Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4um7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A ND1 GLU 5.A OE1 no hydrogen 2.922 N/A ILE 6.A N HIS 2.A O no hydrogen 2.947 N/A TYR 7.A N MET 3.A O no hydrogen 2.799 N/A GLN 8.A N ASN 4.A O no hydrogen 2.956 N/A LYS 9.A N GLU 5.A O no hydrogen 3.314 N/A LYS 9.A NZ ASP 141.A OD1 no hydrogen 2.684 N/A ALA 10.A N ILE 6.A O no hydrogen 2.975 N/A LYS 11.A N TYR 7.A O no hydrogen 2.806 N/A ILE 13.A N ALA 10.A O no hydrogen 3.278 N/A LYS 14.A N HIS 106.A O no hydrogen 2.775 N/A LYS 14.A NZ GLY 56.A O no hydrogen 2.710 N/A LEU 15.A N HIS 106.A O no hydrogen 3.240 N/A PHE 16.A N ILE 58.A O no hydrogen 2.688 N/A ALA 17.A N ALA 108.A O no hydrogen 2.834 N/A MET 18.A N ALA 60.A O no hydrogen 2.862 N/A ASP 19.A N ILE 110.A O no hydrogen 3.025 N/A GLY 22.A N SER 25.A OG no hydrogen 3.239 N/A ILE 23.A N VAL 20.A O no hydrogen 2.970 N/A LEU 24.A N VAL 20.A O no hydrogen 2.777 N/A SER 25.A N VAL 20.A O no hydrogen 3.310 N/A GLY 27.A N SER 25.A OG no hydrogen 3.117 N/A GLN 28.A N ASP 26.A OD1 no hydrogen 3.203 N/A ASN 32.A N THR 36.A O no hydrogen 2.934 N/A GLU 34.A N ASN 32.A OD1 no hydrogen 2.914 N/A GLY 35.A N ASN 32.A O no hydrogen 3.114 N/A THR 36.A N ASN 32.A OD1 no hydrogen 3.034 N/A THR 38.A N ILE 30.A O no hydrogen 2.808 N/A LYS 39.A NZ ASP 21.A OD1 no hydrogen 2.667 N/A ASP 45.A N TYR 42.A O no hydrogen 3.058 N/A GLY 48.A N GLN 44.A O no hydrogen 3.172 N/A LEU 49.A N ASP 45.A O no hydrogen 2.990 N/A GLN 50.A N GLY 46.A O no hydrogen 2.983 N/A GLN 50.A NE2.B LEU 77.A O no hydrogen 3.534 N/A ALA 51.A N LEU 47.A O no hydrogen 2.913 N/A LEU 52.A N GLY 48.A O no hydrogen 3.157 N/A LYS 53.A N LEU 49.A O no hydrogen 3.099 N/A LYS 53.A NZ LEU 77.A O no hydrogen 2.725 N/A GLN 54.A N GLN 50.A O no hydrogen 2.898 N/A SER 55.A N ALA 51.A O no hydrogen 3.093 N/A SER 55.A N LEU 52.A O no hydrogen 3.065 N/A SER 55.A OG LEU 52.A O no hydrogen 2.622 N/A GLY 56.A N LYS 53.A O no hydrogen 2.914 N/A ILE 57.A N LEU 52.A O no hydrogen 3.084 N/A ILE 58.A N LYS 14.A O no hydrogen 2.872 N/A ALA 60.A N PHE 16.A O no hydrogen 2.930 N/A ILE 61.A N HIS 81.A O no hydrogen 2.800 N/A ILE 62.A N MET 18.A O no hydrogen 2.881 N/A THR 63.A N ILE 83.A O no hydrogen 2.827 N/A ARG 65.A N THR 63.A OG1 no hydrogen 3.223 N/A ARG 65.A NH2 TYR 31.A OH no hydrogen 2.986 N/A ARG 65.A NH2 GLU 37.A OE2 no hydrogen 3.027 N/A SER 67.A N GLN 84.A OE1 no hydrogen 2.904 N/A VAL 70.A N SER 67.A OG no hydrogen 3.280 N/A ASP 71.A N SER 67.A O no hydrogen 3.462 N/A ARG 72.A N ALA 68.A O no hydrogen 2.818 N/A ARG 73.A N MET 69.A O no hydrogen 2.978 N/A ARG 73.A NH1 GLU 76.A OE2 no hydrogen 2.931 N/A ALA 74.A N VAL 70.A O no hydrogen 2.878 N/A LYS 75.A N ASP 71.A O no hydrogen 2.935 N/A GLU 76.A N ARG 72.A O no hydrogen 3.170 N/A LEU 77.A N ARG 73.A O no hydrogen 3.283 N/A LEU 77.A N ALA 74.A O no hydrogen 3.214 N/A GLY 78.A N LYS 75.A O no hydrogen 3.334 N/A ILE 79.A N ALA 74.A O no hydrogen 2.755 N/A ILE 83.A N ILE 61.A O no hydrogen 2.833 N/A GLN 84.A NE2 SER 67.A O no hydrogen 3.128 N/A GLY 85.A N ARG 65.A O no hydrogen 2.886 N/A GLN 86.A N THR 63.A O no hydrogen 2.830 N/A LYS 89.A NZ ASP 19.A OD1 no hydrogen 2.729 N/A LYS 89.A NZ ILE 62.A O no hydrogen 3.053 N/A LYS 89.A NZ ASP 116.A OD1 no hydrogen 2.742 N/A THR 91.A N ASP 88.A OD1 no hydrogen 3.222 N/A THR 91.A OG1 ASP 88.A OD1 no hydrogen 3.085 N/A THR 91.A OG1 ASP 88.A OD2 no hydrogen 2.686 N/A ALA 92.A N ASP 88.A O no hydrogen 3.305 N/A LEU 93.A N LYS 89.A O no hydrogen 2.878 N/A VAL 94.A N LEU 90.A O no hydrogen 2.870 N/A GLY 95.A N THR 91.A O no hydrogen 2.880 N/A LEU 96.A N ALA 92.A O no hydrogen 3.005 N/A THR 97.A N LEU 93.A O no hydrogen 3.056 N/A THR 97.A OG1 VAL 94.A O no hydrogen 2.461 N/A LYS 98.A N VAL 94.A O no hydrogen 3.230 N/A LYS 99.A N GLY 95.A O no hydrogen 2.993 N/A LEU 100.A N LEU 96.A O no hydrogen 2.851 N/A ILE 102.A N THR 97.A O no hydrogen 3.135 N/A SER 105.A OG GLU 103.A OE1 no hydrogen 3.262 N/A HIS 106.A N GLU 103.A O no hydrogen 2.927 N/A CYS 107.A N LEU 104.A O no hydrogen 2.996 N/A CYS 107.A SG GLU 103.A O no hydrogen 3.473 N/A ALA 108.A N LEU 15.A O no hydrogen 2.734 N/A TYR 109.A N PHE 125.A O no hydrogen 2.970 N/A TYR 109.A OH ASP 116.A OD1 no hydrogen 2.790 N/A ILE 110.A N ALA 17.A O no hydrogen 3.128 N/A GLY 111.A N ILE 127.A O no hydrogen 3.047 N/A ASP 112.A N ASP 116.A OD2 no hydrogen 3.009 N/A ASP 113.A N ASP 116.A OD2 no hydrogen 3.097 N/A LEU 114.A N ASP 113.A OD1 no hydrogen 2.695 N/A ASP 116.A N ASP 113.A O no hydrogen 2.973 N/A LEU 117.A N LEU 114.A O no hydrogen 2.994 N/A VAL 120.A N ASP 116.A O no hydrogen 2.933 N/A ARG 121.A N LEU 117.A O no hydrogen 2.859 N/A ARG 121.A NE GLU 122.A OE2 no hydrogen 2.759 N/A ARG 121.A NH2 GLU 122.A OE2 no hydrogen 3.455 N/A GLU 122.A N LYS 118.A O no hydrogen 2.899 N/A ALA 123.A N ALA 119.A O no hydrogen 3.051 N/A GLY 124.A N LEU 104.A O no hydrogen 3.019 N/A PHE 125.A N CYS 107.A O no hydrogen 3.171 N/A GLY 126.A N ASP 141.A OD2 no hydrogen 2.779 N/A ILE 127.A N TYR 109.A O no hydrogen 2.864 N/A SER 128.A N TYR 142.A O no hydrogen 2.970 N/A SER 128.A OG GLY 111.A O no hydrogen 2.777 N/A GLY 132.A N VAL 129.A O no hydrogen 2.916 N/A CYS 133.A N ASP 112.A O no hydrogen 2.691 N/A CYS 133.A SG ASP 112.A O no hydrogen 3.913 N/A CYS 133.A SG ASP 113.A OD1 no hydrogen 3.744 N/A CYS 133.A SG GLN 135.A OE1 no hydrogen 3.691 N/A CYS 133.A SG THR 136.A OG1 no hydrogen 3.241 N/A THR 136.A OG1 ASP 113.A O no hydrogen 2.812 N/A ARG 137.A N CYS 133.A O no hydrogen 3.015 N/A ARG 137.A NE GLY 132.A O no hydrogen 2.816 N/A ARG 137.A NH2 GLY 132.A O no hydrogen 3.317 N/A ALA 138.A N GLU 134.A O.A no hydrogen 2.877 N/A ALA 138.A N GLU 134.A O.B no hydrogen 2.811 N/A VAL 139.A N THR 136.A O no hydrogen 3.339 N/A SER 140.A N ARG 137.A O no hydrogen 3.267 N/A SER 140.A OG.A ARG 137.A O no hydrogen 2.609 N/A SER 140.A OG.B THR 136.A O no hydrogen 2.626 N/A SER 140.A OG.B ARG 137.A O no hydrogen 3.542 N/A ASP 141.A N GLY 126.A O no hydrogen 2.779 N/A TYR 142.A N GLY 126.A O no hydrogen 3.253 N/A TYR 142.A OH GLU 155.A OE2 no hydrogen 2.566 N/A THR 144.A N SER 128.A O no hydrogen 3.043 N/A THR 144.A OG1 LYS 146.A O no hydrogen 2.729 N/A THR 145.A N GLU 155.A OE1 no hydrogen 3.089 N/A THR 145.A N GLU 155.A OE2 no hydrogen 2.862 N/A LYS 146.A N GLU 155.A OE1 no hydrogen 2.820 N/A GLY 149.A N ILE 23.A O no hydrogen 3.133 N/A ASN 150.A N THR 147.A O no hydrogen 2.974 N/A ASN 150.A ND2 THR 147.A OG1 no hydrogen 2.978 N/A ALA 152.A N THR 147.A O no hydrogen 3.228 N/A ARG 154.A N ASP 45.A OD1 no hydrogen 2.905 N/A ARG 154.A NE GLU 158.A OE2 no hydrogen 2.791 N/A ARG 154.A NH1 GLN 44.A O no hydrogen 3.018 N/A GLU 155.A N GLY 151.A O no hydrogen 2.860 N/A VAL 156.A N ALA 152.A O no hydrogen 3.082 N/A CYS 157.A N VAL 153.A O no hydrogen 2.908 N/A CYS 157.A SG VAL 153.A O no hydrogen 3.232 N/A GLU 158.A N ARG 154.A O no hydrogen 3.008 N/A LEU 159.A N GLU 155.A O no hydrogen 2.990 N/A ILE 160.A N VAL 156.A O no hydrogen 2.957 N/A LEU 161.A N CYS 157.A O no hydrogen 3.071 N/A LYS 162.A N GLU 158.A O no hydrogen 2.915 N/A ALA 163.A N LEU 159.A O no hydrogen 2.959 N/A GLN 164.A N ILE 160.A O no hydrogen 3.092 N/A GLN 164.A N LEU 161.A O no hydrogen 3.223 N/A GLN 164.A NE2 ALA 10.A O no hydrogen 2.976 N/A GLN 164.A NE2 ILE 13.A O no hydrogen 2.954 N/A ASN 165.A N LYS 162.A O no hydrogen 3.104 N/A ASN 166.A N LEU 161.A O no hydrogen 2.820 N/A PHE 170.A N ASN 166.A O no hydrogen 3.079 N/A ILE 171.A N PHE 167.A O no hydrogen 2.929 N/A ALA 172.A N ASP 168.A O no hydrogen 2.912 N/A THR 173.A N PHE 170.A O no hydrogen 3.177 N/A THR 173.A OG1 PHE 170.A O no hydrogen 2.574 N/A PHE 174.A N ILE 171.A O no hydrogen 2.895 N/A GLN 175.A N ALA 172.A O no hydrogen 3.083 N/A