Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3axe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 201.A OD2 no hydrogen 3.216 N/A LYS 2.A N ASP 201.A OD2 no hydrogen 2.733 N/A LYS 2.A NZ THR 194.A OG1 no hydrogen 2.968 N/A LYS 2.A NZ ASN 198.A O no hydrogen 2.684 N/A SER 5.A N THR 219.A O no hydrogen 2.863 N/A SER 5.A OG GLU 224.A OE2 no hydrogen 2.735 N/A GLY 6.A N ASP 201.A O no hydrogen 2.860 N/A ALA 7.A N LEU 137.A O no hydrogen 3.223 N/A LEU 9.A N PHE 135.A O no hydrogen 2.833 N/A TYR 10.A N GLY 189.A O no hydrogen 3.097 N/A THR 11.A N LEU 133.A O no hydrogen 2.962 N/A THR 11.A OG1 GLU 13.A O no hydrogen 2.782 N/A THR 11.A OG1 LEU 133.A O no hydrogen 3.527 N/A LEU 12.A N ARG 187.A O no hydrogen 2.897 N/A TYR 15.A N GLN 131.A O no hydrogen 2.772 N/A GLY 18.A N TRP 102.A O no hydrogen 2.884 N/A LYS 19.A N TYR 166.A O no hydrogen 3.181 N/A PHE 20.A N LEU 100.A O no hydrogen 2.743 N/A GLU 21.A N LYS 164.A O no hydrogen 2.909 N/A ALA 22.A N TYR 98.A O no hydrogen 2.974 N/A ARG 23.A N TRP 162.A O no hydrogen 3.003 N/A ARG 23.A NE ASP 233.A OD1 no hydrogen 3.356 N/A ARG 23.A NE ASP 233.A OD2 no hydrogen 3.002 N/A ARG 23.A NH1 THR 97.A OG1 no hydrogen 3.085 N/A ARG 23.A NH2 ASP 233.A OD1 no hydrogen 2.953 N/A MET 24.A N HIS 96.A O no hydrogen 2.928 N/A LYS 25.A N PHE 159.A O no hydrogen 2.929 N/A MET 26.A N ALA 91.A O no hydrogen 2.929 N/A ALA 27.A N SER 34.A OG no hydrogen 3.180 N/A ALA 29.A N THR 32.A OG1 no hydrogen 3.153 N/A SER 30.A OG GLN 148.A O no hydrogen 2.585 N/A GLY 31.A N VAL 146.A O no hydrogen 2.821 N/A THR 32.A N ALA 29.A O no hydrogen 3.019 N/A THR 32.A OG1 ALA 29.A O no hydrogen 2.977 N/A VAL 33.A N TRP 138.A O no hydrogen 2.839 N/A SER 34.A N VAL 58.A O no hydrogen 3.126 N/A SER 35.A N ASN 136.A O no hydrogen 2.885 N/A SER 35.A OG ASN 136.A O no hydrogen 3.328 N/A SER 35.A OG ASN 136.A OD1 no hydrogen 2.679 N/A MET 36.A N ILE 56.A O no hydrogen 3.026 N/A PHE 37.A N ARG 134.A O no hydrogen 2.794 N/A LEU 38.A N VAL 54.A O no hydrogen 2.823 N/A TYR 39.A N GLY 132.A O no hydrogen 2.871 N/A TYR 39.A OH GLU 44.A OE1 no hydrogen 2.615 N/A GLN 40.A N VAL 52.A O no hydrogen 3.013 N/A ASN 41.A N GLU 14.A OE2 no hydrogen 2.928 N/A GLY 42.A N GLU 44.A OE1 no hydrogen 3.185 N/A SER 43.A N GLN 40.A O no hydrogen 3.076 N/A SER 43.A OG GLN 40.A O no hydrogen 2.735 N/A GLU 44.A N GLU 44.A OE1 no hydrogen 2.828 N/A ILE 45.A N GLY 42.A O no hydrogen 2.937 N/A ARG 49.A N ASP 47.A OD1 no hydrogen 3.242 N/A ARG 49.A NE ASP 47.A OD1 no hydrogen 2.961 N/A ARG 49.A NE ASP 47.A OD2 no hydrogen 3.417 N/A ARG 49.A NH2 ASP 47.A OD2 no hydrogen 2.908 N/A TRP 51.A N GLY 73.A O no hydrogen 2.901 N/A TRP 51.A NE1 GLU 53.A OE1 no hydrogen 2.895 N/A VAL 52.A N SER 43.A OG no hydrogen 3.093 N/A GLU 53.A N ILE 71.A O no hydrogen 3.152 N/A VAL 54.A N LEU 38.A O no hydrogen 3.027 N/A ASP 55.A N ASN 69.A O no hydrogen 2.805 N/A ILE 56.A N MET 36.A O no hydrogen 2.942 N/A GLU 57.A N GLN 67.A O no hydrogen 2.894 N/A VAL 58.A N SER 34.A O no hydrogen 2.799 N/A GLY 60.A N THR 32.A O no hydrogen 2.741 N/A LYS 61.A NZ ALA 144.A O no hydrogen 3.311 N/A SER 62.A N LEU 59.A O no hydrogen 2.862 N/A SER 62.A OG LEU 59.A O no hydrogen 3.242 N/A SER 65.A N SER 62.A O no hydrogen 3.227 N/A SER 65.A OG SER 62.A O no hydrogen 3.429 N/A PHE 66.A N HIS 85.A O no hydrogen 2.928 N/A GLN 67.A N GLU 57.A O no hydrogen 2.790 N/A SER 68.A N LYS 83.A O no hydrogen 2.753 N/A SER 68.A OG LYS 83.A O no hydrogen 3.488 N/A SER 68.A OG HIS 85.A NE2 no hydrogen 2.713 N/A ASN 69.A N ASP 55.A O no hydrogen 3.161 N/A ASN 69.A ND2 GLU 82.A OE2 no hydrogen 3.214 N/A ILE 70.A N ASN 69.A OD1 no hydrogen 2.991 N/A ILE 71.A N GLU 53.A O no hydrogen 2.833 N/A THR 72.A N LYS 79.A O no hydrogen 3.042 N/A LYS 74.A N ALA 77.A O no hydrogen 3.159 N/A ALA 77.A N LYS 74.A O no hydrogen 2.728 N/A LYS 79.A N THR 72.A O no hydrogen 2.892 N/A THR 80.A OG1 GLU 82.A OE1 no hydrogen 3.113 N/A THR 80.A OG1 GLU 82.A OE2 no hydrogen 3.498 N/A SER 81.A N ASN 69.A OD1 no hydrogen 2.906 N/A SER 81.A OG GLN 123.A OE1 no hydrogen 2.716 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.726 N/A LYS 83.A N SER 68.A O no hydrogen 3.124 N/A HIS 85.A N PHE 66.A O no hydrogen 2.902 N/A HIS 85.A NE2 SER 68.A OG no hydrogen 2.713 N/A VAL 87.A N GLY 64.A O no hydrogen 2.945 N/A ALA 91.A N PRO 63.A O no hydrogen 2.818 N/A GLN 93.A N ALA 90.A O no hydrogen 2.881 N/A HIS 96.A N MET 24.A O no hydrogen 2.994 N/A HIS 96.A ND1 ASP 112.A OD2 no hydrogen 2.714 N/A HIS 96.A NE2 PRO 89.A O no hydrogen 2.853 N/A THR 97.A N ASP 112.A OD1 no hydrogen 2.935 N/A TYR 98.A N ALA 22.A O no hydrogen 2.865 N/A GLY 99.A N THR 110.A O no hydrogen 2.860 N/A LEU 100.A N PHE 20.A O no hydrogen 2.832 N/A GLU 101.A N ARG 108.A O no hydrogen 2.905 N/A TRP 102.A N GLY 18.A O no hydrogen 2.849 N/A THR 103.A N TYR 106.A O no hydrogen 2.965 N/A ASN 105.A N THR 103.A OG1 no hydrogen 3.093 N/A TYR 106.A N THR 103.A OG1 no hydrogen 3.226 N/A VAL 107.A N THR 119.A O no hydrogen 2.990 N/A ARG 108.A N GLU 101.A O no hydrogen 2.856 N/A ARG 108.A NE GLU 115.A OE1 no hydrogen 2.697 N/A ARG 108.A NH1 GLU 101.A OE1 no hydrogen 3.551 N/A ARG 108.A NH1 GLU 101.A OE2 no hydrogen 3.014 N/A TRP 109.A N ARG 117.A O no hydrogen 2.883 N/A TRP 109.A NE1 ASP 55.A O no hydrogen 2.901 N/A THR 110.A N GLY 99.A O no hydrogen 2.953 N/A VAL 111.A N GLN 114.A O no hydrogen 2.909 N/A ASP 112.A N THR 97.A O no hydrogen 2.797 N/A GLN 114.A N VAL 111.A O no hydrogen 3.039 N/A VAL 116.A N TRP 109.A O no hydrogen 2.946 N/A ARG 117.A NE THR 119.A OG1 no hydrogen 2.882 N/A ARG 117.A NH1 SER 68.A OG no hydrogen 2.823 N/A ARG 117.A NH1 SER 81.A O no hydrogen 2.820 N/A ARG 117.A NH2 SER 81.A O no hydrogen 3.339 N/A ARG 117.A NH2 SER 81.A OG no hydrogen 2.914 N/A ARG 117.A NH2 THR 119.A OG1 no hydrogen 3.155 N/A THR 119.A N VAL 107.A O no hydrogen 2.919 N/A GLN 123.A NE2 ILE 70.A O no hydrogen 2.950 N/A GLN 123.A NE2 THR 72.A OG1 no hydrogen 3.030 N/A VAL 124.A N GLY 121.A O no hydrogen 2.897 N/A SER 125.A N GLY 122.A O no hydrogen 3.091 N/A ASN 126.A N GLN 123.A O no hydrogen 2.817 N/A LEU 127.A N VAL 124.A O no hydrogen 3.106 N/A THR 130.A OG1 GLU 14.A OE1 no hydrogen 2.669 N/A GLN 131.A N TYR 15.A O no hydrogen 2.838 N/A GLY 132.A N TYR 39.A O no hydrogen 2.856 N/A LEU 133.A N THR 11.A OG1 no hydrogen 2.946 N/A ARG 134.A N PHE 37.A O no hydrogen 2.739 N/A ARG 134.A NH1 GLU 8.A OE2 no hydrogen 2.796 N/A PHE 135.A N LEU 9.A O no hydrogen 2.929 N/A ASN 136.A N SER 35.A OG no hydrogen 3.086 N/A ASN 136.A ND2 GLU 8.A OE1 no hydrogen 2.873 N/A LEU 137.A N ALA 7.A O no hydrogen 2.981 N/A TRP 138.A N VAL 33.A O no hydrogen 2.936 N/A SER 139.A OG GLY 31.A O no hydrogen 2.741 N/A SER 140.A N GLY 31.A O no hydrogen 3.227 N/A SER 140.A OG SER 142.A OG no hydrogen 2.531 N/A GLU 141.A N GLY 197.A O no hydrogen 2.805 N/A SER 142.A N SER 140.A OG no hydrogen 2.989 N/A SER 142.A OG SER 140.A OG no hydrogen 2.531 N/A TRP 145.A N SER 142.A O no hydrogen 3.038 N/A TRP 145.A NE1 GLN 67.A OE1 no hydrogen 2.899 N/A VAL 146.A N SER 142.A O no hydrogen 3.172 N/A GLY 147.A N ALA 143.A O no hydrogen 2.679 N/A ASP 150.A N SER 30.A O no hydrogen 3.153 N/A SER 152.A N ASP 150.A OD1 no hydrogen 3.102 N/A SER 152.A OG ASP 150.A OD1 no hydrogen 2.589 N/A SER 152.A OG ASP 150.A OD2 no hydrogen 3.551 N/A LYS 153.A N ASP 150.A O no hydrogen 3.056 N/A LEU 154.A N GLU 151.A O no hydrogen 3.030 N/A LEU 156.A N LEU 218.A O no hydrogen 3.042 N/A GLN 158.A N LEU 216.A O no hydrogen 2.899 N/A GLN 158.A NE2 ASN 136.A O no hydrogen 3.358 N/A PHE 159.A N LYS 25.A O no hydrogen 2.858 N/A ILE 160.A N LEU 214.A O no hydrogen 2.810 N/A ASN 161.A N ARG 23.A O no hydrogen 2.818 N/A ASN 161.A ND2 ASP 233.A OD2 no hydrogen 2.902 N/A VAL 163.A N ASP 178.A O no hydrogen 2.939 N/A LYS 164.A N GLU 21.A O no hydrogen 2.843 N/A VAL 165.A N TRP 176.A O no hydrogen 2.924 N/A TYR 166.A N LYS 19.A O no hydrogen 2.788 N/A TYR 166.A OH GLU 21.A OE1 no hydrogen 2.693 N/A LYS 167.A N THR 173.A O no hydrogen 2.718 N/A LYS 167.A NZ ASP 175.A OD2 no hydrogen 3.270 N/A THR 169.A N ASP 171.A O no hydrogen 2.596 N/A THR 169.A OG1 THR 169.A O no hydrogen 2.755 N/A THR 169.A OG1 ASP 171.A O no hydrogen 3.294 N/A THR 169.A OG1 THR 173.A OG1 no hydrogen 2.862 N/A SER 170.A OG PHE 172.A O no hydrogen 3.299 N/A THR 173.A N LYS 167.A O no hydrogen 2.998 N/A THR 173.A OG1 THR 169.A OG1 no hydrogen 2.862 N/A ASP 175.A N VAL 165.A O no hydrogen 2.808 N/A TRP 176.A N VAL 165.A O no hydrogen 3.136 N/A ASP 178.A N VAL 163.A O no hydrogen 2.979 N/A PHE 180.A N ASP 178.A OD1 no hydrogen 2.877 N/A SER 186.A N ASP 184.A OD1 no hydrogen 2.995 N/A SER 186.A OG ASP 184.A OD1 no hydrogen 2.789 N/A ARG 187.A N ASP 184.A O no hydrogen 3.029 N/A TRP 188.A N ASP 184.A O no hydrogen 2.960 N/A TRP 188.A NE1 ASP 178.A OD2 no hydrogen 2.833 N/A GLY 189.A N TYR 10.A O no hydrogen 2.796 N/A GLY 191.A N GLU 8.A O no hydrogen 2.757 N/A TYR 193.A N LEU 202.A O no hydrogen 3.110 N/A TYR 193.A OH GLU 8.A OE2 no hydrogen 2.579 N/A THR 194.A OG1 VAL 200.A O no hydrogen 2.745 N/A PHE 195.A N THR 194.A OG1 no hydrogen 2.775 N/A ASN 198.A N PHE 195.A O no hydrogen 3.086 N/A ARG 199.A N SER 139.A O no hydrogen 2.879 N/A ARG 199.A NE SER 140.A O no hydrogen 3.386 N/A VAL 200.A N ASN 198.A OD1 no hydrogen 2.863 N/A ASP 201.A N PHE 4.A O no hydrogen 2.942 N/A LEU 202.A N TYR 193.A O no hydrogen 2.851 N/A THR 203.A N GLY 6.A O no hydrogen 2.957 N/A ASP 204.A N ASP 192.A OD2 no hydrogen 2.779 N/A LYS 205.A N THR 203.A OG1 no hydrogen 3.142 N/A ASN 206.A N THR 203.A O no hydrogen 3.029 N/A ILE 207.A N ASP 204.A O no hydrogen 3.428 N/A TYR 208.A N ILE 215.A O no hydrogen 2.840 N/A ARG 210.A N MET 213.A O no hydrogen 2.963 N/A ARG 210.A NH1 PHE 226.A O no hydrogen 2.628 N/A ARG 210.A NH2 PHE 226.A O no hydrogen 3.263 N/A MET 213.A N ARG 210.A O no hydrogen 2.978 N/A LEU 214.A N ILE 160.A O no hydrogen 2.900 N/A ILE 215.A N TYR 208.A O no hydrogen 2.701 N/A LEU 216.A N GLN 158.A O no hydrogen 2.923 N/A ALA 217.A N ASN 206.A O no hydrogen 2.903 N/A LEU 218.A N LEU 156.A O no hydrogen 2.902 N/A THR 219.A N SER 5.A O no hydrogen 2.831 N/A THR 219.A OG1 ASN 206.A OD1 no hydrogen 3.220 N/A THR 219.A OG1 ARG 220.A O no hydrogen 3.035 N/A LYS 221.A N ASP 3.A O no hydrogen 3.014 N/A LYS 221.A NZ LYS 2.A O no hydrogen 2.759 N/A LYS 221.A NZ ASP 201.A OD2 no hydrogen 3.039 N/A GLY 222.A N GLU 224.A OE1 no hydrogen 3.179 N/A GLY 222.A N GLU 224.A OE2 no hydrogen 3.013 N/A GLN 223.A N ARG 220.A O no hydrogen 3.071 N/A GLU 224.A N GLU 224.A OE1 no hydrogen 2.889 N/A