Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7nk3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N MET 1.A O no hydrogen 3.080 N/A ARG 6.A NH1 GLU 42.A OE1 no hydrogen 3.469 N/A ARG 6.A NH1 GLU 42.A OE2 no hydrogen 2.892 N/A ARG 6.A NH2 GLU 42.A OE1 no hydrogen 2.789 N/A LEU 9.A N GLU 5.A O no hydrogen 2.985 N/A ILE 10.A N.A ARG 6.A O no hydrogen 3.053 N/A ILE 10.A N.B ARG 6.A O no hydrogen 3.079 N/A GLN 11.A N ALA 7.A O no hydrogen 2.962 N/A LYS 12.A N SER 8.A O no hydrogen 2.869 N/A ALA 13.A N LEU 9.A O no hydrogen 2.867 N/A LYS 14.A N ILE 10.A O.A no hydrogen 3.129 N/A LYS 14.A N ILE 10.A O.B no hydrogen 3.131 N/A LYS 14.A NZ GLU 41.A OE1 no hydrogen 3.302 N/A LEU 15.A N GLN 11.A O no hydrogen 3.068 N/A ALA 16.A N LYS 12.A O no hydrogen 2.806 N/A GLU 17.A N ALA 13.A O no hydrogen 2.985 N/A GLN 18.A N LYS 14.A O no hydrogen 3.157 N/A GLN 18.A NE2 LYS 14.A O no hydrogen 3.615 N/A ALA 19.A N LEU 15.A O no hydrogen 2.973 N/A GLU 20.A N GLU 17.A O no hydrogen 2.991 N/A ARG 21.A N ALA 16.A O no hydrogen 2.885 N/A ARG 21.A NE ASP 24.A OD2 no hydrogen 3.012 N/A ARG 21.A NH2 ASP 24.A OD2 no hydrogen 2.886 N/A MET 25.A N ARG 21.A O no hydrogen 2.919 N/A ALA 26.A N TYR 22.A O no hydrogen 2.883 N/A ALA 27.A N GLU 23.A O.A no hydrogen 3.023 N/A ALA 27.A N GLU 23.A O.B no hydrogen 3.029 N/A PHE 28.A N ASP 24.A O no hydrogen 2.904 N/A MET 29.A N MET 25.A O no hydrogen 2.981 N/A LYS 30.A N ALA 26.A O no hydrogen 2.826 N/A LYS 30.A NZ GLU 34.A OE2 no hydrogen 2.692 N/A GLY 31.A N ALA 27.A O no hydrogen 3.039 N/A ALA 32.A N PHE 28.A O no hydrogen 2.918 N/A VAL 33.A N MET 29.A O no hydrogen 2.891 N/A GLU 34.A N LYS 30.A O no hydrogen 2.935 N/A LYS 35.A N ALA 32.A O no hydrogen 3.114 N/A LYS 35.A NZ MET 1.A O no hydrogen 3.502 N/A LYS 35.A NZ MET 4.A O no hydrogen 2.733 N/A GLY 36.A N VAL 33.A O no hydrogen 2.972 N/A SER 40.A N GLU 42.A OE1 no hydrogen 2.901 N/A GLU 42.A N SER 40.A OG no hydrogen 3.192 N/A ARG 43.A N SER 40.A O no hydrogen 2.852 N/A ARG 43.A NH1 LEU 39.A O no hydrogen 2.929 N/A LEU 45.A N GLU 41.A O no hydrogen 2.990 N/A LEU 46.A N GLU 42.A O no hydrogen 3.003 N/A SER 47.A N ARG 43.A O no hydrogen 2.980 N/A VAL 48.A N ASN 44.A O no hydrogen 2.853 N/A ALA 49.A N LEU 45.A O no hydrogen 3.070 N/A TYR 50.A N LEU 46.A O no hydrogen 3.225 N/A LYS 51.A N SER 47.A O no hydrogen 2.851 N/A ASN 52.A N VAL 48.A O no hydrogen 3.093 N/A VAL 53.A N ALA 49.A O no hydrogen 3.086 N/A VAL 54.A N.A TYR 50.A O no hydrogen 2.910 N/A VAL 54.A N.B TYR 50.A O no hydrogen 2.914 N/A GLY 55.A N LYS 51.A O no hydrogen 2.833 N/A GLY 56.A N ASN 52.A O no hydrogen 3.091 N/A GLN 57.A N VAL 53.A O no hydrogen 3.159 N/A GLN 57.A NE2 GLU 87.A OE2.B no hydrogen 2.900 N/A ARG 58.A N VAL 54.A O.A no hydrogen 2.809 N/A ARG 58.A N VAL 54.A O.B no hydrogen 2.791 N/A ARG 58.A NE GLU 129.A OE1 no hydrogen 2.895 N/A ARG 58.A NH2 GLU 129.A OE1 no hydrogen 3.513 N/A ARG 58.A NH2 GLU 129.A OE2 no hydrogen 2.945 N/A ALA 59.A N GLY 55.A O no hydrogen 3.024 N/A ALA 60.A N GLY 56.A O no hydrogen 3.048 N/A TRP 61.A N GLN 57.A O no hydrogen 2.856 N/A TRP 61.A NE1 GLU 85.A OE1 no hydrogen 2.849 N/A ARG 62.A N ARG 58.A O no hydrogen 2.937 N/A VAL 63.A N ALA 59.A O no hydrogen 3.137 N/A LEU 64.A N ALA 60.A O no hydrogen 2.995 N/A SER 65.A N.A TRP 61.A O no hydrogen 2.768 N/A SER 65.A N.B TRP 61.A O no hydrogen 2.781 N/A SER 65.A OG.B TRP 61.A O no hydrogen 3.029 N/A SER 66.A N ARG 62.A O no hydrogen 3.022 N/A ILE 67.A N VAL 63.A O no hydrogen 3.103 N/A GLU 68.A N LEU 64.A O no hydrogen 2.893 N/A GLN 69.A N SER 65.A O.A no hydrogen 2.913 N/A GLN 69.A N SER 65.A O.B no hydrogen 2.869 N/A LYS 70.A N SER 66.A O no hydrogen 2.997 N/A SER 71.A N ILE 67.A O no hydrogen 2.975 N/A SER 71.A OG GLU 68.A O no hydrogen 2.693 N/A ASN 72.A N GLN 69.A O no hydrogen 3.084 N/A GLU 76.A N GLU 76.A OE1 no hydrogen 2.815 N/A ARG 78.A NH1 GLU 82.A OE1 no hydrogen 3.531 N/A GLU 79.A N PRO 75.A O no hydrogen 2.871 N/A TYR 80.A N GLU 76.A O no hydrogen 2.903 N/A ARG 81.A N VAL 77.A O no hydrogen 2.864 N/A ARG 81.A NE GLU 68.A OE1 no hydrogen 2.780 N/A ARG 81.A NH1 GLU 85.A OE1 no hydrogen 2.980 N/A ARG 81.A NH2 GLU 68.A OE1 no hydrogen 3.483 N/A ARG 81.A NH2 GLU 68.A OE2 no hydrogen 2.851 N/A GLU 82.A N ARG 78.A O no hydrogen 2.890 N/A LYS 83.A N GLU 79.A O no hydrogen 2.960 N/A VAL 84.A N TYR 80.A O no hydrogen 2.991 N/A GLU 85.A N ARG 81.A O no hydrogen 2.841 N/A THR 86.A N GLU 82.A O no hydrogen 2.866 N/A THR 86.A OG1 GLU 82.A O no hydrogen 2.906 N/A GLU 87.A N.A LYS 83.A O no hydrogen 3.100 N/A GLU 87.A N.B LYS 83.A O no hydrogen 3.097 N/A LEU 88.A N VAL 84.A O no hydrogen 2.908 N/A GLN 89.A N GLU 85.A O no hydrogen 2.908 N/A GLY 90.A N THR 86.A O no hydrogen 2.940 N/A VAL 91.A N GLU 87.A O.A no hydrogen 3.077 N/A VAL 91.A N GLU 87.A O.B no hydrogen 3.067 N/A CYS 92.A N LEU 88.A O no hydrogen 2.989 N/A CYS 92.A SG LEU 88.A O no hydrogen 3.497 N/A CYS 92.A SG TYR 123.A O no hydrogen 3.897 N/A ASP 93.A N GLN 89.A O no hydrogen 2.855 N/A THR 94.A N GLY 90.A O no hydrogen 2.965 N/A THR 94.A OG1 GLY 90.A O no hydrogen 3.026 N/A VAL 95.A N VAL 91.A O no hydrogen 2.999 N/A LEU 96.A N CYS 92.A O no hydrogen 2.886 N/A GLY 97.A N ASP 93.A O no hydrogen 2.857 N/A LEU 98.A N THR 94.A O no hydrogen 3.032 N/A LEU 99.A N VAL 95.A O no hydrogen 2.972 N/A ASP 100.A N LEU 96.A O no hydrogen 2.936 N/A SER 101.A N LEU 98.A O no hydrogen 3.328 N/A LEU 103.A N LEU 98.A O no hydrogen 3.346 N/A ILE 104.A N LEU 99.A O no hydrogen 2.980 N/A LYS 105.A NZ HIS 102.A ND1 no hydrogen 2.838 N/A GLU 106.A N HIS 102.A O no hydrogen 3.321 N/A ALA 107.A N ILE 104.A O no hydrogen 2.993 N/A SER 112.A OG ASP 109.A O no hydrogen 2.999 N/A ARG 113.A N ASP 109.A O no hydrogen 2.986 N/A ARG 113.A NE GLU 149.A OE2 no hydrogen 3.463 N/A ARG 113.A NH1 ALA 107.A O no hydrogen 3.308 N/A ARG 113.A NH2 GLU 149.A OE2 no hydrogen 3.296 N/A VAL 114.A N ALA 110.A O no hydrogen 2.899 N/A PHE 115.A N GLU 111.A O no hydrogen 3.168 N/A TYR 116.A N SER 112.A O no hydrogen 3.022 N/A LEU 117.A N ARG 113.A O no hydrogen 2.954 N/A LYS 118.A N VAL 114.A O no hydrogen 2.895 N/A MET 119.A N PHE 115.A O no hydrogen 3.051 N/A LYS 120.A N TYR 116.A O no hydrogen 2.894 N/A GLY 121.A N LEU 117.A O no hydrogen 2.923 N/A ASP 122.A N LYS 118.A O no hydrogen 2.923 N/A TYR 123.A N MET 119.A O no hydrogen 2.921 N/A TYR 124.A N LYS 120.A O no hydrogen 3.088 N/A ARG 125.A N GLY 121.A O no hydrogen 2.832 N/A ARG 125.A NE TYR 147.A OH no hydrogen 2.905 N/A ARG 125.A NH2 ASP 122.A OD1 no hydrogen 3.112 N/A TYR 126.A N ASP 122.A O no hydrogen 2.862 N/A LEU 127.A N TYR 123.A O no hydrogen 3.038 N/A ALA 128.A N TYR 124.A O no hydrogen 2.819 N/A GLU 129.A N ARG 125.A O no hydrogen 3.005 N/A VAL 130.A N LEU 127.A O no hydrogen 3.250 N/A ALA 131.A N ALA 128.A O no hydrogen 3.254 N/A LYS 136.A NZ ALA 128.A O no hydrogen 3.077 N/A ARG 138.A N ASP 134.A O no hydrogen 3.358 N/A ILE 139.A N ASP 135.A O no hydrogen 3.125 N/A ILE 140.A N LYS 136.A O no hydrogen 2.843 N/A ASP 141.A N LYS 137.A O no hydrogen 3.005 N/A SER 142.A N ARG 138.A O no hydrogen 2.961 N/A SER 142.A OG ARG 138.A O no hydrogen 3.277 N/A ALA 143.A N ILE 139.A O no hydrogen 3.029 N/A ARG 144.A N.A ILE 140.A O no hydrogen 2.945 N/A ARG 144.A N.B ILE 140.A O no hydrogen 2.945 N/A ARG 144.A NE.A ASP 141.A OD2 no hydrogen 2.815 N/A ARG 144.A NH2.A ASP 141.A OD1 no hydrogen 3.345 N/A ARG 144.A NH2.A ASP 141.A OD2 no hydrogen 3.298 N/A SER 145.A N ASP 141.A O no hydrogen 2.903 N/A ALA 146.A N SER 142.A O no hydrogen 3.177 N/A TYR 147.A N ALA 143.A O no hydrogen 3.002 N/A TYR 147.A OH ASP 122.A OD1 no hydrogen 2.570 N/A GLN 148.A N ARG 144.A O.A no hydrogen 2.827 N/A GLN 148.A N ARG 144.A O.B no hydrogen 2.840 N/A GLU 149.A N SER 145.A O no hydrogen 3.013 N/A ALA 150.A N ALA 146.A O no hydrogen 3.049 N/A MET 151.A N TYR 147.A O no hydrogen 2.828 N/A ASP 152.A N GLN 148.A O no hydrogen 2.920 N/A ILE 153.A N GLU 149.A O no hydrogen 3.096 N/A SER 154.A N ALA 150.A O no hydrogen 2.903 N/A SER 154.A OG ALA 150.A O no hydrogen 3.398 N/A SER 154.A OG MET 151.A O no hydrogen 3.002 N/A LYS 155.A N MET 151.A O no hydrogen 2.956 N/A LYS 156.A N ASP 152.A O no hydrogen 3.323 N/A GLU 157.A N ILE 153.A O no hydrogen 2.915 N/A MET 158.A N SER 154.A O no hydrogen 2.989 N/A THR 161.A OG1 ASP 200.A OD2 no hydrogen 2.743 N/A ASN 162.A N PRO 159.A O no hydrogen 3.011 N/A ARG 165.A N ASN 162.A OD1 no hydrogen 3.110 N/A ARG 165.A NH1 MET 158.A O no hydrogen 2.801 N/A LEU 166.A N ASN 162.A O no hydrogen 2.901 N/A GLY 167.A N PRO 163.A O no hydrogen 2.861 N/A LEU 168.A N ILE 164.A O no hydrogen 2.891 N/A ALA 169.A N ARG 165.A O no hydrogen 3.034 N/A LEU 170.A N LEU 166.A O no hydrogen 2.882 N/A ASN 171.A N GLY 167.A O no hydrogen 2.914 N/A ASN 171.A ND2 ASP 122.A OD1 no hydrogen 3.000 N/A ASN 171.A ND2 ASP 122.A OD2 no hydrogen 3.222 N/A PHE 172.A N LEU 168.A O no hydrogen 2.839 N/A SER 173.A N ALA 169.A O no hydrogen 2.871 N/A SER 173.A OG ALA 169.A O no hydrogen 3.456 N/A SER 173.A OG LEU 170.A O no hydrogen 2.624 N/A VAL 174.A N LEU 170.A O no hydrogen 3.030 N/A PHE 175.A N ASN 171.A O no hydrogen 2.911 N/A HIS 176.A N PHE 172.A O no hydrogen 2.916 N/A TYR 177.A N SER 173.A O no hydrogen 3.002 N/A GLU 178.A N VAL 174.A O no hydrogen 2.768 N/A ILE 179.A N PHE 175.A O no hydrogen 2.923 N/A ALA 180.A N PHE 175.A O no hydrogen 3.002 N/A SER 182.A N HIS 176.A O no hydrogen 2.808 N/A SER 182.A OG ALA 180.A O no hydrogen 3.177 N/A ALA 186.A N SER 182.A O no hydrogen 3.061 N/A ILE 187.A N PRO 183.A O no hydrogen 2.954 N/A SER 188.A N.A GLU 184.A O no hydrogen 2.913 N/A SER 188.A N.B GLU 184.A O no hydrogen 2.909 N/A SER 188.A OG.B GLU 184.A O no hydrogen 3.092 N/A LEU 189.A N GLU 185.A O no hydrogen 2.896 N/A ALA 190.A N ALA 186.A O no hydrogen 2.981 N/A LYS 191.A N.A ILE 187.A O no hydrogen 2.926 N/A LYS 191.A N.B ILE 187.A O no hydrogen 2.934 N/A LYS 191.A NZ.A ASP 195.A OD2 no hydrogen 2.501 N/A THR 192.A N.A SER 188.A O.A no hydrogen 2.951 N/A THR 192.A N.A SER 188.A O.B no hydrogen 2.974 N/A THR 192.A N.B SER 188.A O.A no hydrogen 2.989 N/A THR 192.A N.B SER 188.A O.B no hydrogen 3.011 N/A THR 192.A OG1.A SER 188.A O.A no hydrogen 3.279 N/A THR 192.A OG1.A SER 188.A O.B no hydrogen 3.268 N/A THR 192.A OG1.B SER 188.A O.A no hydrogen 3.015 N/A THR 192.A OG1.B SER 188.A O.B no hydrogen 3.010 N/A THR 192.A OG1.B LEU 189.A O no hydrogen 3.292 N/A THR 193.A N LEU 189.A O no hydrogen 2.943 N/A THR 193.A OG1 LEU 189.A O no hydrogen 2.701 N/A PHE 194.A N ALA 190.A O no hydrogen 2.954 N/A ASP 195.A N LYS 191.A O.A no hydrogen 2.932 N/A ASP 195.A N LYS 191.A O.B no hydrogen 2.899 N/A GLU 196.A N THR 192.A O.A no hydrogen 2.970 N/A GLU 196.A N THR 192.A O.B no hydrogen 2.961 N/A ALA 197.A N THR 193.A O no hydrogen 3.001 N/A MET 198.A N PHE 194.A O no hydrogen 2.884 N/A ALA 199.A N ASP 195.A O no hydrogen 3.206 N/A ASP 200.A N ALA 197.A O no hydrogen 2.933 N/A LEU 201.A N MET 198.A O no hydrogen 3.304 N/A THR 203.A N ASP 200.A O no hydrogen 3.148 N/A THR 203.A OG1 ASP 200.A O no hydrogen 2.750 N/A LEU 204.A N LEU 201.A O no hydrogen 3.100 N/A SER 205.A OG SER 208.A OG no hydrogen 3.360 N/A SER 208.A N SER 205.A OG no hydrogen 3.286 N/A SER 208.A OG SER 205.A OG no hydrogen 3.360 N/A TYR 209.A N SER 205.A O no hydrogen 2.800 N/A LYS 210.A N GLU 206.A O no hydrogen 3.048 N/A ASP 211.A N ASP 207.A O no hydrogen 3.177 N/A SER 212.A N SER 208.A O no hydrogen 2.924 N/A SER 212.A OG THR 161.A O no hydrogen 2.711 N/A SER 212.A OG SER 208.A O no hydrogen 3.312 N/A THR 213.A N TYR 209.A O no hydrogen 2.901 N/A THR 213.A OG1 TYR 209.A O no hydrogen 2.764 N/A THR 213.A OG1 LYS 210.A O no hydrogen 3.289 N/A LEU 214.A N LYS 210.A O no hydrogen 3.028 N/A ILE 215.A N ASP 211.A O no hydrogen 3.470 N/A MET 216.A N SER 212.A O no hydrogen 2.975 N/A GLN 217.A N THR 213.A O no hydrogen 2.973 N/A GLN 217.A NE2 ASP 221.A OD1 no hydrogen 2.855 N/A LEU 218.A N LEU 214.A O no hydrogen 3.354 N/A LEU 219.A N ILE 215.A O no hydrogen 3.078 N/A ARG 220.A N MET 216.A O no hydrogen 2.926 N/A ASP 221.A N GLN 217.A O no hydrogen 2.772 N/A ASN 222.A N LEU 218.A O no hydrogen 3.123 N/A LEU 223.A N LEU 219.A O no hydrogen 2.945 N/A THR 224.A N ARG 220.A O no hydrogen 2.855 N/A THR 224.A OG1 ARG 220.A O no hydrogen 3.092 N/A LEU 225.A N ASP 221.A O no hydrogen 3.066 N/A TRP 226.A N ASN 222.A O no hydrogen 2.877 N/A TRP 226.A N LEU 223.A O no hydrogen 3.195 N/A THR 227.A OG1 LEU 223.A O no hydrogen 2.627 N/A