Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f7b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A N LEU 18H.A O no hydrogen 2.946 N/A CYS 5.A SG TYR 6.A O no hydrogen 3.622 N/A TYR 6.A N GLN 9.A OE1 no hydrogen 2.822 N/A GLN 9.A N TYR 6.A O no hydrogen 2.851 N/A LYS 22.A N VAL 19.A O no hydrogen 2.798 N/A TRP 23.A N PRO 20.A O no hydrogen 3.129 N/A TRP 23.A NE1 CYS 5.A O no hydrogen 2.975 N/A ASN 26.A N THR 201.A O no hydrogen 2.853 N/A ASN 26.A ND2 THR 201.A O no hydrogen 3.688 N/A ASN 26.A ND2 ASP 203.A OD1 no hydrogen 2.808 N/A CYS 27.A N GLY 24.A O no hydrogen 3.201 N/A CYS 27.A SG GLY 24.A O no hydrogen 3.221 N/A GLN 28.A NE2 TRP 23.A O no hydrogen 2.753 N/A LYS 29.A N ASN 26.A O no hydrogen 2.968 N/A LYS 29.A NZ ASN 26.A OD1 no hydrogen 2.786 N/A ARG 31.A N GLU 204.A OE2 no hydrogen 2.815 N/A GLN 32.A NE2 CYS 202.A O no hydrogen 3.205 N/A GLN 32.A NE2 GLU 204.A OE2 no hydrogen 2.817 N/A SER 33.A N SER 196.A OG no hydrogen 2.954 N/A SER 33.A OG TYR 193.A OH no hydrogen 2.673 N/A SER 33.A OG SER 196.A O no hydrogen 3.450 N/A ILE 37.A N SER 110.A O no hydrogen 3.001 N/A THR 39.A N ASP 112.A OD1 no hydrogen 2.767 N/A THR 39.A OG1 ASP 112.A OD1 no hydrogen 3.376 N/A THR 39.A OG1 ASP 112.A OD2 no hydrogen 2.688 N/A LYS 41.A N VAL 38.A O no hydrogen 2.959 N/A ALA 42.A N THR 39.A O no hydrogen 3.086 N/A ASP 45.A N LYS 256.A O no hydrogen 3.033 N/A LYS 47.A N ASP 45.A OD1 no hydrogen 2.661 N/A LEU 48.A N ASP 45.A O no hydrogen 3.157 N/A ARG 50.A NE PHE 51.A O no hydrogen 2.828 N/A ARG 50.A NH2 PHE 51.A O no hydrogen 2.944 N/A PHE 52.A N SER 82.A O no hydrogen 2.837 N/A SER 54.A N SER 80.A O no hydrogen 2.815 N/A SER 54.A OG SER 80.A OG no hydrogen 3.245 N/A TYR 56.A OH HIS 124.A NE2 no hydrogen 2.724 N/A LYS 58.A N GLY 55A.A O no hydrogen 3.442 N/A LYS 59.A NZ ASP 179.A OD1 no hydrogen 3.193 N/A LYS 59.A NZ ASP 179.A OD2 no hydrogen 2.675 N/A GLN 60.A N SER 175.A O no hydrogen 2.695 N/A VAL 64.A N THR 170.A O no hydrogen 2.977 N/A GLN 65.A N MET 72.A O no hydrogen 2.879 N/A ASN 66.A N MET 168.A O no hydrogen 2.935 N/A ASN 66.A ND2 ILE 163.A O no hydrogen 3.174 N/A ASN 66.A ND2 TYR 230.A O no hydrogen 3.326 N/A ASN 67.A N SER 70.A O no hydrogen 3.440 N/A GLY 68.A N ASN 66.A OD1 no hydrogen 2.787 N/A HIS 69.A N ASN 67.A OD1 no hydrogen 2.860 N/A SER 70.A N ASN 67.A OD1 no hydrogen 2.975 N/A SER 70.A OG VAL 71.A O no hydrogen 3.128 N/A SER 70.A OG LEU 97.A O no hydrogen 2.704 N/A MET 72.A N GLN 65.A O no hydrogen 2.804 N/A MET 73.A N LEU 95.A O no hydrogen 2.803 N/A LEU 74.A N THR 63.A O no hydrogen 2.923 N/A LEU 75.A N LYS 93.A O no hydrogen 2.901 N/A ASN 77.A N ALA 92.A O no hydrogen 3.032 N/A LYS 78.A N LEU 75.A O no hydrogen 2.740 N/A SER 80.A N SER 54.A O no hydrogen 2.881 N/A ILE 81.A N TYR 90.A O no hydrogen 2.981 N/A SER 82.A N PHE 52.A O no hydrogen 3.028 N/A GLY 84.A N ARG 50.A O no hydrogen 3.040 N/A LEU 86.A N GLY 83.A O no hydrogen 2.853 N/A TYR 90.A N ILE 81.A O no hydrogen 2.865 N/A TYR 90.A OH ASP 134.A O no hydrogen 2.723 N/A GLN 91.A N GLU 125.A O no hydrogen 2.898 N/A ALA 92.A N ALA 79.A O no hydrogen 2.732 N/A LYS 93.A N VAL 123.A O no hydrogen 2.705 N/A LYS 93.A NZ ASN 77.A OD1 no hydrogen 2.554 N/A GLN 94.A N VAL 123.A O no hydrogen 3.444 N/A LEU 95.A N MET 73.A O no hydrogen 2.906 N/A HIS 96.A N HIS 121.A O no hydrogen 3.025 N/A HIS 96.A ND1 GLN 94.A OE1 no hydrogen 2.604 N/A LEU 97.A N SER 70.A OG no hydrogen 3.262 N/A HIS 98.A N GLU 119.A O no hydrogen 2.775 N/A HIS 98.A ND1 ASN 242.A O no hydrogen 2.658 N/A TRP 99.A N ASN 242.A OD1 no hydrogen 2.937 N/A TRP 99.A NE1 MET 239.A O no hydrogen 2.859 N/A SER 100.A N ALA 117.A O no hydrogen 3.414 N/A SER 100.A OG ASP 101.A OD1 no hydrogen 3.296 N/A SER 100.A OG ASP 241.A OD1 no hydrogen 2.704 N/A GLY 106.A N PHE 116.A O no hydrogen 2.851 N/A SER 107.A OG HIS 109.A O no hydrogen 2.809 N/A GLU 108.A N GLU 119.A OE1 no hydrogen 2.727 N/A HIS 109.A N GLU 119.A OE1 no hydrogen 2.740 N/A HIS 109.A ND1 GLU 119.A OE2 no hydrogen 2.808 N/A HIS 109.A NE2 TYR 193.A OH no hydrogen 2.663 N/A SER 110.A N ILE 35.A O no hydrogen 3.339 N/A SER 110.A OG ASN 36.A OD1 no hydrogen 2.735 N/A LEU 111.A N GLU 114.A O no hydrogen 2.900 N/A ASP 112.A N ILE 37.A O no hydrogen 2.890 N/A GLY 113.A N ASN 36.A OD1 no hydrogen 2.694 N/A GLU 114.A N LEU 111.A O no hydrogen 2.851 N/A PHE 116.A N SER 107.A OG no hydrogen 2.855 N/A ALA 117.A N VAL 143.A O no hydrogen 2.793 N/A MET 118.A N VAL 143.A O no hydrogen 3.095 N/A GLU 119.A N HIS 98.A O no hydrogen 2.678 N/A MET 120.A N PHE 141.A O no hydrogen 2.788 N/A HIS 121.A N HIS 96.A O no hydrogen 2.907 N/A HIS 121.A NE2 GLU 119.A OE2 no hydrogen 2.603 N/A ILE 122.A N LEU 139.A O no hydrogen 2.831 N/A VAL 123.A N GLN 94.A O no hydrogen 2.924 N/A HIS 124.A N ALA 137.A O no hydrogen 2.825 N/A HIS 124.A ND1 ILE 122.A O no hydrogen 3.020 N/A HIS 124.A NE2 TYR 56.A OH no hydrogen 2.724 N/A GLU 125.A N GLN 91.A O no hydrogen 2.862 N/A LYS 126.A N GLU 135.A O no hydrogen 2.879 N/A LYS 126.A NZ ASP 134.A OD1 no hydrogen 3.289 N/A GLU 127.A N PRO 89.A O no hydrogen 2.762 N/A GLU 135.A N PRO 132.A O no hydrogen 3.238 N/A ILE 136.A N LYS 205.A O no hydrogen 2.982 N/A ALA 137.A N HIS 124.A O no hydrogen 2.938 N/A VAL 138.A N VAL 207.A O no hydrogen 3.277 N/A LEU 139.A N ILE 122.A O no hydrogen 2.843 N/A ALA 140.A N THR 209.A O no hydrogen 2.879 N/A PHE 141.A N MET 120.A O no hydrogen 2.838 N/A VAL 143.A N MET 118.A O no hydrogen 2.882 N/A GLU 144.A N ILE 215.A O no hydrogen 3.059 N/A GLY 146.A N LEU 217.A O no hydrogen 2.814 N/A ASN 150.A N GLN 221.A OE1 no hydrogen 2.998 N/A ASN 150.A ND2 GLN 216.A O no hydrogen 3.094 N/A PHE 153.A N ASN 150.A O no hydrogen 3.229 N/A GLN 154.A N GLU 151.A O no hydrogen 3.001 N/A VAL 157.A N PHE 153.A O no hydrogen 2.888 N/A GLU 158.A N GLN 154.A O no hydrogen 2.872 N/A ALA 159.A N PRO 155.A O no hydrogen 3.164 N/A LEU 160.A N LEU 156.A O no hydrogen 3.235 N/A LEU 160.A N VAL 157.A O no hydrogen 3.099 N/A SER 161.A N GLU 158.A O no hydrogen 3.367 N/A SER 161.A OG GLU 158.A O no hydrogen 3.496 N/A ASN 162.A N ALA 159.A O no hydrogen 2.907 N/A ILE 163.A N LEU 160.A O no hydrogen 3.048 N/A GLU 167.A N ASN 66.A O no hydrogen 2.565 N/A MET 168.A N LYS 165.A O no hydrogen 3.147 N/A THR 170.A N VAL 64.A O no hydrogen 2.919 N/A MET 172.A N TRP 62.A O no hydrogen 2.892 N/A SER 175.A N GLN 60.A O no hydrogen 2.694 N/A SER 176.A N ASP 179.A OD2 no hydrogen 3.080 N/A LEU 178.A N TYR 56.A O no hydrogen 2.937 N/A ASP 179.A N SER 176.A OG no hydrogen 3.153 N/A LEU 180.A N LEU 177.A O no hydrogen 2.754 N/A LEU 181.A N LEU 178.A O no hydrogen 3.004 N/A LYS 186.A N LYS 183.A O no hydrogen 2.868 N/A LEU 187.A N GLU 184A.A O no hydrogen 2.991 N/A TYR 190.A N SER 257.A OG no hydrogen 3.121 N/A TYR 190.A OH GLY 49.A O no hydrogen 2.789 N/A PHE 191.A N VAL 210.A O no hydrogen 2.867 N/A ARG 192.A N ILE 255.A O no hydrogen 2.741 N/A ARG 192.A NE TRP 208.A O no hydrogen 2.849 N/A ARG 192.A NH1 GLY 84.A O no hydrogen 2.918 N/A ARG 192.A NH2 GLY 84.A O no hydrogen 2.827 N/A ARG 192.A NH2 THR 209.A OG1 no hydrogen 2.773 N/A TYR 193.A N TRP 208.A O no hydrogen 3.442 N/A TYR 193.A OH SER 33.A OG no hydrogen 2.673 N/A TYR 193.A OH HIS 109.A NE2 no hydrogen 2.663 N/A GLY 195.A N VAL 206.A O no hydrogen 2.800 N/A SER 196.A N SER 33.A OG no hydrogen 3.062 N/A SER 196.A OG LEU 197.A O no hydrogen 2.684 N/A LEU 197.A N ASP 203.A O no hydrogen 3.078 N/A THR 198.A OG1 GLU 108.A OE1 no hydrogen 2.685 N/A THR 201.A OG1 ASP 203.A OD1 no hydrogen 2.980 N/A THR 201.A OG1 ASP 203.A OD2 no hydrogen 3.514 N/A CYS 202.A N THR 199.A O no hydrogen 2.813 N/A VAL 206.A N GLY 195.A O no hydrogen 3.200 N/A VAL 207.A N ILE 136.A O no hydrogen 2.778 N/A TRP 208.A N TYR 193.A O no hydrogen 2.815 N/A TRP 208.A NE1 SER 196.A O no hydrogen 2.782 N/A THR 209.A N VAL 138.A O no hydrogen 3.089 N/A VAL 210.A N PHE 191.A O no hydrogen 2.867 N/A PHE 211.A N ALA 140.A O no hydrogen 3.130 N/A ARG 212.A N HIS 189.A O no hydrogen 2.960 N/A ARG 212.A NE GLU 213.A OE2 no hydrogen 2.629 N/A ARG 212.A NH2 GLU 213.A OE2 no hydrogen 3.183 N/A ILE 215.A N LEU 142.A O no hydrogen 2.717 N/A LEU 217.A N GLU 144.A O no hydrogen 3.014 N/A HIS 218.A N GLN 221.A OE1 no hydrogen 2.965 N/A GLU 220.A N HIS 218.A ND1 no hydrogen 3.418 N/A GLN 221.A NE2 ASN 150.A O no hydrogen 2.621 N/A GLN 221.A NE2 GLN 154.A OE1 no hydrogen 2.932 N/A ILE 222.A N HIS 218.A O no hydrogen 3.123 N/A LEU 223.A N ARG 219.A O no hydrogen 2.946 N/A ALA 224.A N GLU 220.A O no hydrogen 2.997 N/A PHE 225.A N ILE 222.A O no hydrogen 3.125 N/A SER 226.A OG LEU 223.A O no hydrogen 3.345 N/A LYS 228.A N ALA 224.A O no hydrogen 2.970 N/A TYR 230.A N PRO 164.A O no hydrogen 2.771 N/A TYR 231.A N VAL 237.A O no hydrogen 2.970 N/A TYR 231.A OH LYS 240.A O no hydrogen 2.715 N/A GLN 235.A N ASP 232.A O no hydrogen 3.143 N/A THR 236.A N ASP 232.A OD1 no hydrogen 2.990 N/A THR 236.A N ASP 232.A OD2 no hydrogen 3.060 N/A THR 236.A OG1 ASP 232.A OD2 no hydrogen 2.334 N/A VAL 237.A N ASP 232.A OD1 no hydrogen 2.993 N/A SER 238.A OG SER 226.A O no hydrogen 3.502 N/A MET 239.A N LEU 229.A O no hydrogen 2.912 N/A LYS 240.A NZ ASP 101.A OD2 no hydrogen 2.847 N/A ASP 241.A N TRP 99.A O no hydrogen 2.733 N/A ASN 242.A ND2 HIS 69.A O no hydrogen 2.791 N/A ASN 242.A ND2 LEU 97.A O no hydrogen 3.430 N/A ARG 244.A N GLU 108.A OE2 no hydrogen 2.762 N/A ARG 244.A NH1 GLN 32.A OE1 no hydrogen 2.898 N/A ARG 244.A NH1 SER 33.A O no hydrogen 2.820 N/A ARG 244.A NH2 GLN 32.A OE1 no hydrogen 2.894 N/A GLN 247.A N PRO 34.A O no hydrogen 2.686 N/A GLN 247.A NE2 PRO 245.A O no hydrogen 2.940 N/A ARG 252.A N LEU 249.A O no hydrogen 3.267 N/A ARG 252.A NE LEU 249.A O no hydrogen 2.843 N/A ARG 252.A NH1 GLN 32.A O no hydrogen 3.105 N/A ARG 252.A NH1 LEU 194.A O no hydrogen 2.966 N/A ARG 252.A NH2 GLN 32.A O no hydrogen 2.770 N/A ARG 252.A NH2 GLN 248.A O no hydrogen 2.795 N/A ILE 255.A N ARG 192.A O no hydrogen 3.006 N/A LYS 256.A N LYS 43.A O no hydrogen 3.018 N/A LYS 256.A NZ THR 39.A O no hydrogen 3.166 N/A LYS 256.A NZ ALA 42.A O no hydrogen 3.246 N/A SER 257.A N TYR 190.A O no hydrogen 3.025 N/A SER 257.A OG ARG 188A.A O no hydrogen 2.593 N/A GLU 11A.A N GLU 7.A O no hydrogen 3.068 N/A GLN 227A.A N LEU 223.A O no hydrogen 3.010 N/A SER 12B.A N GLN 9.A O no hydrogen 3.401 N/A SER 12B.A OG VAL 8.A O no hydrogen 2.787 N/A SER 13C.A OG GLN 9.A O no hydrogen 3.146 N/A CYS 17G.A SG TYR 15E.A O no hydrogen 3.973 N/A LEU 18H.A N HIS 3.A O no hydrogen 2.885 N/A