Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ixn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N HIS 209.A O no hydrogen 2.957 N/A LEU 5.A N ASP 39.A OD2 no hydrogen 2.870 N/A GLY 6.A N LEU 211.A O no hydrogen 2.727 N/A VAL 7.A N GLY 40.A O no hydrogen 2.954 N/A ASN 8.A N ILE 213.A O no hydrogen 3.021 N/A ASN 8.A ND2 ASP 10.A OD2 no hydrogen 3.118 N/A ILE 9.A N THR 42.A O no hydrogen 3.067 N/A ASP 10.A N ASN 8.A OD1 no hydrogen 2.753 N/A ILE 12.A N ILE 9.A O no hydrogen 2.820 N/A THR 14.A N ASP 10.A O no hydrogen 3.155 N/A THR 14.A OG1 HIS 11.A ND1 no hydrogen 2.841 N/A LEU 15.A N HIS 11.A O no hydrogen 3.480 N/A ARG 16.A N ILE 12.A O no hydrogen 3.295 N/A ARG 16.A NE ASN 17.A OD1 no hydrogen 2.967 N/A ARG 16.A NH1 ASP 56.A OD1 no hydrogen 3.445 N/A ARG 16.A NH1 ASP 56.A OD2 no hydrogen 2.805 N/A ARG 16.A NH2 ASN 17.A OD1 no hydrogen 3.268 N/A ARG 16.A NH2 HIS 51.A O no hydrogen 3.048 N/A ARG 16.A NH2 ASP 56.A OD1 no hydrogen 2.663 N/A ASN 17.A N ALA 13.A O no hydrogen 2.720 N/A ASN 17.A ND2 ARG 49.A O no hydrogen 3.477 N/A ASN 17.A ND2 ARG 50.A O no hydrogen 2.849 N/A ASN 17.A ND2 HIS 51.A O no hydrogen 3.013 N/A ARG 19.A N ARG 16.A O no hydrogen 3.048 N/A GLY 20.A N ARG 16.A O no hydrogen 3.207 N/A THR 21.A OG1 TYR 23.A O no hydrogen 2.846 N/A VAL 27.A N ASP 25.A OD1 no hydrogen 2.866 N/A GLN 28.A N ASP 25.A O no hydrogen 2.944 N/A ALA 29.A N ASP 25.A O no hydrogen 3.379 N/A ALA 30.A N PRO 26.A O no hydrogen 2.949 N/A ILE 32.A N GLN 28.A O no hydrogen 3.193 N/A ALA 33.A N ALA 29.A O no hydrogen 2.991 N/A GLU 34.A N ALA 30.A O no hydrogen 2.973 N/A GLN 35.A N ILE 32.A O no hydrogen 3.119 N/A ALA 36.A N ALA 33.A O no hydrogen 3.070 N/A ALA 38.A N ALA 33.A O no hydrogen 2.958 N/A ASP 39.A N LEU 5.A O no hydrogen 2.829 N/A ILE 41.A N ARG 67.A O no hydrogen 3.159 N/A THR 42.A N VAL 7.A O no hydrogen 2.780 N/A THR 42.A OG1 ASN 212.A OD1 no hydrogen 2.684 N/A VAL 43.A N ASN 69.A O no hydrogen 3.150 N/A HIS 44.A N ASP 10.A OD1 no hydrogen 2.740 N/A HIS 44.A NE2 GLU 95.A OE2 no hydrogen 2.831 N/A LEU 45.A N GLU 71.A O no hydrogen 3.072 N/A ARG 46.A NH1 HIS 51.A NE2 no hydrogen 3.250 N/A ARG 46.A NH2 GLU 99.A OE1 no hydrogen 3.002 N/A ARG 49.A N ARG 46.A O no hydrogen 2.768 N/A ARG 49.A NE ASP 54.A OD1 no hydrogen 2.568 N/A ARG 49.A NH1 ARG 46.A O no hydrogen 2.834 N/A ARG 49.A NH1 GLU 77.A OE1 no hydrogen 3.406 N/A ARG 49.A NH2 ASP 54.A OD1 no hydrogen 3.049 N/A ARG 49.A NH2 GLU 77.A OE1 no hydrogen 2.965 N/A ARG 50.A N ASP 48.A OD1 no hydrogen 3.262 N/A ARG 50.A NE ASP 48.A OD1 no hydrogen 3.387 N/A ARG 50.A NE ASP 48.A OD2 no hydrogen 3.016 N/A ARG 50.A NH1 GLU 99.A O no hydrogen 2.706 N/A ARG 50.A NH2 ARG 97.A O no hydrogen 3.107 N/A ARG 50.A NH2 GLU 99.A O no hydrogen 2.761 N/A ILE 52.A N HIS 51.A ND1 no hydrogen 2.679 N/A THR 53.A N ASP 56.A OD1 no hydrogen 2.855 N/A ARG 55.A NE ASP 56.A OD2 no hydrogen 3.337 N/A ARG 55.A NH1 ASP 25.A OD2 no hydrogen 3.177 N/A ARG 55.A NH2 ASP 25.A OD1 no hydrogen 2.650 N/A ARG 55.A NH2 ASP 25.A OD2 no hydrogen 3.318 N/A ARG 55.A NH2 ASP 56.A OD2 no hydrogen 3.120 N/A ASP 56.A N THR 53.A OG1 no hydrogen 3.353 N/A VAL 57.A N THR 53.A O no hydrogen 3.136 N/A ARG 58.A N ASP 54.A O no hydrogen 2.844 N/A ILE 59.A N ARG 55.A O no hydrogen 2.762 N/A LEU 60.A N ASP 56.A O no hydrogen 2.706 N/A ARG 61.A N VAL 57.A O no hydrogen 3.147 N/A ARG 61.A NE THR 85.A O no hydrogen 2.954 N/A ARG 61.A NE LYS 86.A O no hydrogen 3.244 N/A ARG 61.A NH1 ARG 61.A O no hydrogen 2.958 N/A ARG 61.A NH2 LYS 86.A O no hydrogen 2.955 N/A GLN 62.A N ILE 59.A O no hydrogen 2.847 N/A THR 63.A N ILE 59.A O no hydrogen 2.928 N/A THR 63.A N LEU 60.A O no hydrogen 3.069 N/A THR 63.A OG1 ILE 59.A O no hydrogen 3.086 N/A LEU 64.A N LEU 60.A O no hydrogen 2.830 N/A ASP 65.A N GLU 34.A OE1 no hydrogen 3.017 N/A THR 66.A N GLU 34.A OE2 no hydrogen 2.870 N/A THR 66.A OG1 GLU 34.A OE2 no hydrogen 2.514 N/A ARG 67.A NH1 GLU 210.A OE1 no hydrogen 2.925 N/A ARG 67.A NH1 GLU 210.A OE2 no hydrogen 3.209 N/A ARG 67.A NH2 GLU 210.A OE1 no hydrogen 2.870 N/A ASN 69.A N ILE 41.A O no hydrogen 2.952 N/A ASN 69.A ND2 THR 42.A OG1 no hydrogen 3.073 N/A ASN 69.A ND2 ASN 212.A OD1 no hydrogen 3.514 N/A LEU 70.A N PHE 89.A O no hydrogen 3.109 N/A GLU 71.A N VAL 43.A O no hydrogen 2.787 N/A MET 72.A N CYS 91.A O no hydrogen 3.033 N/A THR 75.A N ALA 73.A O no hydrogen 3.153 N/A MET 78.A N THR 75.A OG1 no hydrogen 3.298 N/A LEU 79.A N THR 75.A O no hydrogen 3.050 N/A ALA 80.A N GLU 76.A O no hydrogen 3.036 N/A ILE 81.A N GLU 77.A O no hydrogen 3.084 N/A ALA 82.A N MET 78.A O no hydrogen 2.762 N/A VAL 83.A N LEU 79.A O no hydrogen 3.028 N/A GLU 84.A N ALA 80.A O no hydrogen 3.112 N/A THR 85.A N ILE 81.A O no hydrogen 2.732 N/A THR 85.A OG1 ILE 81.A O no hydrogen 2.800 N/A LYS 86.A N ALA 82.A O no hydrogen 2.615 N/A LYS 86.A NZ VAL 83.A O no hydrogen 2.970 N/A PHE 89.A N MET 68.A O no hydrogen 3.024 N/A CYS 90.A N GLN 128.A O no hydrogen 3.148 N/A CYS 90.A SG LEU 70.A O no hydrogen 3.583 N/A CYS 91.A N LEU 70.A O no hydrogen 2.930 N/A CYS 91.A SG SER 130.A O no hydrogen 3.812 N/A LEU 92.A N SER 130.A O no hydrogen 2.848 N/A VAL 93.A N MET 72.A O no hydrogen 2.833 N/A GLU 99.A N LYS 96.A O no hydrogen 2.943 N/A LEU 106.A N PHE 132.A O no hydrogen 2.841 N/A VAL 108.A N GLN 139.A OE1 no hydrogen 2.800 N/A ALA 109.A N GLN 139.A OE1 no hydrogen 3.133 N/A GLY 110.A N ASP 107.A OD2 no hydrogen 2.715 N/A GLN 111.A N VAL 108.A O no hydrogen 2.876 N/A GLN 111.A NE2 ASP 107.A O no hydrogen 2.905 N/A ARG 112.A NE ALA 109.A O no hydrogen 3.135 N/A LYS 114.A NZ GLN 111.A OE1 no hydrogen 2.654 N/A MET 115.A N GLN 111.A O no hydrogen 3.127 N/A ARG 116.A N ARG 112.A O no hydrogen 2.800 N/A ARG 116.A NH1 GLU 145.A O no hydrogen 3.191 N/A ASP 117.A N ASP 113.A O no hydrogen 3.033 N/A ALA 118.A N LYS 114.A O no hydrogen 2.994 N/A CYS 119.A N MET 115.A O no hydrogen 3.127 N/A CYS 119.A SG MET 115.A O no hydrogen 3.056 N/A LYS 120.A N ARG 116.A O no hydrogen 3.175 N/A LYS 120.A NZ ASP 124.A OD2 no hydrogen 3.039 N/A ARG 121.A N ASP 117.A O no hydrogen 2.992 N/A ARG 121.A NH1 GLU 76.A OE1 no hydrogen 3.507 N/A ARG 121.A NH1 GLU 76.A OE2 no hydrogen 3.111 N/A ARG 121.A NH2 GLU 76.A OE1 no hydrogen 3.058 N/A LEU 122.A N ALA 118.A O no hydrogen 2.885 N/A ALA 123.A N CYS 119.A O no hydrogen 2.733 N/A ASP 124.A N LYS 120.A O no hydrogen 2.754 N/A ASP 124.A N ARG 121.A O no hydrogen 3.235 N/A ALA 125.A N ARG 121.A O no hydrogen 3.296 N/A ALA 125.A N LEU 122.A O no hydrogen 3.207 N/A GLY 126.A N ALA 123.A O no hydrogen 3.016 N/A ILE 127.A N LEU 122.A O no hydrogen 2.828 N/A GLN 128.A N HIS 88.A O no hydrogen 3.143 N/A SER 130.A N CYS 90.A O no hydrogen 2.699 N/A LEU 131.A N PHE 150.A O no hydrogen 2.996 N/A PHE 132.A N LEU 92.A O no hydrogen 3.062 N/A ILE 133.A N GLU 152.A O no hydrogen 3.071 N/A ASP 136.A N ASP 134.A O no hydrogen 2.628 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.621 N/A GLU 138.A N ASP 136.A OD2 no hydrogen 2.500 N/A GLN 139.A N ASP 136.A OD2 no hydrogen 3.414 N/A ILE 140.A N ASP 136.A O no hydrogen 2.904 N/A LYS 141.A N GLU 137.A O no hydrogen 2.871 N/A LYS 141.A NZ GLU 145.A OE2 no hydrogen 2.816 N/A ALA 142.A N GLU 138.A O no hydrogen 3.009 N/A ALA 143.A N GLN 139.A O no hydrogen 2.772 N/A ALA 144.A N ILE 140.A O no hydrogen 2.980 N/A GLU 145.A N LYS 141.A O no hydrogen 2.866 N/A VAL 146.A N ALA 142.A O no hydrogen 2.832 N/A GLY 147.A N ALA 144.A O no hydrogen 3.136 N/A ALA 148.A N ALA 143.A O no hydrogen 3.425 N/A PHE 150.A N VAL 129.A O no hydrogen 3.104 N/A ILE 151.A N LYS 187.A O no hydrogen 3.262 N/A GLU 152.A N LEU 131.A O no hydrogen 3.046 N/A ILE 153.A N ASN 189.A O no hydrogen 2.808 N/A HIS 154.A N ILE 133.A O no hydrogen 2.751 N/A THR 155.A N GLY 191.A O no hydrogen 3.091 N/A THR 155.A OG1 HIS 192.A O no hydrogen 2.467 N/A TYR 158.A OH ASN 198.A O no hydrogen 2.576 N/A ALA 159.A N THR 155.A O no hydrogen 2.927 N/A ASP 160.A N GLY 156.A O no hydrogen 2.891 N/A ALA 161.A N TYR 158.A O no hydrogen 3.263 N/A GLU 166.A N THR 163.A OG1 no hydrogen 3.171 N/A GLN 167.A N THR 163.A O no hydrogen 2.996 N/A ALA 168.A N ASP 164.A O no hydrogen 2.998 N/A GLN 169.A N ALA 165.A O no hydrogen 2.950 N/A GLU 170.A N GLU 166.A O no hydrogen 3.003 N/A LEU 171.A N GLN 167.A O no hydrogen 2.846 N/A ALA 172.A N ALA 168.A O no hydrogen 2.897 N/A ARG 173.A N GLN 169.A O no hydrogen 2.989 N/A ARG 173.A NE ALA 135.A O no hydrogen 3.204 N/A ARG 173.A NH1 GLU 170.A OE2 no hydrogen 2.594 N/A ILE 174.A N GLU 170.A O no hydrogen 2.824 N/A ALA 175.A N LEU 171.A O no hydrogen 2.920 N/A LYS 176.A N ALA 172.A O no hydrogen 3.063 N/A ALA 177.A N ARG 173.A O no hydrogen 3.057 N/A ALA 178.A N ILE 174.A O no hydrogen 2.909 N/A THR 179.A N ALA 175.A O no hydrogen 3.083 N/A THR 179.A OG1 ALA 175.A O no hydrogen 3.261 N/A THR 179.A OG1 GLU 207.A OE1 no hydrogen 2.815 N/A PHE 180.A N LYS 176.A O no hydrogen 2.966 N/A ALA 181.A N ALA 177.A O no hydrogen 2.913 N/A ALA 182.A N ALA 178.A O no hydrogen 3.011 N/A SER 183.A N THR 179.A O no hydrogen 3.132 N/A SER 183.A OG PHE 180.A O no hydrogen 2.501 N/A LEU 184.A N ALA 181.A O no hydrogen 2.942 N/A GLY 185.A N ALA 182.A O no hydrogen 2.940 N/A LEU 186.A N ALA 181.A O no hydrogen 3.294 N/A LYS 187.A N PRO 149.A O no hydrogen 3.044 N/A ASN 189.A N ILE 151.A O no hydrogen 2.851 N/A ALA 190.A N GLU 210.A O no hydrogen 3.163 N/A GLY 191.A N ILE 153.A O no hydrogen 3.329 N/A HIS 192.A NE2 THR 102.A O no hydrogen 2.907 N/A TYR 196.A OH ALA 229.A O no hydrogen 2.786 N/A HIS 197.A N THR 195.A OG1 no hydrogen 3.210 N/A ASN 198.A N THR 195.A O no hydrogen 3.252 N/A ASN 198.A N THR 195.A OG1 no hydrogen 3.226 N/A LYS 200.A NZ GLU 239.A OE1 no hydrogen 2.838 N/A ALA 203.A N VAL 199.A O no hydrogen 2.853 N/A ALA 204.A N LYS 200.A O no hydrogen 2.853 N/A ILE 205.A N ILE 202.A O no hydrogen 3.140 N/A GLU 207.A N GLU 207.A OE2 no hydrogen 2.764 N/A MET 208.A N ILE 205.A O no hydrogen 3.053 N/A HIS 209.A N VAL 188.A O no hydrogen 2.880 N/A GLU 210.A N ASN 189.A OD1 no hydrogen 2.545 N/A LEU 211.A N LEU 4.A O no hydrogen 3.047 N/A ASN 212.A N ALA 190.A O no hydrogen 2.927 N/A ASN 212.A ND2 GLU 152.A OE2 no hydrogen 3.081 N/A ILE 213.A N GLY 6.A O no hydrogen 3.025 N/A ILE 218.A N GLY 214.A O no hydrogen 3.096 N/A GLY 219.A N HIS 215.A O no hydrogen 2.846 N/A ARG 220.A N ALA 216.A O no hydrogen 3.032 N/A ARG 220.A N ILE 217.A O no hydrogen 3.268 N/A ALA 221.A N ILE 217.A O no hydrogen 2.867 N/A VAL 222.A N ILE 218.A O no hydrogen 3.117 N/A MET 223.A N ARG 220.A O no hydrogen 2.970 N/A THR 224.A N ARG 220.A O no hydrogen 2.947 N/A THR 224.A OG1 ARG 220.A O no hydrogen 3.534 N/A THR 224.A OG1 GLY 225.A O no hydrogen 3.261 N/A GLY 225.A N ALA 221.A O no hydrogen 2.619 N/A ALA 229.A N GLY 225.A O no hydrogen 3.223 N/A VAL 230.A N LEU 226.A O no hydrogen 2.950 N/A ALA 231.A N LYS 227.A O no hydrogen 2.997 N/A GLU 232.A N ASP 228.A O no hydrogen 2.866 N/A MET 233.A N ALA 229.A O no hydrogen 3.219 N/A LYS 234.A N VAL 230.A O no hydrogen 2.949 N/A LYS 234.A NZ GLY 37.A O no hydrogen 2.923 N/A LYS 234.A NZ ASP 39.A OD1 no hydrogen 3.434 N/A LYS 234.A NZ ASP 39.A OD2 no hydrogen 2.763 N/A ARG 235.A N ALA 231.A O no hydrogen 2.869 N/A ARG 235.A NE GLU 232.A OE1 no hydrogen 2.580 N/A ARG 235.A NH1 GLU 239.A OE2 no hydrogen 2.817 N/A ARG 235.A NH2 GLU 232.A OE1 no hydrogen 2.877 N/A ARG 235.A NH2 GLU 232.A OE2 no hydrogen 2.776 N/A LEU 236.A N GLU 232.A O no hydrogen 3.110 N/A MET 237.A N MET 233.A O no hydrogen 2.931 N/A LEU 238.A N LYS 234.A O no hydrogen 2.903 N/A GLU 239.A N ARG 235.A O no hydrogen 2.998 N/A ALA 240.A N LEU 236.A O no hydrogen 3.068 N/A ARG 241.A N MET 237.A O no hydrogen 3.394 N/A ARG 241.A N LEU 238.A O no hydrogen 3.110 N/A ARG 241.A NE ALA 203.A O no hydrogen 2.670 N/A ARG 241.A NH2 ILE 205.A O no hydrogen 3.079 N/A ARG 241.A NH2 MET 208.A O no hydrogen 2.720 N/A GLY 242.A N GLU 239.A O no hydrogen 3.010 N/A