Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4few_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A SG SER 6.A O no hydrogen 3.926 N/A ARG 7.A NE PRO 8.A O no hydrogen 3.098 N/A ARG 9.A NH1 ARG 9.A O no hydrogen 3.401 N/A ASN 11.A ND2 SER 12.A OG no hydrogen 3.373 N/A ALA 16.A N ASN 13.A O no hydrogen 3.320 N/A LEU 18.A N ASP 15.A O no hydrogen 3.229 N/A TYR 21.A N LEU 18.A O no hydrogen 3.483 N/A TYR 21.A OH PRO 45.A O no hydrogen 2.611 N/A ARG 22.A N TYR 39.A O no hydrogen 2.652 N/A ALA 24.A N ARG 37.A O no hydrogen 3.143 N/A ASP 26.A N ILE 35.A O no hydrogen 2.881 N/A GLY 32.A N GLY 29.A O no hydrogen 3.029 N/A THR 34.A N HIS 51.A O no hydrogen 2.931 N/A TYR 36.A N LEU 49.A O no hydrogen 2.745 N/A ARG 37.A N ALA 24.A O no hydrogen 2.915 N/A ARG 37.A NH2 GLU 46.A OE2 no hydrogen 2.511 N/A LEU 38.A N LEU 47.A O no hydrogen 2.856 N/A TYR 39.A N ARG 22.A O no hydrogen 3.185 N/A LYS 41.A NZ TYR 19.A O no hydrogen 2.706 N/A ALA 44.A N LYS 41.A O no hydrogen 3.259 N/A LEU 47.A N LEU 38.A O no hydrogen 2.931 N/A PHE 48.A N THR 91.A O no hydrogen 2.770 N/A LEU 49.A N TYR 36.A O no hydrogen 2.825 N/A LYS 50.A N LEU 89.A O no hydrogen 2.810 N/A LYS 50.A NZ GLU 63.A OE1 no hydrogen 2.481 N/A LYS 50.A NZ ASP 207.A OD1 no hydrogen 2.991 N/A HIS 51.A N THR 34.A O no hydrogen 2.898 N/A HIS 51.A NE2 ASP 86.A OD2 no hydrogen 2.773 N/A GLY 52.A N ALA 87.A O no hydrogen 2.864 N/A GLY 54.A N ASP 85.A O no hydrogen 2.799 N/A ALA 57.A N GLY 54.A O no hydrogen 2.854 N/A ASN 58.A N SER 55.A O no hydrogen 2.878 N/A VAL 60.A N VAL 56.A O no hydrogen 3.016 N/A THR 61.A N ALA 57.A O no hydrogen 2.903 N/A THR 61.A OG1 ALA 57.A O no hydrogen 2.799 N/A ASP 62.A N ASN 58.A O no hydrogen 2.791 N/A GLU 63.A N ASP 59.A O no hydrogen 2.892 N/A ARG 65.A N ASP 62.A O no hydrogen 3.389 N/A ARG 65.A NE VAL 211.A O no hydrogen 2.906 N/A ARG 65.A NH1 ASP 62.A O no hydrogen 2.994 N/A LEU 66.A N GLU 63.A O no hydrogen 2.928 N/A TRP 68.A N VAL 64.A O no hydrogen 2.961 N/A LEU 69.A N ARG 65.A O no hydrogen 2.796 N/A THR 70.A N LEU 66.A O no hydrogen 3.145 N/A ALA 71.A N TRP 68.A O no hydrogen 3.293 N/A PHE 72.A N LEU 69.A O no hydrogen 2.829 N/A THR 76.A N THR 92.A OG1 no hydrogen 3.210 N/A LYS 78.A N LEU 90.A O no hydrogen 2.791 N/A HIS 79.A N LEU 90.A O no hydrogen 3.336 N/A HIS 79.A ND1 ASP 17.A OD2 no hydrogen 2.809 N/A ILE 81.A N TRP 88.A O no hydrogen 2.848 N/A ARG 82.A NH1 PRO 84.A O no hydrogen 3.237 N/A ARG 82.A NH1 ASP 86.A O no hydrogen 3.241 N/A ARG 82.A NH2 ASN 58.A OD1 no hydrogen 2.992 N/A THR 83.A N ASP 86.A O no hydrogen 2.811 N/A THR 83.A OG1 ASP 86.A O no hydrogen 3.542 N/A ASP 86.A N THR 83.A O no hydrogen 3.282 N/A ALA 87.A N GLY 52.A O no hydrogen 2.838 N/A TRP 88.A N ILE 81.A O no hydrogen 2.851 N/A LEU 89.A N LYS 50.A O no hydrogen 2.831 N/A LEU 90.A N HIS 79.A O no hydrogen 2.804 N/A THR 91.A N PHE 48.A O no hydrogen 2.789 N/A THR 92.A N THR 76.A O no hydrogen 2.920 N/A ALA 93.A N GLU 46.A O no hydrogen 2.989 N/A LYS 97.A N PHE 197.A O no hydrogen 2.767 N/A LYS 97.A NZ GLU 105.A OE1 no hydrogen 2.844 N/A THR 98.A N GLN 101.A OE1 no hydrogen 3.006 N/A THR 98.A OG1 GLN 101.A OE1 no hydrogen 3.569 N/A ALA 99.A N LEU 195.A O no hydrogen 2.780 N/A PHE 100.A N LEU 192.A O no hydrogen 2.999 N/A GLN 101.A N THR 98.A OG1 no hydrogen 2.937 N/A VAL 102.A N THR 98.A O no hydrogen 2.994 N/A LEU 103.A N ALA 99.A O no hydrogen 2.898 N/A GLU 104.A N PHE 100.A O no hydrogen 3.106 N/A GLU 105.A N GLN 101.A O no hydrogen 2.978 N/A TYR 106.A N VAL 102.A O no hydrogen 2.788 N/A SER 109.A N TYR 106.A O no hydrogen 2.748 N/A GLY 110.A N PRO 107.A O no hydrogen 3.391 N/A ILE 113.A N SER 109.A O no hydrogen 2.866 N/A VAL 114.A N GLY 110.A O no hydrogen 2.897 N/A ASP 115.A N GLU 111.A O no hydrogen 3.143 N/A ALA 116.A N ASN 112.A O no hydrogen 3.016 N/A LEU 117.A N ILE 113.A O no hydrogen 2.927 N/A ALA 118.A N VAL 114.A O no hydrogen 2.797 N/A VAL 119.A N ASP 115.A O no hydrogen 2.920 N/A PHE 120.A N ALA 116.A O no hydrogen 2.954 N/A LEU 121.A N LEU 117.A O no hydrogen 2.911 N/A ARG 122.A N ALA 118.A O no hydrogen 2.994 N/A ARG 122.A NE TYR 242.A O no hydrogen 2.819 N/A ARG 122.A NH2 TYR 242.A O no hydrogen 3.021 N/A ARG 123.A N VAL 119.A O no hydrogen 3.094 N/A LEU 124.A N PHE 120.A O no hydrogen 3.084 N/A HIS 125.A N LEU 121.A O no hydrogen 2.886 N/A HIS 125.A ND1 TYR 242.A OH no hydrogen 2.501 N/A HIS 125.A NE2 ASP 219.A OD2 no hydrogen 2.906 N/A SER 126.A N ARG 123.A O no hydrogen 3.183 N/A SER 126.A OG ARG 122.A O no hydrogen 3.496 N/A SER 126.A OG ARG 123.A O no hydrogen 2.728 N/A ILE 127.A N LEU 124.A O no hydrogen 3.173 N/A ASN 131.A N PRO 128.A O no hydrogen 2.963 N/A CYS 132.A N VAL 129.A O no hydrogen 2.964 N/A CYS 132.A SG PHE 134.A O no hydrogen 3.595 N/A SER 136.A N ILE 213.A O no hydrogen 2.999 N/A SER 136.A OG ARG 210.A O no hydrogen 3.223 N/A SER 136.A OG VAL 211.A O no hydrogen 3.130 N/A ASP 137.A N ASN 135.A OD1 no hydrogen 2.959 N/A ARG 138.A NH2 PHE 179.A O no hydrogen 3.164 N/A PHE 140.A N ASP 137.A OD1 no hydrogen 3.024 N/A ARG 141.A N ASP 137.A O no hydrogen 2.833 N/A ARG 141.A NE GLN 144.A OE1 no hydrogen 3.059 N/A LEU 142.A N ARG 138.A O no hydrogen 2.748 N/A ALA 143.A N VAL 139.A O no hydrogen 3.250 N/A GLN 144.A N PHE 140.A O no hydrogen 3.075 N/A ALA 145.A N ARG 141.A O no hydrogen 2.810 N/A GLN 146.A N LEU 142.A O no hydrogen 2.897 N/A SER 147.A N ALA 143.A O no hydrogen 3.136 N/A SER 147.A OG ALA 143.A O no hydrogen 3.223 N/A ARG 148.A N GLN 144.A O no hydrogen 3.059 N/A ARG 148.A NE PHE 259.A O no hydrogen 2.642 N/A ARG 148.A NH1 PHE 259.A O no hydrogen 3.379 N/A ASN 150.A N SER 147.A O no hydrogen 2.705 N/A LEU 152.A N ARG 148.A O no hydrogen 2.849 N/A SER 156.A N ASP 154.A OD1 no hydrogen 3.124 N/A SER 156.A OG ASP 154.A OD1 no hydrogen 2.621 N/A ASP 157.A N ASP 154.A O no hydrogen 3.004 N/A ASP 159.A N GLU 258.A OE2 no hydrogen 2.753 N/A GLU 161.A N GLU 161.A OE1 no hydrogen 2.834 N/A ARG 162.A N ASP 159.A O no hydrogen 2.784 N/A ARG 162.A NE GLU 258.A OE2 no hydrogen 2.663 N/A ARG 162.A NH2 ASP 159.A OD2 no hydrogen 2.836 N/A ARG 162.A NH2 GLU 258.A OE2 no hydrogen 3.371 N/A ASN 163.A N ASP 160.A O no hydrogen 3.108 N/A TRP 165.A N ARG 162.A O no hydrogen 2.985 N/A GLN 169.A N PRO 166.A O no hydrogen 2.901 N/A VAL 170.A N PRO 166.A O no hydrogen 3.390 N/A TRP 171.A N VAL 167.A O no hydrogen 3.012 N/A LYS 172.A N GLU 168.A O no hydrogen 3.008 N/A GLU 173.A N GLN 169.A O no hydrogen 2.909 N/A HIS 174.A ND1 TRP 171.A O no hydrogen 2.750 N/A LYS 175.A N GLU 173.A O no hydrogen 3.206 N/A LYS 175.A NZ GLU 173.A OE2 no hydrogen 2.570 N/A LEU 177.A N HIS 174.A O no hydrogen 3.332 N/A VAL 184.A N ALA 214.A O no hydrogen 2.873 N/A THR 186.A N GLY 212.A O no hydrogen 2.866 N/A THR 186.A OG1 GLY 212.A O no hydrogen 2.722 N/A HIS 187.A N ASP 219.A OD2 no hydrogen 2.984 N/A HIS 187.A NE2 ILE 206.A O no hydrogen 2.793 N/A GLY 188.A N ASP 219.A OD1 no hydrogen 2.963 N/A ASP 189.A N HIS 187.A ND1 no hydrogen 2.959 N/A SER 191.A N ASP 189.A O no hydrogen 2.737 N/A ASP 193.A N SER 191.A OG no hydrogen 3.089 N/A ASN 194.A N SER 191.A O no hydrogen 3.151 N/A ASN 194.A ND2 ASP 189.A O no hydrogen 2.862 N/A ILE 196.A N GLY 204.A O no hydrogen 2.899 N/A PHE 197.A N LYS 97.A O no hydrogen 2.655 N/A ASP 198.A N LYS 201.A O no hydrogen 2.838 N/A LYS 201.A N ASP 198.A O no hydrogen 3.044 N/A ILE 203.A N ILE 196.A O no hydrogen 2.968 N/A CYS 205.A N PRO 73.A O no hydrogen 3.275 N/A ILE 206.A N ASN 194.A O no hydrogen 2.916 N/A VAL 211.A N VAL 208.A O no hydrogen 3.061 N/A GLY 212.A N THR 186.A O no hydrogen 3.076 N/A ILE 213.A N PHE 134.A O no hydrogen 2.833 N/A ALA 214.A N VAL 184.A O no hydrogen 2.986 N/A ARG 216.A N ASP 182.A OD2 no hydrogen 2.948 N/A ARG 216.A NE ASP 182.A OD1 no hydrogen 3.339 N/A ARG 216.A NH1 TYR 242.A OH no hydrogen 3.091 N/A ARG 216.A NH2 ASP 182.A OD1 no hydrogen 3.233 N/A TYR 217.A N ASP 215.A OD1 no hydrogen 2.836 N/A GLN 218.A N ASP 215.A O no hydrogen 2.852 N/A GLN 218.A NE2 GLY 188.A O no hydrogen 2.839 N/A ASP 219.A N ARG 216.A O no hydrogen 3.120 N/A LEU 220.A N ARG 216.A O no hydrogen 3.109 N/A ALA 221.A N TYR 217.A O no hydrogen 2.840 N/A LEU 223.A N ASP 219.A O no hydrogen 3.277 N/A TRP 224.A N LEU 220.A O no hydrogen 2.889 N/A ASN 225.A N ALA 221.A O no hydrogen 2.854 N/A ASN 225.A ND2 ASP 159.A OD1 no hydrogen 3.061 N/A CYS 226.A N ILE 222.A O no hydrogen 3.066 N/A CYS 226.A SG ILE 222.A O no hydrogen 3.377 N/A LEU 227.A N LEU 223.A O no hydrogen 2.867 N/A GLY 228.A N TRP 224.A O no hydrogen 3.007 N/A GLY 228.A N ASN 225.A O no hydrogen 3.027 N/A GLU 229.A N CYS 226.A O no hydrogen 3.081 N/A PHE 230.A N LEU 227.A O no hydrogen 2.885 N/A SER 231.A N LEU 227.A O no hydrogen 3.067 N/A SER 231.A OG SER 233.A OG no hydrogen 2.847 N/A SER 233.A OG SER 231.A OG no hydrogen 2.847 N/A LEU 234.A N SER 231.A OG no hydrogen 3.014 N/A GLN 235.A N SER 231.A O no hydrogen 3.163 N/A GLN 235.A NE2 TRP 224.A O no hydrogen 3.087 N/A LYS 236.A N PRO 232.A O no hydrogen 2.969 N/A ARG 237.A N SER 233.A O no hydrogen 2.857 N/A ARG 237.A NE ASP 115.A OD1 no hydrogen 2.738 N/A ARG 237.A NH2 ASP 115.A OD2 no hydrogen 2.762 N/A LEU 238.A N LEU 234.A O no hydrogen 3.062 N/A GLN 240.A N LYS 236.A O no hydrogen 3.062 N/A LYS 241.A N ARG 237.A O no hydrogen 2.800 N/A TYR 242.A N LEU 238.A O no hydrogen 2.976 N/A TYR 242.A OH HIS 125.A ND1 no hydrogen 2.501 N/A GLY 243.A N PHE 239.A O no hydrogen 2.864 N/A ILE 244.A N PHE 239.A O no hydrogen 2.922 N/A ASP 248.A N TYR 217.A OH no hydrogen 2.862 N/A ASN 249.A ND2 LEU 176.A O no hydrogen 2.910 N/A LYS 250.A N ASP 248.A OD1 no hydrogen 2.977 N/A LYS 250.A NZ SER 180.A O no hydrogen 3.226 N/A LYS 250.A NZ ASP 215.A OD2 no hydrogen 2.569 N/A LEU 251.A N ASP 248.A O no hydrogen 2.873 N/A PHE 253.A N ASN 249.A O no hydrogen 2.930 N/A HIS 254.A N LYS 250.A O no hydrogen 3.105 N/A HIS 254.A ND1 LYS 250.A O no hydrogen 2.760 N/A LEU 255.A N LEU 251.A O no hydrogen 3.089 N/A ASP 257.A N HIS 254.A O no hydrogen 3.106 N/A PHE 259.A N LEU 256.A O no hydrogen 3.126 N/A PHE 260.A N ASP 257.A O no hydrogen 3.217 N/A