Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4urf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N GLU 28.A OE1 no hydrogen 2.830 N/A LEU 3.A N GLU 28.A O no hydrogen 2.836 N/A GLY 5.A N GLY 29.A O no hydrogen 3.155 N/A LYS 6.A N.A LEU 3.A O no hydrogen 3.070 N/A LYS 6.A N.B LEU 3.A O no hydrogen 3.058 N/A LYS 6.A NZ.A ASP 229.A OD1.A no hydrogen 2.610 N/A THR 7.A N ASP 84.A OD2 no hydrogen 2.843 N/A ALA 8.A N ASN 31.A O no hydrogen 2.845 N/A LEU 9.A N.A ILE 85.A O no hydrogen 2.942 N/A LEU 9.A N.B ILE 85.A O no hydrogen 2.901 N/A VAL 10.A N VAL 33.A O no hydrogen 3.045 N/A THR 11.A N CYS 87.A O no hydrogen 3.014 N/A THR 11.A OG1 CYS 87.A O no hydrogen 3.552 N/A ALA 13.A N SER 35.A O.A no hydrogen 2.894 N/A ALA 13.A N SER 35.A O.B no hydrogen 2.817 N/A GLY 14.A N ASP 36.A OD2 no hydrogen 2.793 N/A ARG 19.A N ASN 15.A O no hydrogen 3.174 N/A ARG 19.A NE THR 45.A OG1 no hydrogen 2.866 N/A ARG 19.A NH1 GLU 44.A OE1 no hydrogen 3.006 N/A ARG 19.A NH2 TRP 41.A O no hydrogen 3.181 N/A ARG 19.A NH2 GLU 44.A OE1 no hydrogen 2.863 N/A ARG 19.A NH2 THR 45.A OG1 no hydrogen 3.208 N/A THR 20.A N GLY 16.A O no hydrogen 3.245 N/A THR 20.A OG1 GLY 16.A O no hydrogen 3.376 N/A THR 20.A OG1 THR 216.A OG1 no hydrogen 2.738 N/A ILE 21.A N ILE 17.A O no hydrogen 2.796 N/A ALA 22.A N GLY 18.A O no hydrogen 2.913 N/A LEU 23.A N ARG 19.A O no hydrogen 2.945 N/A THR 24.A N THR 20.A O no hydrogen 2.852 N/A THR 24.A OG1 THR 20.A O no hydrogen 2.776 N/A TYR 25.A N ILE 21.A O no hydrogen 2.799 N/A TYR 25.A OH SER 227.A OG no hydrogen 2.756 N/A ALA 26.A N ALA 22.A O no hydrogen 3.039 N/A ALA 27.A N LEU 23.A O no hydrogen 2.882 N/A GLU 28.A N THR 24.A O no hydrogen 2.927 N/A GLY 29.A N ALA 26.A O no hydrogen 2.939 N/A ALA 30.A N TYR 25.A O no hydrogen 3.027 N/A ASN 31.A N LYS 6.A O.A no hydrogen 2.725 N/A ASN 31.A N LYS 6.A O.B no hydrogen 2.833 N/A VAL 32.A N LYS 55.A O no hydrogen 2.919 N/A VAL 33.A N ALA 8.A O no hydrogen 2.778 N/A VAL 34.A N VAL 57.A O no hydrogen 2.836 N/A SER 35.A N.A VAL 10.A O no hydrogen 3.047 N/A SER 35.A N.B VAL 10.A O no hydrogen 3.119 N/A SER 35.A OG.A VAL 10.A O no hydrogen 2.862 N/A SER 35.A OG.B GLN 59.A O no hydrogen 2.873 N/A SER 38.A N ASP 36.A OD1 no hydrogen 2.793 N/A TRP 41.A N SER 38.A OG no hydrogen 3.118 N/A GLY 42.A N SER 38.A O no hydrogen 2.860 N/A ARG 43.A N.A ASP 39.A O no hydrogen 2.821 N/A ARG 43.A N.B ASP 39.A O no hydrogen 2.886 N/A GLU 44.A N GLU 40.A O no hydrogen 3.153 N/A THR 45.A N TRP 41.A O no hydrogen 2.975 N/A THR 45.A OG1 ALA 13.A O no hydrogen 2.692 N/A THR 45.A OG1 TRP 41.A O no hydrogen 3.371 N/A LEU 46.A N GLY 42.A O no hydrogen 2.996 N/A ALA 47.A N ARG 43.A O.A no hydrogen 2.909 N/A ALA 47.A N ARG 43.A O.B no hydrogen 2.903 N/A LEU 48.A N GLU 44.A O no hydrogen 2.866 N/A ILE 49.A N THR 45.A O no hydrogen 3.047 N/A GLU 50.A N LEU 46.A O no hydrogen 2.909 N/A GLY 51.A N ALA 47.A O no hydrogen 2.824 N/A LYS 52.A N LEU 48.A O no hydrogen 3.258 N/A LYS 52.A N ILE 49.A O no hydrogen 3.192 N/A GLY 53.A N GLU 50.A O no hydrogen 3.011 N/A GLY 54.A N ILE 49.A O no hydrogen 2.916 N/A VAL 57.A N VAL 32.A O no hydrogen 2.998 N/A GLN 59.A N VAL 34.A O no hydrogen 2.892 N/A HIS 60.A ND1 ASP 39.A OD1 no hydrogen 2.674 N/A ALA 61.A N ASP 36.A O no hydrogen 3.065 N/A ASP 62.A N ASP 68.A OD2 no hydrogen 2.803 N/A ALA 64.A N ASP 62.A OD1 no hydrogen 3.047 N/A HIS 65.A N ASP 62.A O no hydrogen 3.028 N/A GLU 67.A N GLU 67.A OE1 no hydrogen 2.815 N/A ASP 68.A N HIS 65.A O no hydrogen 2.993 N/A HIS 69.A N PRO 66.A O no hydrogen 3.039 N/A HIS 69.A NE2 THR 63.A O no hydrogen 2.841 N/A GLU 71.A N GLU 67.A O no hydrogen 3.392 N/A LEU 72.A N.A ASP 68.A O no hydrogen 3.037 N/A LEU 72.A N.B ASP 68.A O no hydrogen 3.039 N/A LEU 72.A N.B HIS 69.A O no hydrogen 3.173 N/A ILE 73.A N HIS 69.A O no hydrogen 3.044 N/A ALA 74.A N ASP 70.A O no hydrogen 2.885 N/A ALA 75.A N GLU 71.A O no hydrogen 2.939 N/A ALA 76.A N LEU 72.A O.A no hydrogen 2.907 N/A ALA 76.A N LEU 72.A O.B no hydrogen 3.086 N/A LYS 77.A N ILE 73.A O no hydrogen 2.988 N/A LYS 77.A NZ GLU 131.A OE1 no hydrogen 3.223 N/A LYS 77.A NZ GLU 131.A OE2 no hydrogen 2.846 N/A ARG 78.A N ALA 74.A O no hydrogen 2.856 N/A ALA 79.A N ALA 75.A O no hydrogen 3.042 N/A PHE 80.A N ALA 76.A O no hydrogen 2.907 N/A GLY 81.A N LYS 77.A O no hydrogen 2.864 N/A ARG 82.A NE ASP 84.A OD1 no hydrogen 2.849 N/A ARG 82.A NH2 ASP 84.A OD1 no hydrogen 3.214 N/A ASP 84.A N THR 7.A O no hydrogen 2.923 N/A ILE 85.A N THR 7.A O no hydrogen 2.941 N/A ALA 86.A N ALA 136.A O no hydrogen 2.983 N/A CYS 87.A N LEU 9.A O.A no hydrogen 2.802 N/A CYS 87.A N LEU 9.A O.B no hydrogen 2.900 N/A CYS 87.A SG VAL 138.A O no hydrogen 3.689 N/A ASN 88.A N VAL 138.A O no hydrogen 2.869 N/A ASN 88.A ND2 GLN 125.A OE1 no hydrogen 2.935 N/A ASN 88.A ND2 ASN 139.A OD1 no hydrogen 2.985 N/A ASN 89.A N THR 11.A OG1 no hydrogen 2.899 N/A ASN 89.A ND2 THR 11.A O no hydrogen 3.122 N/A ALA 90.A N THR 11.A OG1 no hydrogen 2.985 N/A ILE 92.A N ASN 114.A OD1 no hydrogen 2.945 N/A SER 93.A OG GLY 94.A O no hydrogen 2.708 N/A THR 97.A N GLY 151.A O no hydrogen 2.859 N/A THR 97.A OG1 GLU 95.A O.B no hydrogen 3.139 N/A THR 99.A OG1 THR 153.A OG1 no hydrogen 2.724 N/A GLU 101.A N PRO 98.A O no hydrogen 2.955 N/A THR 102.A N THR 99.A O no hydrogen 3.103 N/A THR 102.A OG1 PRO 98.A O no hydrogen 2.926 N/A THR 103.A N GLN 106.A OE1 no hydrogen 2.939 N/A THR 103.A OG1 GLN 106.A OE1 no hydrogen 3.529 N/A GLN 106.A N THR 103.A OG1 no hydrogen 3.108 N/A GLN 106.A NE2 THR 97.A OG1 no hydrogen 2.963 N/A TRP 107.A N THR 103.A O no hydrogen 3.041 N/A GLN 108.A N ASP 104.A O no hydrogen 2.843 N/A ARG 109.A N ALA 105.A O no hydrogen 2.940 N/A VAL 110.A N GLN 106.A O no hydrogen 3.214 N/A ILE 111.A N TRP 107.A O no hydrogen 2.958 N/A GLY 112.A N GLN 108.A O no hydrogen 2.854 N/A ILE 113.A N ARG 109.A O no hydrogen 3.152 N/A ASN 114.A N VAL 110.A O no hydrogen 2.841 N/A ASN 114.A ND2 ILE 92.A O no hydrogen 2.770 N/A LEU 115.A N ILE 111.A O no hydrogen 2.967 N/A SER 116.A N ILE 111.A O no hydrogen 2.866 N/A PHE 119.A N LEU 115.A O no hydrogen 2.977 N/A TYR 120.A N SER 116.A O no hydrogen 2.806 N/A GLY 121.A N GLY 117.A O no hydrogen 3.142 N/A VAL 122.A N VAL 118.A O no hydrogen 2.805 N/A ARG 123.A N PHE 119.A O no hydrogen 2.859 N/A ALA 124.A N TYR 120.A O no hydrogen 3.172 N/A GLN 125.A N GLY 121.A O no hydrogen 2.797 N/A GLN 125.A NE2 ASN 88.A OD1 no hydrogen 2.911 N/A ILE 126.A N VAL 122.A O no hydrogen 2.839 N/A ARG 127.A N ARG 123.A O no hydrogen 3.339 N/A ALA 128.A N ALA 124.A O no hydrogen 3.139 N/A MET 129.A N GLN 125.A O no hydrogen 2.869 N/A LEU 130.A N ILE 126.A O no hydrogen 2.912 N/A GLU 131.A N ALA 128.A O no hydrogen 3.153 N/A THR 132.A N MET 129.A O no hydrogen 3.100 N/A GLY 134.A N MET 129.A O no hydrogen 2.982 N/A GLY 135.A N GLY 177.A O no hydrogen 2.948 N/A ALA 136.A N ASP 84.A O no hydrogen 2.922 N/A ILE 137.A N ARG 179.A O no hydrogen 2.848 N/A VAL 138.A N ALA 86.A O no hydrogen 2.810 N/A ASN 139.A N ASN 181.A O no hydrogen 2.862 N/A ASN 139.A ND2 THR 166.A OG1 no hydrogen 3.062 N/A ILE 140.A N ASN 88.A O no hydrogen 2.983 N/A SER 141.A N VAL 183.A O no hydrogen 2.710 N/A SER 141.A OG LYS 159.A O no hydrogen 2.918 N/A ILE 143.A N PRO 185.A O no hydrogen 2.913 N/A ALA 144.A N SER 142.A OG no hydrogen 2.828 N/A GLY 145.A N SER 142.A O no hydrogen 2.832 N/A GLN 146.A N ILE 143.A O no hydrogen 2.908 N/A ILE 147.A N ILE 143.A O no hydrogen 2.957 N/A ILE 152.A N ILE 149.A O no hydrogen 3.206 N/A THR 153.A OG1 THR 99.A OG1 no hydrogen 2.724 N/A THR 156.A N ILE 152.A O no hydrogen 2.929 N/A THR 156.A OG1 ILE 152.A O no hydrogen 2.991 N/A ALA 157.A N THR 153.A O no hydrogen 2.923 N/A ALA 158.A N PRO 154.A O no hydrogen 2.884 N/A LYS 159.A N TYR 155.A O no hydrogen 2.831 N/A LYS 159.A NZ ILE 140.A O no hydrogen 2.876 N/A LYS 159.A NZ SER 141.A O no hydrogen 3.421 N/A HIS 160.A N THR 156.A O no hydrogen 2.965 N/A HIS 160.A ND1 ALA 144.A O no hydrogen 2.827 N/A HIS 160.A ND1 THR 156.A O no hydrogen 3.030 N/A GLY 161.A N ALA 157.A O no hydrogen 2.897 N/A VAL 162.A N ALA 158.A O no hydrogen 2.960 N/A VAL 163.A N LYS 159.A O no hydrogen 3.324 N/A GLY 164.A N HIS 160.A O no hydrogen 3.067 N/A LEU 165.A N.A GLY 161.A O no hydrogen 3.012 N/A LEU 165.A N.B GLY 161.A O no hydrogen 2.916 N/A THR 166.A N VAL 162.A O no hydrogen 3.205 N/A THR 166.A OG1 VAL 162.A O no hydrogen 2.812 N/A THR 166.A OG1 SER 182.A OG.A no hydrogen 2.857 N/A LYS 167.A N GLY 164.A O no hydrogen 3.037 N/A THR 168.A N.A GLY 164.A O no hydrogen 3.368 N/A THR 168.A N.B GLY 164.A O no hydrogen 3.382 N/A THR 168.A OG1.B LEU 165.A O.A no hydrogen 3.123 N/A THR 168.A OG1.B LEU 165.A O.B no hydrogen 2.742 N/A VAL 169.A N LEU 165.A O.A no hydrogen 3.115 N/A VAL 169.A N LEU 165.A O.B no hydrogen 3.041 N/A ALA 170.A N THR 166.A O no hydrogen 3.058 N/A TRP 171.A N LYS 167.A O no hydrogen 3.422 N/A GLU 172.A N THR 168.A O.A no hydrogen 2.990 N/A GLU 172.A N THR 168.A O.B no hydrogen 2.913 N/A TYR 173.A N VAL 169.A O no hydrogen 2.999 N/A LYS 176.A N TYR 173.A O no hydrogen 2.983 N/A GLY 177.A N GLY 174.A O no hydrogen 3.195 N/A ILE 178.A N TYR 173.A O no hydrogen 3.280 N/A ARG 179.A N GLY 135.A O no hydrogen 2.889 N/A ARG 179.A NH1 LEU 226.A O no hydrogen 3.104 N/A ARG 179.A NH1 VAL 234.A O no hydrogen 3.003 N/A ARG 179.A NH2 LEU 226.A O no hydrogen 3.015 N/A ILE 180.A N THR 235.A OG1 no hydrogen 3.020 N/A ASN 181.A N ILE 137.A O no hydrogen 3.053 N/A ASN 181.A ND2 VAL 234.A O no hydrogen 2.976 N/A SER 182.A N.A SER 237.A O no hydrogen 2.851 N/A SER 182.A N.B SER 237.A O no hydrogen 2.866 N/A SER 182.A OG.A THR 166.A OG1 no hydrogen 2.857 N/A SER 182.A OG.B SER 237.A O no hydrogen 3.567 N/A VAL 183.A N ASN 139.A O no hydrogen 2.861 N/A GLY 184.A N TYR 239.A O.A no hydrogen 2.767 N/A GLY 184.A N TYR 239.A O.B no hydrogen 2.920 N/A ALA 186.A N VAL 241.A O no hydrogen 3.097 N/A PHE 187.A N HIS 208.A NE2 no hydrogen 3.252 N/A ASN 189.A N GLY 214.A O no hydrogen 2.745 N/A ASN 189.A ND2 GLU 215.A OE1 no hydrogen 2.952 N/A THR 190.A N ILE 188.A O no hydrogen 2.864 N/A GLN 194.A N THR 190.A O no hydrogen 3.144 N/A GLN 194.A NE2 ASN 189.A OD1 no hydrogen 2.959 N/A ASN 195.A N LEU 192.A O no hydrogen 3.037 N/A ASN 195.A ND2 THR 191.A O no hydrogen 2.904 N/A VAL 196.A N VAL 193.A O.A no hydrogen 3.124 N/A ARG 201.A N.A PRO 197.A O no hydrogen 2.944 N/A ARG 201.A N.B PRO 197.A O no hydrogen 2.978 N/A ARG 201.A NE.A GLU 205.A OE2 no hydrogen 2.830 N/A ARG 202.A N LEU 198.A O no hydrogen 2.792 N/A ARG 202.A NH1 GLU 205.A OE1 no hydrogen 2.796 N/A GLN 203.A N GLU 199.A O.A no hydrogen 3.047 N/A GLN 203.A N GLU 199.A O.B no hydrogen 3.073 N/A LEU 204.A N THR 200.A O no hydrogen 2.957 N/A GLU 205.A N ARG 201.A O.A no hydrogen 2.820 N/A GLU 205.A N ARG 201.A O.B no hydrogen 2.796 N/A GLN 206.A N.A ARG 202.A O no hydrogen 3.075 N/A GLN 206.A N.B ARG 202.A O no hydrogen 3.086 N/A GLN 206.A NE2.A ARG 202.A O no hydrogen 3.123 N/A MET 207.A N.A LEU 204.A O no hydrogen 2.981 N/A MET 207.A N.B LEU 204.A O no hydrogen 2.999 N/A HIS 208.A N GLU 205.A O no hydrogen 3.043 N/A HIS 208.A ND1 LEU 204.A O no hydrogen 2.827 N/A LEU 210.A N GLY 243.A O no hydrogen 3.185 N/A ARG 211.A N.A HIS 208.A O no hydrogen 2.904 N/A ARG 211.A N.B HIS 208.A O no hydrogen 2.881 N/A ARG 211.A NH1.A ALA 209.A O no hydrogen 2.806 N/A ARG 211.A NH1.B GLN 206.A OE1.A no hydrogen 2.998 N/A ARG 212.A NH1 LEU 213.A O no hydrogen 3.019 N/A ARG 212.A NH1 GLU 218.A OE1 no hydrogen 2.934 N/A ARG 212.A NH1 GLU 218.A OE2 no hydrogen 3.403 N/A ARG 212.A NH2 GLU 218.A OE2 no hydrogen 2.806 N/A GLY 214.A N PHE 187.A O no hydrogen 2.976 N/A GLU 215.A N GLU 218.A OE1 no hydrogen 2.806 N/A THR 216.A OG1 THR 20.A OG1 no hydrogen 2.738 N/A THR 216.A OG1 GLU 217.A OE1 no hydrogen 3.436 N/A GLU 217.A N GLU 217.A OE1 no hydrogen 2.800 N/A GLU 218.A N GLU 215.A O no hydrogen 2.913 N/A ALA 220.A N THR 216.A O no hydrogen 2.921 N/A ASN 221.A N GLU 217.A O no hydrogen 2.854 N/A VAL 223.A N VAL 219.A O no hydrogen 3.024 N/A ALA 224.A N ALA 220.A O no hydrogen 2.865 N/A TRP 225.A N ASN 221.A O no hydrogen 3.076 N/A LEU 226.A N LEU 222.A O no hydrogen 2.931 N/A SER 227.A N VAL 223.A O no hydrogen 3.000 N/A SER 227.A N ALA 224.A O no hydrogen 3.169 N/A SER 227.A OG TYR 25.A OH no hydrogen 2.756 N/A SER 227.A OG VAL 223.A O no hydrogen 2.740 N/A SER 228.A N TRP 225.A O no hydrogen 3.000 N/A SER 228.A OG TRP 225.A O no hydrogen 2.767 N/A LYS 230.A N SER 228.A OG no hydrogen 3.063 N/A ALA 231.A N SER 228.A O no hydrogen 3.088 N/A SER 232.A N ASP 229.A O.A no hydrogen 3.234 N/A SER 232.A OG ASP 229.A O.A no hydrogen 3.147 N/A SER 232.A OG ASP 229.A O.B no hydrogen 3.210 N/A VAL 234.A N ALA 231.A O no hydrogen 2.919 N/A THR 235.A OG1 ILE 180.A O no hydrogen 3.419 N/A GLY 236.A N ILE 180.A O no hydrogen 2.740 N/A SER 237.A N ASN 181.A OD1 no hydrogen 2.998 N/A SER 237.A OG THR 235.A O no hydrogen 3.140 N/A SER 237.A OG TYR 239.A OH.B no hydrogen 2.996 N/A TYR 238.A OH SER 142.A O no hydrogen 2.799 N/A TYR 239.A N.A SER 182.A O.A no hydrogen 2.833 N/A TYR 239.A N.A SER 182.A O.B no hydrogen 2.812 N/A TYR 239.A N.B SER 182.A O.A no hydrogen 2.841 N/A TYR 239.A N.B SER 182.A O.B no hydrogen 2.822 N/A VAL 241.A N GLY 184.A O no hydrogen 2.939 N/A GLY 244.A N ASP 242.A OD1 no hydrogen 2.832 N/A TYR 245.A N ASP 242.A O no hydrogen 2.937 N/A LEU 246.A N ASP 242.A OD2 no hydrogen 2.981 N/A ALA 247.A N GLY 244.A O no hydrogen 3.003 N/A