Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5x67_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A NE2 ARG 247.A O no hydrogen 2.646 N/A GLU 3.A N HIS 1.A ND1 no hydrogen 3.116 N/A LEU 4.A N HIS 1.A O no hydrogen 3.215 N/A GLN 5.A N GLY 2.A O no hydrogen 3.016 N/A GLN 5.A NE2 ARG 37.A O no hydrogen 2.669 N/A TYR 6.A OH MET 192.A O no hydrogen 2.581 N/A LEU 7.A N GLU 3.A O no hydrogen 3.031 N/A GLY 8.A N LEU 4.A O no hydrogen 2.788 N/A GLN 9.A N GLN 5.A O no hydrogen 3.000 N/A ILE 10.A N TYR 6.A O no hydrogen 3.016 N/A GLN 11.A N LEU 7.A O no hydrogen 3.083 N/A HIS 12.A N GLY 8.A O no hydrogen 2.846 N/A ILE 13.A N GLN 9.A O no hydrogen 2.984 N/A LEU 14.A N ILE 10.A O no hydrogen 2.917 N/A ARG 15.A N GLN 11.A O no hydrogen 3.150 N/A CYS 16.A N HIS 12.A O no hydrogen 2.789 N/A GLY 17.A N ILE 13.A O no hydrogen 2.988 N/A VAL 18.A N SER 30.A O no hydrogen 2.946 N/A LYS 20.A N THR 28.A O no hydrogen 3.041 N/A LYS 20.A NZ ASP 227.A OD2 no hydrogen 2.864 N/A ARG 23.A NH1 VAL 286.A O no hydrogen 2.900 N/A THR 24.A N ASP 22.A OD2 no hydrogen 2.878 N/A THR 24.A OG1 ASP 22.A OD1 no hydrogen 2.950 N/A THR 24.A OG1 ASP 22.A OD2 no hydrogen 2.579 N/A THR 24.A OG1 THR 26.A OG1 no hydrogen 2.810 N/A GLY 25.A N ASP 22.A O no hydrogen 2.969 N/A THR 26.A N THR 24.A OG1 no hydrogen 3.245 N/A THR 26.A OG1 THR 24.A OG1 no hydrogen 2.810 N/A GLY 27.A N ASP 22.A OD1 no hydrogen 3.035 N/A THR 28.A N LYS 20.A O no hydrogen 2.977 N/A THR 28.A OG1 LYS 20.A O no hydrogen 3.104 N/A LEU 29.A N ILE 230.A O no hydrogen 2.888 N/A SER 30.A N VAL 18.A O no hydrogen 2.819 N/A SER 30.A OG ASP 227.A OD1 no hydrogen 2.932 N/A VAL 31.A N.A ALA 228.A O no hydrogen 2.963 N/A VAL 31.A N.B ALA 228.A O no hydrogen 2.992 N/A GLY 33.A N GLY 226.A O no hydrogen 2.983 N/A MET 34.A N LEU 225.A O no hydrogen 3.253 N/A GLN 35.A NE2 THR 224.A OG1 no hydrogen 2.919 N/A ALA 36.A N HIS 223.A O no hydrogen 2.970 N/A ARG 37.A N GLN 5.A OE1 no hydrogen 2.872 N/A ARG 37.A NH1 ASP 220.A OD2 no hydrogen 3.253 N/A TYR 38.A N PHE 221.A O no hydrogen 2.745 N/A LEU 40.A N GLY 219.A O no hydrogen 2.791 N/A ARG 41.A N SER 39.A OG no hydrogen 3.194 N/A ARG 41.A NE GLU 180.A OE1 no hydrogen 3.253 N/A ARG 41.A NE GLU 180.A OE2 no hydrogen 3.311 N/A ARG 41.A NH1 SER 39.A OG no hydrogen 3.284 N/A ARG 41.A NH1 ASP 220.A OD1 no hydrogen 3.052 N/A ARG 41.A NH2 GLU 180.A OE1 no hydrogen 2.945 N/A ARG 41.A NH2 ASP 220.A OD2 no hydrogen 3.192 N/A PHE 44.A N PRO 250.A O no hydrogen 2.893 N/A LEU 46.A N PHE 44.A O no hydrogen 2.812 N/A THR 48.A N GLU 3.A OE2 no hydrogen 2.782 N/A THR 48.A OG1 GLU 3.A OE2 no hydrogen 2.812 N/A THR 48.A OG1 ARG 247.A O no hydrogen 3.149 N/A THR 49.A N GLU 3.A OE1 no hydrogen 2.841 N/A THR 49.A OG1 GLU 3.A OE1 no hydrogen 2.575 N/A VAL 52.A N TYR 274.A OH no hydrogen 2.997 N/A LYS 55.A NZ LYS 77.A O no hydrogen 2.677 N/A VAL 57.A N PHE 53.A O no hydrogen 3.042 N/A LEU 58.A N TRP 54.A O no hydrogen 2.878 N/A GLU 59.A N LYS 55.A O no hydrogen 2.946 N/A GLU 60.A N GLY 56.A O no hydrogen 2.763 N/A LEU 61.A N VAL 57.A O no hydrogen 3.038 N/A LEU 62.A N LEU 58.A O no hydrogen 3.059 N/A TRP 63.A N GLU 59.A O no hydrogen 3.063 N/A TRP 63.A NE1 ASN 70.A O no hydrogen 3.047 N/A PHE 64.A N GLU 60.A O no hydrogen 2.951 N/A ILE 65.A N LEU 61.A O no hydrogen 2.947 N/A LYS 66.A N LEU 62.A O no hydrogen 3.033 N/A LYS 66.A NZ GLU 73.A OE1 no hydrogen 2.682 N/A GLY 67.A N PHE 64.A O no hydrogen 2.983 N/A SER 68.A N TRP 63.A O no hydrogen 3.207 N/A SER 68.A OG GLU 73.A OE2 no hydrogen 2.964 N/A THR 69.A OG1 TYR 119.A OH no hydrogen 2.613 N/A ASN 70.A N SER 68.A OG no hydrogen 3.198 N/A ALA 71.A N GLY 102.A O no hydrogen 2.819 N/A LYS 72.A N ASN 70.A OD1 no hydrogen 2.891 N/A GLU 73.A N ASN 70.A O no hydrogen 3.150 N/A SER 75.A N ALA 71.A O no hydrogen 2.798 N/A SER 75.A OG ASP 83.A OD2 no hydrogen 2.799 N/A SER 76.A N LYS 72.A O no hydrogen 2.916 N/A SER 76.A OG LYS 72.A O no hydrogen 3.347 N/A SER 76.A OG GLU 73.A O no hydrogen 2.921 N/A LYS 77.A N LEU 74.A O no hydrogen 2.967 N/A GLY 78.A N SER 75.A O no hydrogen 2.959 N/A VAL 79.A N LEU 74.A O no hydrogen 3.390 N/A LYS 80.A NZ SER 75.A O no hydrogen 2.804 N/A LYS 80.A NZ SER 75.A OG no hydrogen 3.260 N/A TRP 82.A NE1 GLU 60.A OE2 no hydrogen 3.046 N/A ASP 83.A N LYS 80.A O no hydrogen 3.099 N/A GLY 86.A N TRP 82.A O no hydrogen 3.177 N/A GLY 86.A N ASP 83.A O no hydrogen 3.226 N/A SER 87.A N ALA 84.A O no hydrogen 3.353 N/A SER 87.A OG ALA 84.A O no hydrogen 3.026 N/A ARG 88.A N GLU 101.A OE2 no hydrogen 2.983 N/A ARG 88.A NE ASP 92.A OD1 no hydrogen 3.091 N/A ARG 88.A NE ASP 92.A OD2 no hydrogen 3.391 N/A ARG 88.A NH1 ASP 92.A OD1 no hydrogen 2.931 N/A ARG 88.A NH1 ARG 99.A O no hydrogen 2.929 N/A ARG 88.A NH2 ARG 99.A O no hydrogen 2.741 N/A PHE 90.A N SER 87.A OG no hydrogen 3.144 N/A LEU 91.A N SER 87.A O no hydrogen 2.803 N/A ASP 92.A N ARG 88.A O no hydrogen 2.888 N/A SER 93.A N ASP 89.A O no hydrogen 3.044 N/A SER 93.A OG PHE 90.A O no hydrogen 2.590 N/A LEU 94.A N LEU 91.A O no hydrogen 3.266 N/A GLY 95.A N ASP 92.A O no hydrogen 2.883 N/A PHE 96.A N LEU 91.A O no hydrogen 2.926 N/A ARG 99.A N PHE 96.A O no hydrogen 3.083 N/A ARG 99.A NH1 ASP 103.A O no hydrogen 3.106 N/A ARG 99.A NH1 LEU 162.A O no hydrogen 2.961 N/A ARG 99.A NH2 LEU 162.A O no hydrogen 2.686 N/A GLY 102.A N GLY 86.A O no hydrogen 2.842 N/A ASP 103.A N GLU 100.A O no hydrogen 3.129 N/A LEU 104.A N THR 69.A O no hydrogen 3.082 N/A GLY 105.A N ASP 103.A OD1 no hydrogen 3.039 N/A VAL 107.A N GLY 105.A O no hydrogen 2.896 N/A GLN 111.A N VAL 107.A O no hydrogen 3.018 N/A GLN 111.A NE2 PRO 106.A O no hydrogen 2.896 N/A GLN 111.A NE2 ASP 159.A OD2 no hydrogen 2.876 N/A TRP 112.A N TYR 108.A O no hydrogen 2.917 N/A ARG 113.A N GLY 109.A O no hydrogen 3.244 N/A ARG 113.A NE ASP 132.A OD1 no hydrogen 2.875 N/A ARG 113.A NH1 ILE 65.A O no hydrogen 2.699 N/A ARG 113.A NH1 ASP 262.A OD1 no hydrogen 2.721 N/A ARG 113.A NH2 ASP 132.A OD1 no hydrogen 3.414 N/A ARG 113.A NH2 ASP 132.A OD2 no hydrogen 2.730 N/A ARG 113.A NH2 ASP 262.A OD2 no hydrogen 3.457 N/A HIS 114.A N PHE 110.A O no hydrogen 2.827 N/A HIS 114.A ND1 GLN 129.A O no hydrogen 2.880 N/A PHE 115.A N VAL 131.A O no hydrogen 2.993 N/A ALA 117.A N HIS 114.A O no hydrogen 2.975 N/A TYR 119.A OH THR 69.A OG1 no hydrogen 2.613 N/A TYR 119.A OH ASP 103.A OD1 no hydrogen 2.624 N/A ARG 120.A N TYR 126.A OH no hydrogen 2.858 N/A ASP 121.A N SER 124.A OG no hydrogen 3.176 N/A MET 122.A N ASP 103.A OD2 no hydrogen 3.022 N/A GLU 123.A N ASP 121.A OD1 no hydrogen 2.812 N/A SER 124.A N ASP 121.A O no hydrogen 3.255 N/A SER 124.A OG ASP 121.A O no hydrogen 3.258 N/A SER 124.A OG ASP 121.A OD1 no hydrogen 3.037 N/A TYR 126.A OH ASP 121.A O no hydrogen 2.835 N/A SER 127.A N ASP 125.A OD1 no hydrogen 3.088 N/A SER 127.A OG ASP 125.A OD1 no hydrogen 2.441 N/A GLN 129.A N TYR 126.A O no hydrogen 2.867 N/A VAL 131.A N PHE 115.A O no hydrogen 2.816 N/A GLN 133.A N TRP 112.A O no hydrogen 2.876 N/A GLN 133.A NE2 GLN 111.A O no hydrogen 2.879 N/A GLN 133.A NE2 CYS 153.A O no hydrogen 2.811 N/A LEU 134.A N TRP 112.A O no hydrogen 3.263 N/A GLN 135.A N ASP 132.A OD1 no hydrogen 3.036 N/A GLN 135.A NE2 ASP 139.A OD1 no hydrogen 2.728 N/A ARG 136.A N ASP 132.A O no hydrogen 3.089 N/A VAL 137.A N GLN 133.A O no hydrogen 2.908 N/A ILE 138.A N LEU 134.A O no hydrogen 3.294 N/A ASP 139.A N GLN 135.A O no hydrogen 2.963 N/A THR 140.A N ARG 136.A O no hydrogen 2.899 N/A THR 140.A OG1 ARG 136.A O no hydrogen 2.823 N/A ILE 141.A N VAL 137.A O no hydrogen 3.066 N/A LYS 142.A N ILE 138.A O no hydrogen 3.097 N/A THR 143.A N ASP 139.A O no hydrogen 3.174 N/A THR 143.A OG1 ASP 139.A O no hydrogen 3.042 N/A ASN 144.A N THR 140.A O no hydrogen 2.681 N/A ASP 147.A N ASN 144.A O no hydrogen 2.968 N/A ARG 149.A N ASP 147.A OD1 no hydrogen 2.522 N/A MET 152.A N CYS 172.A O no hydrogen 2.971 N/A CYS 153.A N GLN 133.A OE1 no hydrogen 2.804 N/A CYS 153.A SG TRP 155.A O no hydrogen 3.568 N/A CYS 153.A SG ALA 170.A O no hydrogen 3.770 N/A ALA 154.A N ALA 170.A O no hydrogen 3.041 N/A ASN 156.A ND2 GLN 111.A OE1 no hydrogen 3.024 N/A ARG 158.A N ASN 156.A OD1 no hydrogen 3.208 N/A ASP 159.A N ASN 156.A O no hydrogen 2.878 N/A LEU 160.A N ASN 156.A O no hydrogen 3.112 N/A LEU 162.A N ASP 159.A O no hydrogen 2.825 N/A MET 163.A N LEU 160.A O no hydrogen 3.170 N/A ALA 164.A N LEU 104.A O no hydrogen 2.838 N/A HIS 169.A N TYR 108.A OH no hydrogen 3.096 N/A ALA 170.A N TYR 186.A O no hydrogen 3.030 N/A CYS 172.A N MET 152.A O no hydrogen 2.933 N/A CYS 172.A SG MET 152.A O no hydrogen 4.001 N/A GLN 173.A N GLN 184.A O no hydrogen 2.814 N/A PHE 174.A N ILE 150.A O no hydrogen 2.801 N/A TYR 175.A N SER 182.A O no hydrogen 2.952 N/A VAL 177.A N GLU 180.A O no hydrogen 3.088 N/A GLU 180.A N VAL 177.A O no hydrogen 2.962 N/A LEU 181.A N LYS 217.A O no hydrogen 2.797 N/A SER 182.A N TYR 175.A O no hydrogen 2.848 N/A CYS 183.A N ASP 220.A O no hydrogen 2.923 N/A CYS 183.A SG GLN 173.A O no hydrogen 3.993 N/A GLN 184.A N GLN 173.A O no hydrogen 2.859 N/A GLN 184.A NE2 THR 224.A OG1 no hydrogen 2.769 N/A LEU 185.A N ILE 222.A O no hydrogen 2.912 N/A TYR 186.A N LEU 171.A O no hydrogen 2.927 N/A GLN 187.A N THR 224.A O no hydrogen 2.823 N/A GLN 187.A NE2 SER 189.A O no hydrogen 2.986 N/A GLN 187.A NE2 ASN 199.A OD1 no hydrogen 2.935 N/A ARG 188.A N CYS 168.A O no hydrogen 2.846 N/A ARG 188.A NE PRO 167.A O no hydrogen 2.900 N/A ARG 188.A NH2 PRO 166.A O no hydrogen 2.872 N/A GLY 190.A N ASP 227.A O no hydrogen 2.934 N/A MET 192.A N HIS 229.A O no hydrogen 2.911 N/A LEU 194.A N ASP 191.A OD1 no hydrogen 3.093 N/A GLY 195.A N ASP 191.A O no hydrogen 3.021 N/A VAL 196.A N ASP 191.A O no hydrogen 3.071 N/A ASN 199.A N GLY 195.A O no hydrogen 2.827 N/A ILE 200.A N VAL 196.A O no hydrogen 2.756 N/A ALA 201.A N PRO 197.A O no hydrogen 3.205 N/A SER 202.A N PHE 198.A O no hydrogen 3.071 N/A SER 202.A OG PHE 198.A O no hydrogen 3.099 N/A TYR 203.A N ASN 199.A O no hydrogen 3.240 N/A ALA 204.A N ILE 200.A O no hydrogen 3.041 N/A LEU 205.A N ALA 201.A O no hydrogen 2.874 N/A LEU 206.A N SER 202.A O no hydrogen 2.959 N/A THR 207.A N TYR 203.A O no hydrogen 2.918 N/A THR 207.A OG1 TYR 203.A O no hydrogen 2.774 N/A TYR 208.A N ALA 204.A O no hydrogen 3.031 N/A TYR 208.A OH LEU 40.A O no hydrogen 2.787 N/A TYR 208.A OH GLU 43.A O no hydrogen 2.744 N/A MET 209.A N LEU 205.A O no hydrogen 2.936 N/A ILE 210.A N LEU 206.A O no hydrogen 2.985 N/A ALA 211.A N THR 207.A O no hydrogen 2.835 N/A HIS 212.A N TYR 208.A O no hydrogen 2.837 N/A ILE 213.A N MET 209.A O no hydrogen 3.084 N/A THR 214.A N ILE 210.A O no hydrogen 3.037 N/A THR 214.A OG1 ILE 210.A O no hydrogen 2.948 N/A THR 214.A OG1 ALA 211.A O no hydrogen 3.397 N/A GLY 215.A N HIS 212.A O no hydrogen 3.439 N/A LEU 216.A N ALA 211.A O no hydrogen 2.925 N/A LYS 217.A N SER 179.A O no hydrogen 2.850 N/A GLY 219.A N LEU 181.A O no hydrogen 2.736 N/A ASP 220.A N SER 182.A OG no hydrogen 3.041 N/A PHE 221.A N TYR 38.A O no hydrogen 2.791 N/A ILE 222.A N CYS 183.A O no hydrogen 2.796 N/A HIS 223.A N ALA 36.A O no hydrogen 2.949 N/A HIS 223.A NE2 GLN 187.A OE1 no hydrogen 2.832 N/A THR 224.A N LEU 185.A O no hydrogen 2.849 N/A LEU 225.A N MET 34.A O no hydrogen 2.832 N/A GLY 226.A N GLN 187.A O no hydrogen 2.773 N/A ASP 227.A N ARG 188.A O no hydrogen 3.031 N/A ALA 228.A N VAL 31.A O.A no hydrogen 2.916 N/A ALA 228.A N VAL 31.A O.B no hydrogen 2.933 N/A HIS 229.A N GLY 190.A O no hydrogen 2.920 N/A HIS 229.A ND1 ASP 227.A O no hydrogen 3.109 N/A HIS 229.A ND1 ASP 227.A OD1 no hydrogen 3.191 N/A ILE 230.A N LEU 29.A O no hydrogen 2.837 N/A LEU 232.A N GLY 27.A O no hydrogen 3.081 N/A HIS 234.A N TYR 231.A O no hydrogen 2.809 N/A HIS 234.A NE2 GLU 283.A O no hydrogen 2.732 N/A ILE 235.A N LEU 232.A O no hydrogen 3.377 N/A LEU 238.A N HIS 234.A O no hydrogen 2.869 N/A LYS 239.A N ILE 235.A O no hydrogen 2.964 N/A LYS 239.A NZ GLU 236.A OE1 no hydrogen 3.080 N/A ILE 240.A N GLU 236.A O no hydrogen 3.144 N/A GLN 241.A N PRO 237.A O no hydrogen 3.148 N/A GLN 241.A NE2 THR 49.A OG1 no hydrogen 2.869 N/A LEU 242.A N LEU 238.A O no hydrogen 2.854 N/A GLN 243.A N ILE 240.A O no hydrogen 3.056 N/A ARG 244.A N GLN 241.A O no hydrogen 2.945 N/A ARG 244.A NH1 THR 49.A O no hydrogen 2.917 N/A ARG 244.A NH1 PRO 278.A O no hydrogen 2.923 N/A ARG 247.A N THR 48.A OG1 no hydrogen 2.821 N/A ARG 247.A NH1 ASN 275.A O no hydrogen 2.996 N/A LYS 251.A N GLU 272.A O no hydrogen 2.926 N/A ARG 253.A N GLN 270.A O no hydrogen 2.949 N/A LEU 255.A N ASP 268.A O no hydrogen 2.737 N/A VAL 258.A N HIS 212.A NE2 no hydrogen 3.231 N/A ASP 263.A N LYS 260.A O no hydrogen 2.938 N/A LYS 265.A N ASP 268.A OD2 no hydrogen 3.001 N/A ASP 268.A N LYS 265.A O no hydrogen 2.958 N/A PHE 269.A N ALA 266.A O no hydrogen 3.364 N/A GLN 270.A N ARG 253.A O no hydrogen 2.998 N/A GLU 272.A N LYS 251.A O no hydrogen 2.845 N/A TYR 274.A OH LEU 47.A O no hydrogen 2.653 N/A HIS 277.A N THR 48.A O no hydrogen 2.856 N/A HIS 277.A NE2 GLU 245.A O no hydrogen 3.098 N/A