Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mku_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N SER 2.A OG no hydrogen 3.177 N/A ARG 5.A N SER 2.A O no hydrogen 3.060 N/A ARG 5.A NE TYR 8.A O no hydrogen 2.852 N/A ARG 5.A NH1 TYR 8.A O no hydrogen 2.808 N/A ARG 5.A NH1 GLU 13.A OE1 no hydrogen 2.821 N/A ARG 5.A NH2 GLU 13.A OE1 no hydrogen 2.883 N/A ASN 7.A ND2 VAL 121.A O no hydrogen 2.960 N/A TYR 8.A OH GLN 69.A OE1 no hydrogen 2.706 N/A ASP 11.A N HIS 9.A ND1 no hydrogen 2.964 N/A GLU 13.A N HIS 9.A O no hydrogen 3.009 N/A ALA 14.A N SER 10.A O no hydrogen 2.975 N/A ALA 15.A N ASP 11.A O no hydrogen 2.942 N/A VAL 16.A N CYS 12.A O no hydrogen 2.847 N/A ASN 17.A N GLU 13.A O no hydrogen 3.189 N/A ASN 17.A ND2 ARG 75.A O no hydrogen 3.035 N/A ARG 18.A N ALA 14.A O no hydrogen 3.009 N/A MET 19.A N ALA 15.A O no hydrogen 2.852 N/A LEU 20.A N VAL 16.A O no hydrogen 2.871 N/A ASN 21.A N ASN 17.A O no hydrogen 3.124 N/A ASN 21.A ND2 ASP 80.A O no hydrogen 2.986 N/A LEU 22.A N ARG 18.A O no hydrogen 3.092 N/A GLU 23.A N MET 19.A O no hydrogen 2.927 N/A LEU 24.A N LEU 20.A O no hydrogen 3.078 N/A TYR 25.A N ASN 21.A O no hydrogen 2.828 N/A ALA 26.A N LEU 22.A O no hydrogen 2.851 N/A SER 27.A N GLU 23.A O no hydrogen 2.923 N/A SER 27.A OG SER 55.A O no hydrogen 2.885 N/A SER 27.A OG SER 55.A OG.A no hydrogen 3.081 N/A TYR 28.A N LEU 24.A O no hydrogen 3.014 N/A THR 29.A N TYR 25.A O no hydrogen 3.001 N/A THR 29.A OG1 TYR 25.A O no hydrogen 3.519 N/A TYR 30.A N ALA 26.A O no hydrogen 3.027 N/A TYR 30.A OH GLU 103.A OE2 no hydrogen 2.652 N/A SER 31.A N SER 27.A O no hydrogen 2.939 N/A SER 31.A OG.A TYR 28.A O no hydrogen 2.694 N/A SER 31.A OG.B SER 27.A O no hydrogen 3.244 N/A SER 31.A OG.B SER 55.A OG.A no hydrogen 2.699 N/A SER 32.A N TYR 28.A O no hydrogen 3.032 N/A MET 33.A N THR 29.A O no hydrogen 3.122 N/A TYR 34.A N TYR 30.A O no hydrogen 2.957 N/A ALA 35.A N SER 31.A O no hydrogen 3.067 N/A PHE 36.A N SER 32.A O no hydrogen 3.018 N/A PHE 37.A N MET 33.A O no hydrogen 3.071 N/A ASP 38.A N TYR 34.A O no hydrogen 3.160 N/A ASP 38.A N ALA 35.A O no hydrogen 3.303 N/A ARG 39.A N PHE 36.A O no hydrogen 3.096 N/A ARG 39.A NE ASP 41.A OD1.A no hydrogen 2.919 N/A ARG 39.A NE ASP 41.A OD1.B no hydrogen 2.824 N/A ARG 39.A NH2 ASP 41.A OD1.A no hydrogen 3.436 N/A ARG 39.A NH2 ASP 41.A OD1.B no hydrogen 3.309 N/A ARG 39.A NH2 ASP 41.A OD2.A no hydrogen 2.967 N/A ARG 39.A NH2 ASP 41.A OD2.B no hydrogen 2.806 N/A VAL 42.A N ARG 39.A O no hydrogen 3.002 N/A ALA 43.A N ARG 39.A O no hydrogen 2.788 N/A LEU 44.A N PHE 37.A O no hydrogen 3.114 N/A ASN 46.A ND2 ASP 167.A O no hydrogen 2.857 N/A ASN 46.A ND2 GLU 173.A OE1 no hydrogen 3.002 N/A VAL 47.A N ASP 167.A OD2 no hydrogen 3.046 N/A ALA 48.A N LEU 44.A O no hydrogen 2.909 N/A GLU 49.A N HIS 45.A O no hydrogen 2.962 N/A PHE 50.A N ASN 46.A O no hydrogen 2.907 N/A PHE 51.A N VAL 47.A O no hydrogen 3.099 N/A LYS 52.A N ALA 48.A O no hydrogen 2.928 N/A GLU 53.A N GLU 49.A O no hydrogen 2.970 N/A GLN 54.A N PHE 50.A O no hydrogen 2.967 N/A GLN 54.A NE2 ASP 140.A OD1 no hydrogen 3.371 N/A GLN 54.A NE2 ASP 140.A OD2 no hydrogen 3.014 N/A SER 55.A N PHE 51.A O no hydrogen 2.920 N/A SER 55.A OG.A SER 27.A O no hydrogen 2.781 N/A SER 55.A OG.A SER 27.A OG no hydrogen 3.081 N/A SER 55.A OG.A SER 31.A OG.B no hydrogen 2.699 N/A SER 55.A OG.B LYS 52.A O no hydrogen 2.593 N/A HIS 56.A N LYS 52.A O no hydrogen 3.033 N/A GLU 57.A N GLU 53.A O no hydrogen 2.954 N/A GLU 58.A N GLN 54.A O no hydrogen 3.114 N/A ARG 59.A N SER 55.A O no hydrogen 3.151 N/A ARG 59.A NH1.A SER 27.A OG no hydrogen 3.274 N/A GLU 60.A N HIS 56.A O no hydrogen 3.089 N/A HIS 61.A N GLU 57.A O no hydrogen 2.961 N/A HIS 61.A ND1 GLU 58.A OE1 no hydrogen 3.137 N/A ALA 62.A N GLU 58.A O no hydrogen 2.991 N/A GLU 63.A N ARG 59.A O no hydrogen 2.957 N/A LYS 64.A N GLU 60.A O no hydrogen 3.012 N/A LYS 64.A NZ.A GLU 132.A OE1 no hydrogen 2.645 N/A LYS 64.A NZ.B GLU 132.A O no hydrogen 3.550 N/A LYS 64.A NZ.B GLU 132.A OE1 no hydrogen 3.001 N/A PHE 65.A N HIS 61.A O no hydrogen 3.262 N/A MET 66.A N ALA 62.A O no hydrogen 3.074 N/A LYS 67.A N GLU 63.A O no hydrogen 3.029 N/A TYR 68.A N LYS 64.A O no hydrogen 2.950 N/A TYR 68.A OH HIS 124.A ND1 no hydrogen 2.807 N/A GLN 69.A N PHE 65.A O no hydrogen 2.897 N/A GLN 69.A NE2 GLU 13.A O no hydrogen 2.986 N/A GLN 69.A NE2 ASN 17.A OD1 no hydrogen 2.986 N/A ASN 70.A N MET 66.A O no hydrogen 3.193 N/A LYS 71.A N LYS 67.A O no hydrogen 2.917 N/A ARG 72.A N TYR 68.A O no hydrogen 3.030 N/A ARG 72.A NH1 TYR 68.A OH no hydrogen 2.877 N/A ARG 72.A NH1 ASP 122.A OD1 no hydrogen 3.018 N/A ARG 72.A NH1 ASP 122.A OD2 no hydrogen 3.047 N/A ARG 72.A NH2 GLN 6.A O no hydrogen 3.014 N/A ARG 72.A NH2 ASN 7.A O no hydrogen 2.895 N/A ARG 72.A NH2 ASP 122.A OD2 no hydrogen 3.318 N/A GLY 73.A N ASN 70.A O no hydrogen 3.117 N/A GLY 74.A N GLN 69.A O no hydrogen 2.905 N/A ARG 75.A N GLU 13.A OE2 no hydrogen 2.892 N/A VAL 77.A N ASN 17.A OD1 no hydrogen 3.199 N/A ARG 86.A NE GLU 88.A O no hydrogen 2.886 N/A ARG 86.A NH1 GLU 94.A OE2 no hydrogen 2.980 N/A ARG 86.A NH2 GLU 88.A OE2 no hydrogen 3.020 N/A ARG 86.A NH2 GLU 94.A OE2 no hydrogen 2.898 N/A TRP 89.A NE1 SER 32.A OG no hydrogen 2.876 N/A GLY 90.A N GLU 88.A OE1 no hydrogen 2.854 N/A ASN 91.A N TRP 89.A O no hydrogen 2.849 N/A THR 92.A N GLU 163.A OE2 no hydrogen 2.802 N/A THR 92.A OG1 GLU 163.A OE2 no hydrogen 2.692 N/A GLU 94.A N ASN 91.A OD1 no hydrogen 2.978 N/A ALA 95.A N ASN 91.A O no hydrogen 2.992 N/A MET 96.A N THR 92.A O no hydrogen 2.914 N/A GLN 97.A N LEU 93.A O no hydrogen 2.893 N/A ALA 98.A N GLU 94.A O no hydrogen 2.992 N/A ALA 99.A N ALA 95.A O no hydrogen 2.822 N/A LEU 100.A N MET 96.A O no hydrogen 2.860 N/A GLN 101.A N GLN 97.A O no hydrogen 3.092 N/A LEU 102.A N ALA 98.A O no hydrogen 2.882 N/A GLU 103.A N ALA 99.A O no hydrogen 2.874 N/A LYS 104.A N LEU 100.A O no hydrogen 2.963 N/A THR 105.A N GLN 101.A O no hydrogen 2.850 N/A THR 105.A OG1 GLN 101.A O no hydrogen 2.943 N/A VAL 106.A N LEU 102.A O no hydrogen 2.916 N/A ASN 107.A N GLU 103.A O no hydrogen 2.868 N/A GLN 108.A N LYS 104.A O no hydrogen 2.850 N/A GLN 108.A NE2 GLN 108.A O no hydrogen 3.341 N/A GLN 108.A NE2 ASP 112.A OD1 no hydrogen 2.930 N/A ALA 109.A N THR 105.A O no hydrogen 3.091 N/A LEU 110.A N VAL 106.A O no hydrogen 2.964 N/A LEU 111.A N ASN 107.A O no hydrogen 2.865 N/A ASP 112.A N GLN 108.A O no hydrogen 2.854 N/A LEU 113.A N ALA 109.A O no hydrogen 2.912 N/A HIS 114.A N LEU 110.A O no hydrogen 2.890 N/A HIS 114.A NE2 GLU 130.A OE2 no hydrogen 2.684 N/A LYS 115.A N LEU 111.A O no hydrogen 2.984 N/A LYS 115.A NZ.A ASP 112.A OD1 no hydrogen 2.755 N/A LEU 116.A N ASP 112.A O no hydrogen 3.051 N/A ALA 117.A N LEU 113.A O no hydrogen 2.861 N/A THR 118.A N HIS 114.A O no hydrogen 2.832 N/A THR 118.A OG1 HIS 114.A ND1 no hydrogen 3.381 N/A THR 118.A OG1 HIS 114.A O no hydrogen 2.887 N/A ASP 119.A N LYS 115.A O no hydrogen 2.879 N/A LYS 120.A N LEU 116.A O no hydrogen 2.897 N/A LYS 120.A NZ HIS 9.A NE2 no hydrogen 3.530 N/A VAL 121.A N THR 118.A O no hydrogen 3.025 N/A ASP 122.A N ALA 117.A O no hydrogen 2.885 N/A HIS 124.A ND1 TYR 68.A OH no hydrogen 2.807 N/A LEU 125.A N ASP 122.A OD1 no hydrogen 2.981 N/A CYS 126.A N ASP 122.A O no hydrogen 3.083 N/A CYS 126.A SG THR 118.A OG1 no hydrogen 3.513 N/A CYS 126.A SG ASP 122.A O no hydrogen 3.463 N/A ASP 127.A N PRO 123.A O no hydrogen 2.890 N/A PHE 128.A N HIS 124.A O no hydrogen 2.932 N/A LEU 129.A N LEU 125.A O no hydrogen 3.010 N/A GLU 130.A N CYS 126.A O no hydrogen 2.943 N/A SER 131.A N ASP 127.A O no hydrogen 2.775 N/A SER 131.A OG.A ASP 127.A O no hydrogen 2.677 N/A SER 131.A OG.A PHE 128.A O no hydrogen 3.471 N/A SER 131.A OG.B ASP 127.A O no hydrogen 2.814 N/A SER 131.A OG.B ASP 127.A OD1 no hydrogen 3.074 N/A GLU 132.A N PHE 128.A O no hydrogen 2.903 N/A TYR 133.A N LEU 129.A O no hydrogen 2.939 N/A TYR 133.A OH HIS 61.A O no hydrogen 2.835 N/A LEU 134.A N LEU 129.A O no hydrogen 2.898 N/A GLN 137.A N TYR 133.A O no hydrogen 3.213 N/A GLN 137.A NE2 GLU 103.A O no hydrogen 2.947 N/A GLN 137.A NE2 GLU 103.A OE1 no hydrogen 2.787 N/A VAL 138.A N LEU 134.A O no hydrogen 3.146 N/A LYS 139.A N GLU 135.A O no hydrogen 2.877 N/A ASP 140.A N GLU 136.A O no hydrogen 2.955 N/A ILE 141.A N GLN 137.A O no hydrogen 2.849 N/A LYS 142.A N VAL 138.A O no hydrogen 3.008 N/A LYS 142.A NZ ASP 146.A OD1 no hydrogen 2.900 N/A LYS 142.A NZ ASP 146.A OD2 no hydrogen 2.938 N/A ARG 143.A N LYS 139.A O no hydrogen 2.966 N/A ARG 143.A NE ASP 140.A OD1 no hydrogen 2.929 N/A ARG 143.A NH1 ASP 140.A OD1 no hydrogen 2.762 N/A ILE 144.A N ASP 140.A O no hydrogen 2.895 N/A GLY 145.A N ILE 141.A O no hydrogen 2.866 N/A ASP 146.A N LYS 142.A O no hydrogen 2.906 N/A PHE 147.A N ARG 143.A O no hydrogen 3.017 N/A ILE 148.A N ILE 144.A O no hydrogen 2.923 N/A THR 149.A N GLY 145.A O no hydrogen 2.984 N/A THR 149.A OG1 GLY 145.A O no hydrogen 3.291 N/A ASN 150.A N ASP 146.A O no hydrogen 3.097 N/A ASN 150.A ND2 ASP 146.A O no hydrogen 2.994 N/A LEU 151.A N PHE 147.A O no hydrogen 2.788 N/A LYS 152.A N ILE 148.A O no hydrogen 2.944 N/A ARG 153.A N THR 149.A O no hydrogen 2.988 N/A ARG 153.A NH1 ASN 150.A OD1 no hydrogen 2.889 N/A LEU 154.A N ASN 150.A O no hydrogen 2.884 N/A GLY 155.A N LYS 152.A O no hydrogen 3.007 N/A LEU 156.A N LEU 151.A O no hydrogen 3.096 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.779 N/A ASN 159.A N GLY 155.A O no hydrogen 2.932 N/A GLY 162.A N ASN 159.A OD1 no hydrogen 3.017 N/A GLU 163.A N ASN 159.A O no hydrogen 3.066 N/A TYR 164.A N GLY 160.A O no hydrogen 2.922 N/A LEU 165.A N MET 161.A O no hydrogen 2.921 N/A PHE 166.A N GLY 162.A O no hydrogen 2.972 N/A ASP 167.A N GLU 163.A O no hydrogen 3.251 N/A LYS 168.A N TYR 164.A O no hydrogen 3.206 N/A LYS 168.A NZ TYR 164.A O no hydrogen 3.092 N/A LYS 168.A NZ ASP 167.A OD1 no hydrogen 2.753 N/A HIS 169.A N LEU 165.A O no hydrogen 2.891 N/A SER 170.A N PHE 166.A O no hydrogen 2.837 N/A SER 174.A N ASN 46.A OD1 no hydrogen 2.897 N/A SER 174.A OG LYS 172.A O no hydrogen 3.499 N/A