Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5dem_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ILE 3.A O no hydrogen 3.068 N/A ASP 4.A N VAL 21.A O no hydrogen 2.917 N/A ARG 6.A N ASP 4.A OD1 no hydrogen 2.797 N/A ARG 6.A NE ASP 4.A OD1 no hydrogen 2.837 N/A ARG 6.A NH2 ASP 4.A OD1 no hydrogen 3.495 N/A ARG 6.A NH2 ASP 4.A OD2 no hydrogen 2.897 N/A ALA 7.A N ASP 4.A O no hydrogen 3.080 N/A ILE 8.A N SER 25.A O no hydrogen 2.773 N/A ASP 10.A N VAL 27.A O no hydrogen 2.857 N/A SER 12.A N ASP 10.A OD1 no hydrogen 2.798 N/A SER 12.A OG ASP 10.A OD1 no hydrogen 2.764 N/A ALA 13.A N ASP 10.A O no hydrogen 2.982 N/A ARG 14.A N VAL 31.A O no hydrogen 2.901 N/A ALA 16.A N ILE 33.A O no hydrogen 3.002 N/A VAL 19.A N ALA 16.A O no hydrogen 3.244 N/A GLN 20.A N THR 37.A O no hydrogen 3.059 N/A VAL 21.A N LEU 2.A O no hydrogen 2.977 N/A GLY 22.A N ILE 39.A O no hydrogen 2.940 N/A TRP 24.A N ARG 6.A O no hydrogen 3.367 N/A SER 25.A OG GLY 40.A O no hydrogen 2.632 N/A ILE 26.A N VAL 43.A O no hydrogen 2.798 N/A VAL 27.A N ILE 8.A O no hydrogen 2.786 N/A GLY 28.A N LEU 45.A O no hydrogen 2.904 N/A GLU 30.A N SER 12.A OG no hydrogen 3.040 N/A VAL 31.A N GLY 28.A O no hydrogen 3.335 N/A GLU 32.A N THR 49.A O no hydrogen 2.911 N/A ILE 33.A N ARG 14.A O no hydrogen 2.834 N/A GLY 34.A N ILE 51.A O no hydrogen 2.797 N/A GLY 36.A N ALA 17.A O no hydrogen 3.053 N/A THR 37.A N GLY 34.A O no hydrogen 3.227 N/A THR 37.A OG1 GLY 34.A O no hydrogen 3.336 N/A THR 37.A OG1 GLY 52.A O no hydrogen 2.781 N/A VAL 38.A N ASN 55.A O no hydrogen 2.912 N/A ILE 39.A N GLN 20.A O no hydrogen 2.806 N/A GLY 40.A N ILE 57.A O no hydrogen 2.820 N/A HIS 42.A N PRO 23.A O no hydrogen 3.048 N/A VAL 43.A N SER 25.A OG no hydrogen 2.907 N/A VAL 44.A N SER 61.A O no hydrogen 2.980 N/A LEU 45.A N ILE 26.A O no hydrogen 2.812 N/A LYS 46.A N VAL 63.A O no hydrogen 2.895 N/A LYS 46.A NZ ASP 66.A OD1 no hydrogen 3.519 N/A THR 49.A N GLU 30.A O no hydrogen 3.037 N/A THR 49.A OG1 LYS 46.A O no hydrogen 2.711 N/A LYS 50.A N LEU 79.A O no hydrogen 2.906 N/A ILE 51.A N GLU 32.A O no hydrogen 2.792 N/A GLY 52.A N ILE 81.A O no hydrogen 2.915 N/A GLY 52.A N GLY 82.A O no hydrogen 3.214 N/A LYS 53.A N ASP 83.A OD1 no hydrogen 2.839 N/A HIS 54.A N GLU 35.A O no hydrogen 2.871 N/A ASN 55.A N THR 37.A OG1 no hydrogen 3.071 N/A ASN 55.A ND2 GLY 82.A O no hydrogen 2.896 N/A ARG 56.A N ASN 85.A O no hydrogen 2.949 N/A ILE 57.A N VAL 38.A O no hydrogen 2.893 N/A TYR 58.A N ILE 87.A O no hydrogen 2.800 N/A GLN 59.A N GLN 59.A OE1 no hydrogen 2.825 N/A PHE 60.A N HIS 42.A O no hydrogen 2.730 N/A SER 61.A OG TYR 58.A O no hydrogen 3.028 N/A SER 62.A N VAL 91.A O no hydrogen 2.898 N/A VAL 63.A N VAL 44.A O no hydrogen 2.855 N/A GLY 64.A N ILE 93.A O no hydrogen 2.815 N/A ASP 69.A N THR 67.A OG1 no hydrogen 3.092 N/A LYS 73.A NZ GLU 75.A OE2 no hydrogen 2.633 N/A THR 77.A OG1 GLY 96.A O no hydrogen 2.861 N/A ARG 78.A N ALA 102.A O no hydrogen 2.904 N/A ARG 78.A NE GLU 103.A OE1 no hydrogen 3.091 N/A ARG 78.A NH1 GLU 103.A OE1 no hydrogen 3.086 N/A LEU 79.A N PRO 48.A O no hydrogen 3.197 N/A VAL 80.A N THR 104.A O no hydrogen 2.886 N/A ILE 81.A N LYS 50.A O no hydrogen 2.783 N/A GLY 82.A N ILE 106.A O no hydrogen 2.923 N/A GLY 82.A N GLY 107.A O no hydrogen 3.161 N/A ASP 83.A N ASP 108.A OD1 no hydrogen 2.802 N/A HIS 84.A N LYS 53.A O no hydrogen 2.854 N/A ASN 85.A N ASN 55.A OD1 no hydrogen 2.812 N/A ASN 85.A ND2 ASN 55.A OD1 no hydrogen 3.075 N/A ASN 85.A ND2 GLY 107.A O no hydrogen 2.886 N/A VAL 86.A N ASN 110.A O no hydrogen 2.925 N/A ILE 87.A N ARG 56.A O no hydrogen 2.903 N/A ARG 88.A N ILE 112.A O no hydrogen 2.872 N/A ARG 88.A NE GLU 89.A OE1 no hydrogen 2.957 N/A ARG 88.A NH2 GLU 89.A OE1 no hydrogen 3.404 N/A ARG 88.A NH2 GLU 89.A OE2 no hydrogen 3.141 N/A GLU 89.A N GLU 89.A OE1 no hydrogen 2.759 N/A GLY 90.A N GLN 59.A O no hydrogen 3.030 N/A VAL 91.A N SER 61.A OG no hydrogen 3.190 N/A THR 92.A N ALA 116.A O no hydrogen 3.049 N/A THR 92.A OG1 HIS 117.A ND1 no hydrogen 2.810 N/A ILE 93.A N SER 62.A O no hydrogen 2.970 N/A HIS 94.A N ILE 118.A O no hydrogen 3.039 N/A ARG 95.A N GLU 65.A O no hydrogen 2.985 N/A ARG 95.A NE THR 77.A O no hydrogen 2.899 N/A ARG 95.A NH1 GLY 64.A O no hydrogen 2.730 N/A ARG 95.A NH1 ASP 66.A OD1 no hydrogen 2.811 N/A ARG 95.A NH2 ASP 66.A OD1 no hydrogen 3.000 N/A GLY 96.A N ARG 78.A O no hydrogen 3.184 N/A THR 97.A N ASP 121.A OD1 no hydrogen 2.880 N/A THR 97.A OG1 ASP 121.A OD2 no hydrogen 2.660 N/A ARG 101.A N ASP 121.A OD1 no hydrogen 3.180 N/A ARG 101.A NH2 GLU 103.A O no hydrogen 2.825 N/A ARG 101.A NH2 THR 105.A OG1 no hydrogen 3.061 N/A THR 104.A N ARG 78.A O no hydrogen 3.015 N/A THR 104.A OG1 HIS 94.A O no hydrogen 2.695 N/A THR 105.A N SER 122.A O no hydrogen 2.961 N/A THR 105.A OG1 GLU 103.A OE2 no hydrogen 2.636 N/A ILE 106.A N VAL 80.A O no hydrogen 2.807 N/A ASP 108.A N ASN 126.A OD1 no hydrogen 2.831 N/A HIS 109.A N ASP 83.A O no hydrogen 2.898 N/A ASN 110.A N ASN 85.A OD1 no hydrogen 2.877 N/A ASN 110.A ND2 ASN 85.A OD1 no hydrogen 2.975 N/A ASN 110.A ND2 GLY 125.A O no hydrogen 2.891 N/A LEU 111.A N CYS 128.A O no hydrogen 2.942 N/A ILE 112.A N VAL 86.A O no hydrogen 2.848 N/A MET 113.A N LEU 130.A O no hydrogen 2.795 N/A TYR 115.A N GLU 89.A O no hydrogen 2.805 N/A ALA 116.A N MET 113.A O no hydrogen 3.210 N/A HIS 117.A N THR 134.A O no hydrogen 2.771 N/A HIS 117.A ND1 THR 92.A OG1 no hydrogen 2.810 N/A ILE 118.A N THR 92.A O no hydrogen 2.866 N/A GLY 119.A N LEU 136.A O no hydrogen 2.880 N/A HIS 120.A ND1 ASP 121.A OD2 no hydrogen 2.910 N/A HIS 120.A NE2 ASP 69.A OD2 no hydrogen 2.833 N/A ASP 121.A N THR 104.A OG1 no hydrogen 2.958 N/A SER 122.A N GLY 119.A O no hydrogen 3.194 N/A SER 122.A OG GLY 119.A O no hydrogen 2.848 N/A VAL 123.A N VAL 140.A O no hydrogen 2.802 N/A ILE 124.A N THR 105.A O no hydrogen 2.733 N/A GLY 125.A N VAL 142.A O no hydrogen 2.863 N/A ASN 126.A N ASP 144.A OD1 no hydrogen 2.823 N/A HIS 127.A N ASP 108.A O no hydrogen 2.949 N/A CYS 128.A N ASN 110.A OD1 no hydrogen 2.804 N/A CYS 128.A SG ASN 126.A O no hydrogen 3.737 N/A CYS 128.A SG ASP 143.A O no hydrogen 3.214 N/A ILE 129.A N ALA 146.A O no hydrogen 2.970 N/A LEU 130.A N LEU 111.A O no hydrogen 2.904 N/A VAL 131.A N LEU 148.A O no hydrogen 2.843 N/A ASN 133.A N ALA 114.A O no hydrogen 2.898 N/A THR 134.A N VAL 131.A O no hydrogen 3.093 N/A THR 134.A OG1 VAL 131.A O no hydrogen 2.871 N/A THR 134.A OG1 LEU 148.A O no hydrogen 3.536 N/A THR 134.A OG1 SER 149.A O no hydrogen 3.276 N/A ALA 135.A N THR 152.A O no hydrogen 2.827 N/A LEU 136.A N HIS 117.A O no hydrogen 2.858 N/A ALA 137.A N VAL 154.A O no hydrogen 2.975 N/A HIS 139.A N HIS 120.A O no hydrogen 2.856 N/A HIS 139.A ND1 ASP 100.A OD2 no hydrogen 2.313 N/A VAL 140.A N SER 122.A OG no hydrogen 3.293 N/A HIS 141.A N CYS 158.A O no hydrogen 3.141 N/A VAL 142.A N VAL 123.A O no hydrogen 2.768 N/A ASP 143.A N ILE 160.A O no hydrogen 2.916 N/A ASP 144.A N ASP 143.A OD1 no hydrogen 2.795 N/A TRP 145.A N ASN 126.A O no hydrogen 2.990 N/A ALA 146.A N ASP 143.A O no hydrogen 3.363 N/A ILE 147.A N SER 164.A O no hydrogen 2.900 N/A LEU 148.A N ILE 129.A O no hydrogen 2.865 N/A SER 149.A N SER 166.A O no hydrogen 3.076 N/A SER 149.A N SER 166.A OG no hydrogen 3.221 N/A SER 149.A OG SER 166.A O no hydrogen 2.684 N/A TYR 151.A N ASN 132.A O no hydrogen 2.869 N/A THR 152.A N SER 149.A O no hydrogen 3.181 N/A THR 152.A OG1 SER 149.A O no hydrogen 2.754 N/A THR 152.A OG1 SER 166.A OG no hydrogen 2.683 N/A THR 152.A OG1 GLY 167.A O no hydrogen 3.463 N/A LEU 153.A N SER 170.A O no hydrogen 2.840 N/A VAL 154.A N ALA 135.A O no hydrogen 2.841 N/A HIS 155.A N.A ILE 172.A O no hydrogen 2.913 N/A HIS 155.A N.B ILE 172.A O no hydrogen 2.922 N/A HIS 155.A ND1.A ILE 172.A O no hydrogen 3.046 N/A HIS 155.A ND1.B GLN 156.A O no hydrogen 2.936 N/A TYR 157.A N GLY 138.A O no hydrogen 3.035 N/A CYS 158.A N HIS 155.A O.A no hydrogen 3.328 N/A CYS 158.A N HIS 155.A O.B no hydrogen 3.321 N/A CYS 158.A SG HIS 155.A O.A no hydrogen 3.498 N/A CYS 158.A SG HIS 155.A O.B no hydrogen 3.501 N/A ARG 159.A N ASP 175.A OD1 no hydrogen 2.862 N/A ILE 160.A N HIS 141.A O no hydrogen 2.737 N/A GLY 161.A N VAL 176.A O no hydrogen 2.763 N/A HIS 163.A N ASP 144.A O no hydrogen 2.900 N/A SER 164.A N GLY 161.A O no hydrogen 3.176 N/A SER 164.A OG GLY 161.A O no hydrogen 2.789 N/A PHE 165.A N VAL 180.A O no hydrogen 3.044 N/A SER 166.A N ILE 147.A O no hydrogen 2.995 N/A SER 166.A OG THR 152.A OG1 no hydrogen 2.683 N/A GLY 167.A N VAL 182.A O no hydrogen 2.860 N/A GLY 169.A N GLY 150.A O no hydrogen 2.811 N/A SER 170.A N GLY 167.A O no hydrogen 3.171 N/A SER 170.A OG GLY 167.A O no hydrogen 2.721 N/A SER 170.A OG VAL 182.A O no hydrogen 3.523 N/A ALA 171.A N GLY 184.A O no hydrogen 2.905 N/A ILE 172.A N LEU 153.A O no hydrogen 2.750 N/A ASP 175.A N GLY 254.A O no hydrogen 3.296 N/A VAL 176.A N ARG 159.A O no hydrogen 2.850 N/A ALA 178.A N SER 247.A OG no hydrogen 2.954 N/A TYR 179.A N ALA 162.A O no hydrogen 2.780 N/A TYR 179.A OH GLU 240.A O no hydrogen 2.916 N/A VAL 180.A N PRO 177.A O no hydrogen 3.199 N/A THR 181.A N SER 191.A O no hydrogen 2.846 N/A VAL 182.A N PHE 165.A O no hydrogen 2.907 N/A PHE 183.A N GLU 188.A O no hydrogen 3.029 N/A ALA 187.A N ALA 171.A O no hydrogen 2.947 N/A GLU 188.A N PHE 183.A O no hydrogen 2.852 N/A ALA 189.A N ARG 257.A O no hydrogen 2.905 N/A ARG 190.A N THR 181.A O no hydrogen 2.847 N/A SER 191.A N THR 181.A OG1 no hydrogen 3.035 N/A ASN 193.A N TYR 179.A O no hydrogen 2.712 N/A ASN 193.A ND2 HIS 163.A O no hydrogen 2.903 N/A PHE 194.A N MET 192.A O no hydrogen 2.908 N/A GLY 196.A N ASN 193.A OD1 no hydrogen 3.187 N/A MET 197.A N ASN 193.A O no hydrogen 3.170 N/A ARG 198.A N PHE 194.A O no hydrogen 3.005 N/A ARG 199.A N GLU 195.A O no hydrogen 2.990 N/A ARG 200.A N GLY 196.A O no hydrogen 3.143 N/A ARG 200.A N MET 197.A O no hydrogen 3.143 N/A GLY 201.A N ARG 198.A O no hydrogen 3.050 N/A PHE 202.A N MET 197.A O no hydrogen 3.051 N/A SER 204.A OG GLU 205.A OE2 no hydrogen 3.385 N/A ALA 206.A N SER 203.A OG no hydrogen 2.986 N/A ILE 207.A N SER 203.A O no hydrogen 3.007 N/A HIS 208.A N SER 204.A O no hydrogen 2.920 N/A ALA 209.A N GLU 205.A O no hydrogen 2.913 N/A LEU 210.A N ALA 206.A O no hydrogen 2.885 N/A ARG 211.A N ILE 207.A O no hydrogen 2.932 N/A ARG 212.A N HIS 208.A O no hydrogen 3.103 N/A ALA 213.A N ALA 209.A O no hydrogen 2.952 N/A TYR 214.A N LEU 210.A O no hydrogen 2.980 N/A LYS 215.A N ARG 211.A O no hydrogen 3.383 N/A VAL 216.A N ARG 212.A O no hydrogen 3.063 N/A VAL 217.A N ALA 213.A O no hydrogen 3.154 N/A TYR 218.A N TYR 214.A O no hydrogen 2.857 N/A TYR 218.A OH THR 256.A O no hydrogen 2.761 N/A ARG 219.A N LYS 215.A O no hydrogen 2.874 N/A HIS 222.A NE2 GLN 220.A OE1 no hydrogen 3.118 N/A THR 223.A N GLU 226.A OE1 no hydrogen 2.988 N/A GLU 226.A N THR 223.A OG1 no hydrogen 3.159 N/A ALA 227.A N THR 223.A O no hydrogen 2.902 N/A LEU 228.A N VAL 224.A O no hydrogen 2.861 N/A ALA 229.A N GLU 225.A O no hydrogen 3.148 N/A GLU 230.A N GLU 226.A O no hydrogen 2.881 N/A LEU 231.A N ALA 227.A O no hydrogen 2.904 N/A LEU 231.A N LEU 228.A O no hydrogen 3.226 N/A ALA 232.A N ALA 229.A O no hydrogen 3.347 N/A ALA 235.A N LEU 231.A O no hydrogen 2.871 N/A ALA 236.A N ALA 232.A O no hydrogen 3.031 N/A ALA 236.A N GLU 233.A O no hydrogen 3.184 N/A GLN 237.A N GLU 233.A O no hydrogen 3.195 N/A PHE 238.A N SER 234.A O no hydrogen 2.822 N/A GLU 240.A N GLU 240.A OE1 no hydrogen 2.770 N/A ALA 242.A N PHE 238.A O no hydrogen 3.023 N/A VAL 243.A N PRO 239.A O no hydrogen 3.043 N/A ARG 245.A N VAL 241.A O no hydrogen 2.861 N/A ARG 245.A NE ASP 246.A OD1 no hydrogen 2.750 N/A ARG 245.A NH2 ASP 246.A OD1 no hydrogen 3.325 N/A ASP 246.A N ALA 242.A O no hydrogen 2.780 N/A SER 247.A N VAL 243.A O no hydrogen 3.042 N/A SER 247.A OG PHE 244.A O no hydrogen 2.705 N/A ILE 248.A N PHE 244.A O no hydrogen 3.145 N/A GLN 249.A N ARG 245.A O no hydrogen 2.949 N/A SER 250.A N ASP 246.A O no hydrogen 2.996 N/A SER 250.A OG ASP 246.A O no hydrogen 3.165 N/A SER 250.A OG SER 247.A O no hydrogen 3.221 N/A ALA 251.A N ILE 248.A O no hydrogen 3.070 N/A THR 252.A N SER 250.A O no hydrogen 3.141 N/A THR 256.A N ASP 175.A O no hydrogen 2.776 N/A THR 256.A OG1 LYS 174.A O no hydrogen 3.031 N/A THR 256.A OG1 ASP 175.A O no hydrogen 3.102 N/A ARG 257.A NH1 VAL 217.A O no hydrogen 3.195 N/A