Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6a8n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N LYS 141.A O no hydrogen 2.767 N/A ILE 1.A N ASP 196.A OD1 no hydrogen 2.724 N/A VAL 2.A N ASP 191.A O no hydrogen 2.851 N/A GLU 5.A N MET 155.A O no hydrogen 2.957 N/A THR 7.A N LEU 153.A O no hydrogen 2.896 N/A THR 7.A OG1 GLU 8.A O no hydrogen 3.263 N/A VAL 9.A N SER 63.A OG no hydrogen 3.111 N/A GLU 10.A N GLU 10.A OE1 no hydrogen 2.775 N/A ASN 11.A N GLU 8.A O no hydrogen 3.072 N/A ASN 11.A ND2 THR 7.A OG1 no hydrogen 2.765 N/A GLN 12.A N VAL 9.A O no hydrogen 2.775 N/A PHE 15.A N GLN 12.A O no hydrogen 2.803 N/A ALA 16.A N GLY 32.A O no hydrogen 2.788 N/A ALA 17.A N TYR 59.A O no hydrogen 2.910 N/A ILE 18.A N CYS 30.A O no hydrogen 2.850 N/A TYR 19.A N VAL 57.A O no hydrogen 2.879 N/A TYR 19.A OH GLN 62.A OE1 no hydrogen 2.520 N/A GLN 20.A N SER 27.A O no hydrogen 3.007 N/A LYS 21.A N ASN 55.A O no hydrogen 2.623 N/A LYS 21.A NZ GLU 76.A OE1 no hydrogen 3.270 N/A LYS 21.A NZ GLU 54A.A O no hydrogen 2.867 N/A ASN 22.A ND2 SER 27.A OG no hydrogen 2.619 N/A ASN 22.A ND2 PRO 25E.A O no hydrogen 2.957 N/A SER 27.A N GLN 20.A O no hydrogen 3.047 N/A LYS 29.A N ILE 18.A O no hydrogen 2.855 N/A CYS 30.A N ILE 18.A O no hydrogen 3.189 N/A CYS 30.A SG LYS 29.A O no hydrogen 3.034 N/A CYS 30.A SG SER 197.A OG no hydrogen 3.675 N/A GLY 31.A N SER 197.A O no hydrogen 2.821 N/A SER 33.A N ALA 41.A O no hydrogen 2.877 N/A LEU 34.A N TRP 14.A O no hydrogen 2.888 N/A ILE 35.A N TRP 39.A O no hydrogen 3.119 N/A SER 36.A N TRP 39.A O no hydrogen 3.442 N/A TRP 39.A N SER 36.A O no hydrogen 2.952 N/A VAL 40.A N LEU 100.A O no hydrogen 2.910 N/A ALA 41.A N SER 33.A O no hydrogen 2.898 N/A SER 42.A N ALA 98.A O no hydrogen 2.905 N/A SER 42.A OG GLY 31.A O no hydrogen 2.856 N/A ALA 43.A N SER 42.A OG no hydrogen 2.581 N/A HIS 45.A N ASP 96.A OD2 no hydrogen 2.822 N/A HIS 45.A ND1 ASP 96.A OD1 no hydrogen 2.548 N/A HIS 45.A NE2 SER 197.A OG no hydrogen 2.715 N/A CYS 46.A N ALA 43.A O no hydrogen 3.069 N/A PHE 47.A N ALA 44.A O no hydrogen 2.948 N/A LYS 52.A N LEU 50B.A O no hydrogen 3.036 N/A LYS 53.A NZ GLU 78.A O no hydrogen 3.462 N/A ASN 55.A N LYS 52.A O no hydrogen 3.112 N/A TYR 56.A N LYS 53.A O no hydrogen 3.261 N/A TYR 56.A OH LEU 50B.A O no hydrogen 2.633 N/A VAL 57.A N TYR 19.A O no hydrogen 2.938 N/A VAL 58.A N PHE 75.A O no hydrogen 3.072 N/A TYR 59.A N ALA 17.A O no hydrogen 2.964 N/A LEU 60.A N MET 73.A O no hydrogen 2.917 N/A GLN 62.A NE2 GLU 72.A OE1 no hydrogen 2.953 N/A SER 63.A N ASN 69.A OD1 no hydrogen 2.910 N/A SER 63.A OG GLU 8.A OE1 no hydrogen 3.387 N/A LYS 64.A N ASN 69.A OD1 no hydrogen 2.996 N/A GLU 65.A N LYS 151.A O no hydrogen 2.885 N/A SER 66.A N TYR 19.A OH no hydrogen 2.913 N/A SER 66.A OG GLU 65.A OE1 no hydrogen 2.468 N/A ASN 69.A ND2 LYS 64.A O no hydrogen 2.884 N/A ASN 69.A ND2 GLU 72.A OE1 no hydrogen 2.862 N/A GLU 72.A N ASN 69.A O no hydrogen 2.869 N/A MET 73.A N LEU 60.A O no hydrogen 2.981 N/A PHE 75.A N VAL 58.A O no hydrogen 2.745 N/A GLU 76.A N ARG 103.A O no hydrogen 2.637 N/A GLU 78.A N LYS 101.A O no hydrogen 2.562 N/A GLN 79.A N LYS 101.A O no hydrogen 3.386 N/A ILE 81.A N LEU 99.A O no hydrogen 2.909 N/A HIS 83.A N ILE 97.A O no hydrogen 3.160 N/A GLU 84.A N GLU 84.A OE2 no hydrogen 2.518 N/A TYR 85.A N HIS 83.A ND1 no hydrogen 2.930 N/A TYR 86.A N HIS 83.A O no hydrogen 2.958 N/A TYR 86.A OH GLU 88.A OE1 no hydrogen 2.689 N/A ARG 87.A N HIS 94.A O no hydrogen 3.230 N/A ASP 89.A N ALA 92.A O no hydrogen 3.233 N/A ALA 92.A N ASP 89.A OD1 no hydrogen 2.861 N/A HIS 94.A N ARG 87.A O no hydrogen 2.818 N/A ASN 95.A ND2 TYR 85.A O no hydrogen 2.619 N/A ALA 98.A N SER 42.A O no hydrogen 2.711 N/A LEU 99.A N ILE 81.A O no hydrogen 2.730 N/A LEU 100.A N VAL 40.A O no hydrogen 2.706 N/A LYS 101.A N GLN 79.A O no hydrogen 2.909 N/A ILE 102.A N CYS 38.A O no hydrogen 2.870 N/A ARG 103.A N GLU 76.A O no hydrogen 2.896 N/A ARG 103.A NH2 GLU 78.A OE2 no hydrogen 3.306 N/A THR 104.A N GLN 108D.A O no hydrogen 2.969 N/A THR 104.A OG1 THR 106B.A OG1 no hydrogen 3.061 N/A CYS 109.A SG ILE 102.A O no hydrogen 3.855 N/A ALA 110.A N PRO 37.A O no hydrogen 2.930 N/A SER 113.A N ILE 116.A O no hydrogen 2.990 N/A SER 113.A OG SER 115.A OG no hydrogen 3.156 N/A SER 115.A N SER 113.A OG no hydrogen 3.099 N/A SER 115.A OG SER 113.A OG no hydrogen 3.156 N/A ILE 116.A N SER 113.A O no hydrogen 3.422 N/A GLN 117.A N PRO 13.A O no hydrogen 2.928 N/A ILE 119.A N LEU 34.A O no hydrogen 2.825 N/A THR 126.A OG1 ASP 127.A O no hydrogen 3.370 N/A THR 126.A OG1 GLU 206.A OE2 no hydrogen 2.689 N/A CYS 134.A N VAL 158.A O no hydrogen 2.666 N/A GLU 135.A N ILE 202.A O no hydrogen 2.665 N/A ILE 136.A N SER 156.A O no hydrogen 2.925 N/A THR 137.A OG1 LYS 154.A O no hydrogen 2.763 N/A GLY 138.A N LYS 154.A O no hydrogen 3.001 N/A GLY 140.A N ASP 196.A OD2 no hydrogen 2.647 N/A LYS 141.A N LYS 194.A O no hydrogen 2.736 N/A LYS 141.A NZ ASP 146.A O no hydrogen 2.536 N/A ASP 146.A N SER 143.A O no hydrogen 2.904 N/A LYS 151.A NZ GLU 65.A O no hydrogen 2.789 N/A ASN 152.A N PRO 150.A O no hydrogen 2.839 N/A ASN 152.A ND2 SER 63.A O no hydrogen 3.677 N/A LEU 153.A N SER 63.A O no hydrogen 2.733 N/A LYS 154.A N GLY 138.A O no hydrogen 3.146 N/A LYS 154.A NZ ILE 1.A O no hydrogen 3.040 N/A LYS 154.A NZ GLY 3.A O no hydrogen 2.949 N/A LYS 154.A NZ GLU 142.A OE2 no hydrogen 2.511 N/A MET 155.A N GLU 5.A O no hydrogen 2.915 N/A SER 156.A N ILE 136.A O no hydrogen 2.803 N/A SER 156.A OG THR 190.A OG1 no hydrogen 2.347 N/A VAL 157.A N SER 156.A OG no hydrogen 2.782 N/A VAL 158.A N CYS 134.A O no hydrogen 2.800 N/A LYS 159.A N ALA 184.A O no hydrogen 2.971 N/A LEU 160.A N SER 132.A O no hydrogen 2.662 N/A VAL 161.A N CYS 182.A O no hydrogen 2.840 N/A GLN 165.A N SER 162.A OG no hydrogen 2.995 N/A GLN 165.A NE2 GLN 165.A O no hydrogen 2.968 N/A CYS 166.A N SER 162.A O no hydrogen 2.814 N/A MET 167.A N HIS 163.A O no hydrogen 2.874 N/A GLN 168.A N GLN 165.A O no hydrogen 3.076 N/A TYR 171.A N GLN 168.A O no hydrogen 2.812 N/A TYR 172.A N CYS 166.A O no hydrogen 2.953 N/A TYR 172.A OH PRO 227.A O no hydrogen 2.566 N/A GLY 173.A N GLN 168.A O no hydrogen 2.958 N/A GLU 175.A N TYR 172.A O no hydrogen 3.213 N/A ILE 176.A N GLY 173.A O no hydrogen 3.337 N/A ASN 177.A ND2 HIS 94.A ND1 no hydrogen 3.688 N/A LYS 179.A N ASN 177.A OD1 no hydrogen 2.654 N/A LYS 179.A NZ ASN 95.A OD1 no hydrogen 3.228 N/A MET 180.A N ASN 177.A O no hydrogen 3.024 N/A LEU 181.A N TYR 230.A O no hydrogen 2.509 N/A ALA 183.A N GLY 228.A O no hydrogen 2.831 N/A ALA 184.A N LYS 159.A O no hydrogen 2.922 N/A TRP 188.A N ASP 185.A O no hydrogen 2.806 N/A LYS 189.A N ASP 185.A OD1 no hydrogen 2.779 N/A LYS 189.A NZ GLU 187B.A OE2 no hydrogen 2.678 N/A THR 190.A OG1 VAL 2.A O no hydrogen 2.704 N/A THR 190.A OG1 SER 156.A OG no hydrogen 2.347 N/A ASP 191.A N VAL 2.A O no hydrogen 3.286 N/A SER 192.A OG ASP 191.A OD1 no hydrogen 3.410 N/A SER 192.A OG TYR 230.A OH no hydrogen 2.732 N/A CYS 193.A N ASP 196.A OD1 no hydrogen 2.811 N/A ASP 196.A N CYS 193.A O no hydrogen 2.792 N/A SER 197.A OG HIS 45.A NE2 no hydrogen 2.715 N/A GLY 198.A N VAL 215.A O no hydrogen 3.074 N/A GLY 199.A N ASP 196.A O no hydrogen 3.149 N/A LEU 201.A N GLY 213.A O no hydrogen 2.817 N/A ILE 202.A N GLU 135.A O no hydrogen 2.827 N/A CYS 203.A N THR 210.A O no hydrogen 2.883 N/A CYS 203.A SG SER 212.A OG no hydrogen 3.337 N/A ILE 205.A N ARG 208.A O no hydrogen 2.844 N/A ARG 208.A N ILE 205.A O no hydrogen 2.822 N/A THR 210.A OG1 ARG 208.A O no hydrogen 2.555 N/A LEU 211.A N ALA 120.A O no hydrogen 2.954 N/A SER 212.A N LEU 201.A O no hydrogen 2.803 N/A GLY 213.A N LEU 201.A O no hydrogen 3.333 N/A VAL 215.A N GLY 199.A O no hydrogen 3.072 N/A SER 216.A N VAL 229.A O no hydrogen 3.052 N/A SER 216.A OG ASP 96.A OD1 no hydrogen 2.707 N/A TRP 217.A N VAL 229.A O no hydrogen 3.286 N/A ARG 219.A N TYR 172.A OH no hydrogen 3.164 N/A ARG 219.A NH1 GLU 223.A OE2 no hydrogen 2.676 N/A CYS 221.A N GLU 144.A OE2 no hydrogen 2.955 N/A CYS 221.A SG SER 192.A O no hydrogen 3.833 N/A ALA 222.A N ASP 191.A OD2 no hydrogen 2.999 N/A LYS 226.A N GLU 223.A O no hydrogen 3.091 N/A LYS 226.A NZ TYR 171.A O no hydrogen 2.944 N/A LYS 226.A NZ HIS 170B.A O no hydrogen 3.160 N/A VAL 229.A N TRP 217.A O no hydrogen 2.808 N/A TYR 230.A N LEU 181.A O no hydrogen 2.521 N/A THR 231.A N ILE 214.A O no hydrogen 2.980 N/A THR 231.A OG1 ASP 96.A O no hydrogen 2.634 N/A ARG 232.A N LYS 179.A O no hydrogen 2.766 N/A ARG 232.A NH1 MET 180.A O no hydrogen 3.294 N/A VAL 233.A N SER 212.A O no hydrogen 3.136 N/A HIS 235.A N ARG 232.A O no hydrogen 2.894 N/A PHE 236.A N VAL 233.A O no hydrogen 2.690 N/A TRP 239.A NE1 GLU 84.A OE2 no hydrogen 2.826 N/A ILE 240.A N PHE 236.A O no hydrogen 2.763 N/A GLN 241.A N LEU 237.A O no hydrogen 2.778 N/A SER 242.A N ASP 238.A O no hydrogen 3.068 N/A SER 242.A OG ASP 238.A O no hydrogen 2.867 N/A SER 242.A OG TRP 239.A O no hydrogen 2.860 N/A HIS 243.A N ILE 240.A O no hydrogen 3.015 N/A ILE 244.A N ILE 240.A O no hydrogen 3.007 N/A GLY 245.A N GLN 241.A O no hydrogen 2.970 N/A GLU 54A.A N GLU 54A.A OE1 no hydrogen 2.750 N/A SER 90A.A OG ASP 89.A O no hydrogen 2.587 N/A LEU 50B.A N PHE 47.A O no hydrogen 3.128 N/A LEU 91B.A N ASP 89.A OD1 no hydrogen 3.139 N/A THR 106B.A N THR 104.A OG1 no hydrogen 3.164 N/A THR 106B.A OG1 THR 104.A OG1 no hydrogen 3.061 N/A GLU 187B.A N ASP 185.A OD1 no hydrogen 3.213 N/A GLY 107C.A N THR 104.A O no hydrogen 3.066 N/A SER 24D.A OG ASN 22.A O no hydrogen 3.553 N/A SER 24D.A OG LYS 23A.A O no hydrogen 2.325 N/A GLN 108D.A N THR 104.A OG1 no hydrogen 3.137 N/A