Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ire_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 11.A N SER 14.A OG no hydrogen 2.544 N/A THR 11.A OG1 SER 14.A OG no hydrogen 3.021 N/A SER 14.A N THR 11.A OG1 no hydrogen 3.053 N/A SER 14.A OG THR 11.A O no hydrogen 2.538 N/A SER 14.A OG THR 11.A OG1 no hydrogen 3.021 N/A LEU 15.A N THR 11.A O no hydrogen 3.123 N/A ARG 16.A N LEU 12.A O no hydrogen 3.229 N/A GLU 18.A N LEU 15.A O no hydrogen 2.785 N/A GLN 22.A N ALA 19.A O no hydrogen 3.439 N/A VAL 24.A N PHE 21.A O no hydrogen 3.125 N/A GLY 25.A N PHE 21.A O no hydrogen 2.875 N/A ALA 26.A N GLN 22.A O no hydrogen 3.049 N/A GLN 28.A N VAL 24.A O no hydrogen 3.030 N/A GLN 28.A NE2 HIS 94.A O no hydrogen 3.159 N/A ILE 29.A N GLY 25.A O no hydrogen 2.862 N/A ALA 30.A N ALA 26.A O no hydrogen 2.712 N/A GLU 31.A N ALA 27.A O no hydrogen 3.001 N/A LEU 32.A N GLN 28.A O no hydrogen 3.125 N/A ASP 33.A N ILE 29.A O no hydrogen 3.097 N/A THR 34.A N ALA 30.A O no hydrogen 3.170 N/A THR 34.A OG1 ALA 30.A O no hydrogen 2.975 N/A THR 34.A OG1 GLU 31.A O no hydrogen 2.660 N/A LEU 35.A N GLU 31.A O no hydrogen 2.978 N/A ARG 36.A N LEU 32.A O no hydrogen 2.698 N/A ARG 36.A NH2 GLU 87.A OE1 no hydrogen 3.261 N/A ALA 37.A N ASP 33.A O no hydrogen 2.644 N/A ALA 38.A N THR 34.A O no hydrogen 2.811 N/A HIS 39.A N LEU 35.A O no hydrogen 2.789 N/A HIS 39.A NE2 HIS 83.A O no hydrogen 2.815 N/A ALA 40.A N ARG 36.A O no hydrogen 2.795 N/A ALA 41.A N ALA 37.A O no hydrogen 3.047 N/A GLU 42.A N ALA 38.A O no hydrogen 3.334 N/A ARG 43.A N HIS 39.A O no hydrogen 3.070 N/A THR 44.A N ALA 40.A O no hydrogen 3.180 N/A SER 45.A N ALA 41.A O no hydrogen 2.900 N/A SER 45.A OG ALA 41.A O no hydrogen 2.809 N/A VAL 46.A N GLU 42.A O no hydrogen 2.861 N/A GLN 47.A N ARG 43.A O no hydrogen 2.639 N/A LYS 48.A N THR 44.A O no hydrogen 2.929 N/A THR 49.A N SER 45.A O no hydrogen 3.278 N/A GLN 50.A N VAL 46.A O no hydrogen 3.016 N/A ASN 51.A N GLN 47.A O no hydrogen 2.762 N/A ALA 52.A N LYS 48.A O no hydrogen 2.786 N/A ALA 53.A N THR 49.A O no hydrogen 2.966 N/A ALA 53.A N GLN 50.A O no hydrogen 3.175 N/A ILE 54.A N GLN 50.A O no hydrogen 2.977 N/A LYS 56.A N ALA 53.A O no hydrogen 2.983 N/A ASN 61.A ND2 ASN 61.A O no hydrogen 2.997 N/A LYS 66.A N ALA 63.A O no hydrogen 3.294 N/A ILE 69.A N ILE 65.A O no hydrogen 3.075 N/A ASN 70.A N LYS 66.A O no hydrogen 3.182 N/A ASP 71.A N ASN 67.A O no hydrogen 3.062 N/A GLN 72.A N SER 68.A O no hydrogen 3.103 N/A GLN 72.A NE2 GLN 50.A O no hydrogen 3.349 N/A THR 73.A N ILE 69.A O no hydrogen 2.759 N/A LYS 74.A N ASP 71.A O no hydrogen 3.218 N/A GLN 75.A N ASP 71.A O no hydrogen 2.953 N/A TRP 76.A N GLN 72.A O no hydrogen 2.973 N/A THR 77.A OG1 THR 73.A O no hydrogen 3.329 N/A THR 77.A OG1 GLY 217.A O no hydrogen 3.081 N/A ASP 78.A N LYS 74.A O no hydrogen 2.965 N/A MET 79.A N GLN 75.A O no hydrogen 3.023 N/A ILE 80.A N TRP 76.A O no hydrogen 2.952 N/A ALA 81.A N THR 77.A O no hydrogen 2.925 N/A ARG 82.A N ASP 78.A O no hydrogen 3.169 N/A HIS 83.A N MET 79.A O no hydrogen 2.857 N/A ARG 84.A N ILE 80.A O no hydrogen 2.840 N/A LYS 85.A N ALA 81.A O no hydrogen 2.963 N/A GLU 86.A N ARG 82.A O no hydrogen 3.106 N/A GLU 87.A N HIS 83.A O no hydrogen 3.010 N/A TRP 88.A N ARG 84.A O no hydrogen 2.831 N/A ASP 89.A N LYS 85.A O no hydrogen 2.945 N/A MET 90.A N GLU 86.A O no hydrogen 3.107 N/A LEU 91.A N GLU 87.A O no hydrogen 2.988 N/A ARG 92.A N TRP 88.A O no hydrogen 2.969 N/A ARG 92.A NH2 ASP 89.A OD1 no hydrogen 2.872 N/A GLN 93.A N ASP 89.A O no hydrogen 2.965 N/A HIS 94.A N MET 90.A O no hydrogen 2.760 N/A VAL 95.A N LEU 91.A O no hydrogen 2.955 N/A GLN 96.A N ARG 92.A O no hydrogen 2.976 N/A GLN 96.A NE2 ARG 92.A O no hydrogen 3.564 N/A ASP 97.A N GLN 93.A O no hydrogen 3.072 N/A SER 98.A N HIS 94.A O no hydrogen 3.058 N/A SER 98.A OG HIS 94.A O no hydrogen 2.705 N/A SER 98.A OG VAL 95.A O no hydrogen 3.532 N/A GLN 99.A NE2 GLN 96.A OE1 no hydrogen 3.405 N/A MET 102.A N SER 98.A O no hydrogen 2.857 N/A LYS 103.A N GLN 99.A O no hydrogen 3.246 N/A ALA 104.A N ASP 100.A O no hydrogen 3.162 N/A LEU 105.A N ALA 101.A O no hydrogen 2.921 N/A MET 106.A N MET 102.A O no hydrogen 3.041 N/A LEU 107.A N LYS 103.A O no hydrogen 3.065 N/A THR 108.A N ALA 104.A O no hydrogen 3.049 N/A THR 108.A OG1 ALA 104.A O no hydrogen 3.039 N/A VAL 109.A N LEU 105.A O no hydrogen 2.673 N/A GLN 110.A N MET 106.A O no hydrogen 2.816 N/A GLN 110.A NE2 HIS 188.A O no hydrogen 3.251 N/A GLN 110.A NE2 GLN 191.A OE1 no hydrogen 2.721 N/A ALA 111.A N LEU 107.A O no hydrogen 2.904 N/A ALA 112.A N THR 108.A O no hydrogen 3.004 N/A GLN 113.A N VAL 109.A O no hydrogen 3.186 N/A GLN 113.A NE2 GLU 8.A O no hydrogen 3.057 N/A ILE 114.A N GLN 110.A O no hydrogen 3.052 N/A LYS 115.A N ALA 111.A O no hydrogen 2.986 N/A GLN 116.A N ALA 112.A O no hydrogen 2.836 N/A LEU 117.A N GLN 113.A O no hydrogen 2.898 N/A GLU 118.A N ILE 114.A O no hydrogen 2.752 N/A ASP 119.A N LYS 115.A O no hydrogen 2.825 N/A ARG 120.A N GLN 116.A O no hydrogen 3.048 N/A ARG 120.A NE ASP 124.A OD1 no hydrogen 3.292 N/A ARG 120.A NH1 PRO 3.A O no hydrogen 2.645 N/A ARG 120.A NH2 GLU 2.A O no hydrogen 3.514 N/A ARG 120.A NH2 PRO 3.A O no hydrogen 3.116 N/A HIS 121.A N LEU 117.A O no hydrogen 2.713 N/A ALA 122.A N GLU 118.A O no hydrogen 2.883 N/A ARG 123.A N ASP 119.A O no hydrogen 3.004 N/A ASP 124.A N ARG 120.A O no hydrogen 3.098 N/A ILE 125.A N HIS 121.A O no hydrogen 3.192 N/A LYS 126.A N ALA 122.A O no hydrogen 3.027 N/A ASP 127.A N ARG 123.A O no hydrogen 2.820 N/A LEU 128.A N ASP 124.A O no hydrogen 2.998 N/A ASN 129.A N ILE 125.A O no hydrogen 2.865 N/A ALA 130.A N LYS 126.A O no hydrogen 2.908 N/A LYS 131.A N ASP 127.A O no hydrogen 2.950 N/A GLN 132.A N LEU 128.A O no hydrogen 2.862 N/A GLN 132.A NE2 PHE 166.A O no hydrogen 3.699 N/A GLN 132.A NE2 GLU 169.A OE1 no hydrogen 2.666 N/A ALA 133.A N ASN 129.A O no hydrogen 2.730 N/A LYS 134.A N ALA 130.A O no hydrogen 2.996 N/A MET 135.A N LYS 131.A O no hydrogen 3.044 N/A SER 136.A N GLN 132.A O no hydrogen 3.012 N/A SER 136.A OG GLN 132.A O no hydrogen 3.410 N/A ALA 137.A N ALA 133.A O no hydrogen 3.025 N/A ASP 138.A N LYS 134.A O no hydrogen 2.872 N/A THR 139.A N MET 135.A O no hydrogen 3.066 N/A THR 139.A OG1 MET 135.A O no hydrogen 3.431 N/A THR 139.A OG1 SER 136.A O no hydrogen 2.546 N/A ALA 140.A N SER 136.A O no hydrogen 3.168 N/A LYS 141.A N ALA 137.A O no hydrogen 2.989 N/A GLU 142.A N ASP 138.A O no hydrogen 3.118 N/A VAL 143.A N THR 139.A O no hydrogen 3.193 N/A GLN 144.A N ALA 140.A O no hydrogen 3.207 N/A ASN 145.A N GLU 142.A O no hydrogen 3.020 N/A ASP 146.A N GLU 142.A O no hydrogen 3.240 N/A ASP 152.A N ASN 149.A O no hydrogen 3.441 N/A ARG 156.A N ASP 152.A O no hydrogen 3.226 N/A GLU 157.A N ARG 153.A O no hydrogen 3.017 N/A LYS 158.A N ARG 154.A O no hydrogen 2.764 N/A ARG 159.A N LEU 155.A O no hydrogen 2.831 N/A GLN 160.A N ARG 156.A O no hydrogen 2.867 N/A ASN 161.A N GLU 157.A O no hydrogen 2.973 N/A ASN 162.A N LYS 158.A O no hydrogen 2.825 N/A ASN 162.A N ARG 159.A O no hydrogen 3.246 N/A VAL 163.A N ARG 159.A O no hydrogen 3.093 N/A ARG 165.A N ASN 161.A O no hydrogen 3.472 N/A PHE 166.A N ASN 162.A O no hydrogen 2.584 N/A MET 167.A N VAL 163.A O no hydrogen 2.598 N/A GLU 168.A N LYS 164.A O no hydrogen 3.114 N/A GLU 169.A N ARG 165.A O no hydrogen 3.132 N/A LYS 170.A N PHE 166.A O no hydrogen 3.053 N/A LYS 170.A NZ ASN 129.A OD1 no hydrogen 2.238 N/A LYS 171.A N MET 167.A O no hydrogen 3.041 N/A GLN 172.A N GLU 168.A O no hydrogen 2.860 N/A ILE 173.A N GLU 169.A O no hydrogen 2.998 N/A GLY 174.A N LYS 170.A O no hydrogen 3.190 N/A VAL 175.A N LYS 171.A O no hydrogen 3.185 N/A LYS 176.A N GLN 172.A O no hydrogen 3.095 N/A GLN 177.A N ILE 173.A O no hydrogen 2.795 N/A GLN 177.A NE2 HIS 121.A O no hydrogen 3.082 N/A GLY 178.A N GLY 174.A O no hydrogen 2.739 N/A ARG 179.A N VAL 175.A O no hydrogen 3.020 N/A ARG 179.A NH1 GLU 182.A OE1 no hydrogen 3.284 N/A ALA 180.A N LYS 176.A O no hydrogen 3.004 N/A MET 181.A N GLN 177.A O no hydrogen 2.834 N/A GLU 182.A N GLY 178.A O no hydrogen 2.921 N/A LYS 183.A N ARG 179.A O no hydrogen 2.771 N/A LEU 184.A N ALA 180.A O no hydrogen 2.952 N/A LYS 185.A N MET 181.A O no hydrogen 2.939 N/A LEU 186.A N GLU 182.A O no hydrogen 2.968 N/A ALA 187.A N LYS 183.A O no hydrogen 3.062 N/A HIS 188.A N LEU 184.A O no hydrogen 3.097 N/A HIS 188.A NE2 GLN 113.A OE1 no hydrogen 2.564 N/A SER 189.A N LYS 185.A O no hydrogen 3.000 N/A SER 189.A OG LYS 185.A O no hydrogen 3.393 N/A LYS 190.A N LEU 186.A O no hydrogen 2.981 N/A GLN 191.A N ALA 187.A O no hydrogen 2.935 N/A ILE 192.A N HIS 188.A O no hydrogen 3.022 N/A GLU 193.A N SER 189.A O no hydrogen 3.080 N/A GLU 194.A N LYS 190.A O no hydrogen 2.808 N/A PHE 195.A N GLN 191.A O no hydrogen 2.795 N/A SER 196.A N ILE 192.A O no hydrogen 3.161 N/A SER 196.A OG ILE 192.A O no hydrogen 3.066 N/A THR 197.A N GLU 193.A O no hydrogen 3.048 N/A THR 197.A OG1 GLU 194.A O no hydrogen 3.365 N/A ASP 198.A N GLU 194.A O no hydrogen 3.055 N/A VAL 199.A N PHE 195.A O no hydrogen 3.293 N/A GLN 200.A N SER 196.A O no hydrogen 3.065 N/A LYS 201.A N THR 197.A O no hydrogen 2.787 N/A LYS 201.A NZ ASP 198.A OD1 no hydrogen 3.535 N/A LEU 202.A N ASP 198.A O no hydrogen 2.932 N/A MET 203.A N VAL 199.A O no hydrogen 3.038 N/A ASP 204.A N GLN 200.A O no hydrogen 3.010 N/A MET 205.A N LYS 201.A O no hydrogen 2.783 N/A TYR 206.A N LEU 202.A O no hydrogen 3.002 N/A LYS 207.A N MET 203.A O no hydrogen 2.953 N/A ILE 208.A N ASP 204.A O no hydrogen 2.878 N/A GLU 209.A N MET 205.A O no hydrogen 2.663 N/A GLU 210.A N TYR 206.A O no hydrogen 2.866 N/A GLU 211.A N LYS 207.A O no hydrogen 2.922 N/A ALA 212.A N ILE 208.A O no hydrogen 2.875 N/A TYR 213.A N GLU 209.A O no hydrogen 3.205 N/A TYR 213.A N GLU 210.A O no hydrogen 3.316 N/A LYS 214.A N GLU 211.A O no hydrogen 3.380 N/A LYS 214.A NZ GLU 211.A OE1 no hydrogen 3.287 N/A THR 215.A N ALA 212.A O no hydrogen 3.269 N/A GLN 216.A N TYR 213.A O no hydrogen 3.101 N/A GLY 217.A N TYR 213.A O no hydrogen 2.968 N/A THR 219.A N GLN 216.A O no hydrogen 2.736 N/A GLU 220.A N GLY 217.A O no hydrogen 3.190 N/A