Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mlx_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N SER 25.A O no hydrogen 2.916 N/A GLN 5.A N THR 23.A O no hydrogen 3.016 N/A GLN 5.A NE2 GLU 6.A O no hydrogen 3.034 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.716 N/A SER 7.A N THR 21.A O no hydrogen 2.866 N/A SER 7.A OG THR 21.A O no hydrogen 3.271 N/A VAL 12.A N THR 124.A O no hydrogen 2.857 N/A LYS 13.A NZ SER 127.A O no hydrogen 2.919 N/A SER 15.A N VAL 85C.A O no hydrogen 2.622 N/A SER 15.A OG PRO 14.A O no hydrogen 2.337 N/A GLU 16.A N LYS 13.A O no hydrogen 3.089 N/A LEU 18.A N LEU 82.A O no hydrogen 2.741 N/A LEU 20.A N LEU 80.A O no hydrogen 2.899 N/A THR 21.A N SER 7.A O no hydrogen 3.108 N/A THR 21.A OG1 SER 79.A OG no hydrogen 3.080 N/A CYS 22.A N PHE 78.A O no hydrogen 2.863 N/A THR 23.A N GLN 5.A O no hydrogen 2.891 N/A THR 23.A OG1 GLN 77.A OE1 no hydrogen 2.902 N/A VAL 24.A N ASN 76.A O no hydrogen 2.928 N/A SER 25.A N GLN 3.A O no hydrogen 2.974 N/A SER 25.A OG GLN 3.A O no hydrogen 3.533 N/A ILE 29.A N ASN 76.A OD1 no hydrogen 3.015 N/A PHE 32.A N ILE 29.A O no hydrogen 3.189 N/A TRP 34.A N ILE 51.A O no hydrogen 2.737 N/A TRP 34.A NE1 ILE 29.A O no hydrogen 3.035 N/A SER 35.A N ALA 96.A O no hydrogen 3.020 N/A SER 35.A OG GLY 49.A O no hydrogen 2.677 N/A SER 35.A OG ASP 98.A OD1 no hydrogen 2.595 N/A SER 35.A OG ASP 98.A OD2 no hydrogen 3.303 N/A ILE 37.A N TYR 94.A O no hydrogen 2.875 N/A ARG 38.A N GLU 46.A O no hydrogen 2.948 N/A ARG 38.A NE GLU 46.A OE1 no hydrogen 2.793 N/A ARG 38.A NH1 ASP 89.A OD1 no hydrogen 2.668 N/A ARG 38.A NH1 TYR 93.A OH no hydrogen 3.020 N/A ARG 38.A NH2 GLU 46.A OE1 no hydrogen 2.979 N/A ARG 38.A NH2 ASP 89.A OD1 no hydrogen 3.494 N/A GLN 39.A N VAL 92.A O no hydrogen 2.897 N/A LYS 43.A N PRO 40.A O no hydrogen 2.928 N/A GLU 46.A N ARG 38.A O no hydrogen 2.836 N/A ILE 48.A N TRP 36.A O no hydrogen 2.928 N/A TYR 50.A N SER 58.A O no hydrogen 2.880 N/A TYR 50.A OH PHE 109F.A O no hydrogen 2.942 N/A ILE 51.A N TRP 34.A O no hydrogen 2.773 N/A TYR 52.A N SER 56.A O no hydrogen 2.890 N/A TYR 53.A N PHE 32.A O no hydrogen 3.142 N/A GLY 55.A N TYR 52.A O no hydrogen 2.795 N/A SER 58.A N TYR 50.A O no hydrogen 3.188 N/A ASN 60.A N ILE 48.A O no hydrogen 2.903 N/A ASN 60.A ND2 TYR 47.A O no hydrogen 3.029 N/A SER 62.A N ASN 60.A OD1 no hydrogen 2.876 N/A SER 62.A OG ASN 60.A OD1 no hydrogen 2.798 N/A LEU 63.A N ASN 60.A O no hydrogen 2.835 N/A ARG 66.A N LEU 63.A O no hydrogen 2.909 N/A ARG 66.A NH1 ASP 89.A OD2 no hydrogen 3.101 N/A ARG 66.A NH1 SER 83A.A O no hydrogen 2.878 N/A ARG 66.A NH2 ASP 89.A OD1 no hydrogen 3.040 N/A VAL 67.A N LEU 63.A O no hydrogen 3.019 N/A SER 68.A N GLU 81.A O no hydrogen 3.139 N/A MET 69.A N TYR 59.A OH no hydrogen 2.872 N/A SER 70.A N SER 79.A O no hydrogen 3.320 N/A ASP 72.A N GLN 77.A O no hydrogen 2.727 N/A SER 74.A OG ASP 72.A OD2 no hydrogen 2.536 N/A ARG 75.A N ASP 72.A O no hydrogen 3.030 N/A ARG 75.A N ASP 72.A OD2 no hydrogen 3.292 N/A ASN 76.A N THR 73.A O no hydrogen 3.134 N/A GLN 77.A N ASP 72.A O no hydrogen 3.137 N/A PHE 78.A N CYS 22.A O no hydrogen 3.165 N/A SER 79.A N SER 70.A O no hydrogen 2.777 N/A SER 79.A OG THR 21.A OG1 no hydrogen 3.080 N/A LEU 80.A N LEU 20.A O no hydrogen 2.860 N/A GLU 81.A N SER 68.A O no hydrogen 2.986 N/A LEU 82.A N LEU 18.A O no hydrogen 2.808 N/A THR 86.A N ASP 89.A OD2 no hydrogen 3.017 N/A ALA 88.A N THR 86.A OG1 no hydrogen 3.257 N/A ASP 89.A N THR 86.A O no hydrogen 2.818 N/A THR 90.A N ALA 87.A O no hydrogen 3.063 N/A THR 90.A OG1 ALA 87.A O no hydrogen 3.397 N/A ALA 91.A N VAL 123.A O no hydrogen 3.105 N/A VAL 92.A N GLN 39.A O no hydrogen 2.948 N/A TYR 93.A N THR 121.A O no hydrogen 2.786 N/A TYR 93.A OH ASP 89.A O no hydrogen 2.685 N/A TYR 94.A N ILE 37.A O no hydrogen 2.728 N/A CYS 95.A N GLU 6.A OE2 no hydrogen 3.011 N/A ALA 96.A N SER 35.A O no hydrogen 2.862 N/A ARG 97.A N LEU 116.A O no hydrogen 2.872 N/A ARG 97.A NE ASP 115.A OD1 no hydrogen 3.284 N/A ARG 97.A NH2 ASP 115.A OD2 no hydrogen 2.675 N/A ASP 98.A N HIS 33.A O no hydrogen 3.000 N/A PHE 99.A N GLY 113J.A O no hydrogen 3.090 N/A GLU 101.A N GLN 110G.A O no hydrogen 3.101 N/A HIS 103.A N GLY 108E.A O no hydrogen 2.841 N/A ASP 115.A N ARG 97.A O no hydrogen 3.149 N/A TRP 117.A NE1 PHE 114K.A O no hydrogen 2.979 N/A GLY 118.A N CYS 95.A O no hydrogen 2.846 N/A GLY 120.A N GLU 6.A OE1 no hydrogen 3.029 N/A GLY 120.A N GLU 6.A OE2 no hydrogen 3.078 N/A THR 121.A N TYR 93.A O no hydrogen 2.887 N/A VAL 123.A N ALA 91.A O no hydrogen 2.954 N/A THR 124.A N GLY 10.A O no hydrogen 2.610 N/A VAL 125.A N THR 90.A OG1 no hydrogen 2.945 N/A SER 126.A N VAL 12.A O no hydrogen 2.966 N/A SER 127.A OG SER 129.A OG no hydrogen 3.147 N/A ALA 128.A N SER 126.A OG no hydrogen 2.756 N/A SER 129.A N SER 127.A OG no hydrogen 3.289 N/A SER 129.A OG SER 127.A OG no hydrogen 3.147 N/A LYS 131.A N PHE 160.A O no hydrogen 2.822 N/A LYS 131.A NZ GLY 132.A O no hydrogen 3.113 N/A LYS 131.A NZ ASP 158.A O no hydrogen 2.697 N/A SER 134.A N LYS 157.A O no hydrogen 2.898 N/A PHE 136.A N LEU 155.A O no hydrogen 2.891 N/A LEU 138.A N GLY 153.A O no hydrogen 2.693 N/A LYS 143.A NZ THR 149.A O no hydrogen 3.255 N/A GLY 147.A N SER 144.A O no hydrogen 3.129 N/A ALA 150.A N VAL 198.A O no hydrogen 2.782 N/A LEU 152.A N VAL 196.A O no hydrogen 3.062 N/A GLY 153.A N LEU 138.A O no hydrogen 2.974 N/A CYS 154.A N SER 194.A O no hydrogen 2.819 N/A CYS 154.A SG GLY 153.A O no hydrogen 3.476 N/A LEU 155.A N PHE 136.A O no hydrogen 2.794 N/A VAL 156.A N LEU 192.A O no hydrogen 2.794 N/A LYS 157.A N SER 134.A O no hydrogen 2.827 N/A ASP 158.A N SER 191.A OG no hydrogen 3.034 N/A TYR 159.A N TYR 190.A O no hydrogen 2.843 N/A TYR 159.A OH GLU 162.A OE1 no hydrogen 2.668 N/A PHE 160.A N LYS 131.A O no hydrogen 2.963 N/A THR 165.A N ASN 213.A O no hydrogen 3.027 N/A THR 165.A OG1 ASN 213.A O no hydrogen 3.547 N/A SER 167.A N ASN 211.A O no hydrogen 3.021 N/A SER 167.A OG ASN 211.A OD1 no hydrogen 2.937 N/A TRP 168.A NE1 SER 194.A OG no hydrogen 2.920 N/A ASN 169.A N ILE 209.A O no hydrogen 2.766 N/A ASN 169.A ND2 THR 207.A O no hydrogen 3.290 N/A SER 170.A N ASN 211.A OD1 no hydrogen 2.739 N/A GLY 171.A N TRP 168.A O no hydrogen 2.931 N/A ALA 172.A N ASN 169.A O no hydrogen 2.973 N/A LEU 173.A N TRP 168.A O no hydrogen 3.415 N/A VAL 177.A N THR 174.A O no hydrogen 3.336 N/A HIS 178.A N VAL 195.A O no hydrogen 2.863 N/A THR 179.A OG1 SER 194.A OG no hydrogen 3.004 N/A PHE 180.A N SER 193.A O no hydrogen 2.979 N/A VAL 183.A N SER 191.A O no hydrogen 2.793 N/A GLN 185.A N LEU 189.A O no hydrogen 3.060 N/A GLN 185.A NE2 ASP 158.A OD1 no hydrogen 2.766 N/A GLN 185.A NE2 LEU 189.A O no hydrogen 3.200 N/A GLY 188.A N GLN 185.A O no hydrogen 2.833 N/A LEU 189.A N SER 187.A OG no hydrogen 3.258 N/A TYR 190.A N TYR 159.A O no hydrogen 2.799 N/A SER 191.A N VAL 183.A O no hydrogen 3.173 N/A LEU 192.A N VAL 156.A O no hydrogen 3.008 N/A SER 194.A N CYS 154.A O no hydrogen 3.061 N/A SER 194.A OG THR 179.A OG1 no hydrogen 3.004 N/A VAL 195.A N HIS 178.A O no hydrogen 2.961 N/A VAL 196.A N LEU 152.A O no hydrogen 2.740 N/A THR 197.A N GLY 176.A O no hydrogen 2.895 N/A VAL 198.A N ALA 150.A O no hydrogen 2.794 N/A SER 200.A N GLY 148.A O no hydrogen 2.984 N/A SER 200.A OG GLY 148.A O no hydrogen 2.534 N/A LEU 203.A N SER 200.A O no hydrogen 2.954 N/A THR 205.A N SER 202.A O no hydrogen 2.938 N/A THR 205.A OG1 SER 202.A O no hydrogen 3.488 N/A GLN 206.A N SER 202.A O no hydrogen 2.867 N/A ILE 209.A N ASN 169.A OD1 no hydrogen 2.772 N/A CYS 210.A N LYS 223.A O no hydrogen 2.991 N/A CYS 210.A SG LYS 223.A O no hydrogen 3.941 N/A ASN 211.A N SER 167.A O no hydrogen 2.715 N/A ASN 211.A ND2 ASP 222.A OD1 no hydrogen 2.811 N/A VAL 212.A N VAL 221.A O no hydrogen 2.788 N/A ASN 213.A N THR 165.A O no hydrogen 3.095 N/A ASN 213.A ND2 THR 219.A O no hydrogen 3.254 N/A HIS 214.A N THR 219.A O no hydrogen 2.823 N/A SER 217.A N HIS 214.A O no hydrogen 3.270 N/A SER 217.A OG HIS 214.A O no hydrogen 3.381 N/A SER 217.A OG THR 219.A OG1 no hydrogen 2.598 N/A ASN 218.A N LYS 215.A O no hydrogen 3.030 N/A THR 219.A N HIS 214.A O no hydrogen 3.117 N/A THR 219.A OG1 SER 217.A OG no hydrogen 2.598 N/A VAL 221.A N VAL 212.A O no hydrogen 2.882 N/A LYS 223.A N CYS 210.A O no hydrogen 3.105 N/A VAL 225.A N TYR 208.A O no hydrogen 2.982 N/A SER 83A.A N ARG 66.A O no hydrogen 2.915 N/A VAL 85C.A N GLU 16.A O no hydrogen 3.183 N/A GLY 106C.A N ASP 105B.A OD1 no hydrogen 2.438 N/A ARG 107D.A N ASP 105B.A OD1 no hydrogen 2.859 N/A GLN 110G.A N GLU 101.A O no hydrogen 2.711 N/A CYS 111H.A SG GLY 113J.A O no hydrogen 3.830 N/A GLU 112I.A N PHE 99.A O no hydrogen 3.038 N/A GLY 113J.A N PHE 99.A O no hydrogen 3.221 N/A