.103 N/A PHE 256.A N ILE 253.A O no hydrogen 2.964 N/A GLU 258.A N LYS 254.A O no hydrogen 3.064 N/A GLU 259.A N GLU 255.A O no hydrogen 2.862 N/A ALA 260.A N PHE 256.A O no hydrogen 2.881 N/A LEU 261.A N PHE 256.A O no hydrogen 2.941 N/A