Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mwz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A NE2 TYR 16.A OH no hydrogen 3.166 N/A GLN 7.A NE2 TYR 170.A OH no hydrogen 2.930 N/A TYR 8.A OH HIS 121.A NE2 no hydrogen 2.768 N/A SER 9.A N ASN 6.A O no hydrogen 3.009 N/A SER 9.A OG ASN 6.A O no hydrogen 3.395 N/A SER 9.A OG GLU 11.A OE1 no hydrogen 3.368 N/A GLY 12.A N SER 9.A OG no hydrogen 2.964 N/A ILE 13.A N SER 9.A O no hydrogen 2.969 N/A ALA 15.A N GLU 11.A O no hydrogen 2.899 N/A TYR 16.A N GLY 12.A O no hydrogen 2.921 N/A GLU 17.A N ILE 13.A O no hydrogen 3.092 N/A PHE 18.A N LYS 14.A O no hydrogen 3.008 N/A ILE 19.A N ALA 15.A O no hydrogen 3.054 N/A PHE 20.A N TYR 16.A O no hydrogen 2.804 N/A GLY 21.A N GLU 17.A O no hydrogen 2.796 N/A ASP 23.A N GLU 17.A OE2 no hydrogen 2.760 N/A TYR 24.A N GLY 21.A O no hydrogen 3.083 N/A SER 27.A OG ASP 117.A OD2 no hydrogen 2.732 N/A GLY 28.A N GLU 206.A OE2 no hydrogen 2.731 N/A GLY 29.A N SER 26.A O no hydrogen 3.186 N/A ALA 32.A N GLY 28.A O no hydrogen 2.988 N/A THR 33.A N GLY 29.A O no hydrogen 3.201 N/A THR 33.A OG1 GLY 29.A O no hydrogen 2.877 N/A THR 34.A N ILE 30.A O no hydrogen 2.919 N/A THR 34.A OG1 ILE 30.A O no hydrogen 2.853 N/A LYS 35.A N ILE 31.A O no hydrogen 3.190 N/A ILE 36.A N ALA 32.A O no hydrogen 2.759 N/A LEU 37.A N THR 33.A O no hydrogen 3.045 N/A SER 38.A N LYS 35.A O no hydrogen 3.141 N/A SER 38.A OG LYS 35.A O no hydrogen 2.715 N/A ILE 40.A N LEU 37.A O no hydrogen 3.120 N/A GLN 41.A NE2 ASP 39.A O no hydrogen 2.989 N/A ASP 43.A N SER 46.A OG no hydrogen 2.843 N/A ASN 45.A N ASP 43.A OD1 no hydrogen 2.896 N/A SER 46.A N ASP 43.A O no hydrogen 3.024 N/A SER 46.A OG ASP 43.A O no hydrogen 3.277 N/A SER 46.A OG ASP 43.A OD1 no hydrogen 3.359 N/A LYS 47.A N ASP 111.A OD2 no hydrogen 2.813 N/A LYS 47.A NZ ASN 45.A O no hydrogen 2.938 N/A VAL 48.A N HIS 69.A O no hydrogen 2.863 N/A LEU 49.A N MET 112.A O no hydrogen 3.005 N/A ASP 50.A N HIS 71.A O no hydrogen 2.888 N/A ILE 51.A N TYR 114.A O no hydrogen 2.847 N/A GLY 52.A N VAL 73.A O no hydrogen 2.771 N/A SER 53.A N VAL 73.A O no hydrogen 3.060 N/A GLY 54.A N ASP 74.A OD2 no hydrogen 2.822 N/A GLY 56.A N SER 53.A O no hydrogen 2.994 N/A GLY 57.A N ASP 23.A O no hydrogen 3.072 N/A CYS 59.A SG ASP 50.A OD2 no hydrogen 3.714 N/A LYS 60.A N GLY 56.A O no hydrogen 2.895 N/A LYS 60.A NZ ASP 23.A OD2 no hydrogen 2.970 N/A TYR 61.A N GLY 57.A O no hydrogen 2.858 N/A ILE 62.A N GLY 58.A O no hydrogen 2.899 N/A ASN 63.A N CYS 59.A O no hydrogen 2.985 N/A ASN 63.A ND2 ALA 68.A O no hydrogen 2.851 N/A GLU 64.A N LYS 60.A O no hydrogen 2.897 N/A LYS 65.A N TYR 61.A O no hydrogen 2.828 N/A LYS 65.A NZ LEU 37.A O no hydrogen 2.869 N/A LYS 65.A NZ TYR 66.A OH no hydrogen 2.945 N/A TYR 66.A N ILE 62.A O no hydrogen 3.001 N/A TYR 66.A OH ILE 40.A O no hydrogen 2.752 N/A GLY 67.A N ASN 63.A O no hydrogen 2.818 N/A HIS 69.A N SER 46.A O no hydrogen 2.955 N/A VAL 70.A N LYS 92.A O no hydrogen 2.949 N/A HIS 71.A N VAL 48.A O no hydrogen 2.826 N/A HIS 71.A NE2 GLU 96.A OE1 no hydrogen 2.773 N/A GLY 72.A N GLU 94.A O no hydrogen 2.841 N/A VAL 73.A N ASP 50.A O no hydrogen 2.963 N/A ASP 74.A N GLU 96.A O no hydrogen 3.072 N/A CYS 76.A N ASP 74.A OD1 no hydrogen 2.887 N/A LYS 78.A NZ ASP 10.A OD1 no hydrogen 2.539 N/A MET 79.A N.B CYS 76.A O no hydrogen 3.085 N/A VAL 80.A N CYS 76.A O no hydrogen 3.110 N/A THR 81.A N GLU 77.A O no hydrogen 2.810 N/A THR 81.A OG1 GLU 77.A O no hydrogen 3.034 N/A ILE 82.A N LYS 78.A O no hydrogen 3.130 N/A ALA 83.A N MET 79.A O.A no hydrogen 2.802 N/A ALA 83.A N MET 79.A O.B no hydrogen 2.794 N/A LYS 84.A N VAL 80.A O no hydrogen 2.910 N/A LEU 85.A N THR 81.A O no hydrogen 3.012 N/A ARG 86.A N ILE 82.A O no hydrogen 2.963 N/A ARG 86.A NH1 GLU 17.A OE2 no hydrogen 2.747 N/A ARG 86.A NH1 ASP 23.A OD1 no hydrogen 2.993 N/A ARG 86.A NH2 GLU 17.A OE1 no hydrogen 3.033 N/A ARG 86.A NH2 GLU 17.A OE2 no hydrogen 3.416 N/A ASN 87.A N LYS 84.A O no hydrogen 3.201 N/A ASN 87.A ND2 ALA 83.A O no hydrogen 2.844 N/A GLN 88.A NE2 LEU 85.A O no hydrogen 3.070 N/A LYS 90.A N ASN 87.A O no hydrogen 2.976 N/A LYS 92.A NZ ALA 44.A O no hydrogen 2.781 N/A LYS 92.A NZ GLY 67.A O no hydrogen 2.686 N/A ILE 93.A N LYS 90.A O no hydrogen 3.158 N/A GLU 94.A N VAL 70.A O no hydrogen 2.930 N/A GLU 96.A N GLY 72.A O no hydrogen 2.907 N/A LYS 98.A N ASP 74.A O no hydrogen 2.992 N/A LYS 98.A NZ LYS 102.A O no hydrogen 3.363 N/A LEU 101.A N ASP 99.A OD1 no hydrogen 2.936 N/A LYS 102.A N ASP 99.A O no hydrogen 2.860 N/A LYS 102.A NZ ASP 99.A OD2 no hydrogen 3.300 N/A LYS 103.A N ILE 100.A O no hydrogen 3.071 N/A LYS 103.A NZ GLU 96.A OE1 no hydrogen 3.158 N/A LYS 103.A NZ GLU 96.A OE2 no hydrogen 2.675 N/A SER 108.A N LYS 136.A O no hydrogen 3.114 N/A SER 108.A OG GLU 107.A OE2 no hydrogen 2.734 N/A THR 109.A N TRP 137.A O no hydrogen 2.781 N/A THR 109.A OG1 PRO 106.A O no hydrogen 2.644 N/A PHE 110.A N TRP 137.A O no hydrogen 3.013 N/A ASP 111.A N LYS 47.A O no hydrogen 2.796 N/A MET 112.A N LYS 47.A O no hydrogen 3.374 N/A ILE 113.A N ILE 143.A O no hydrogen 2.853 N/A TYR 114.A N LEU 49.A O no hydrogen 2.807 N/A SER 115.A N LEU 145.A O no hydrogen 2.957 N/A SER 115.A OG ILE 51.A O no hydrogen 2.855 N/A ARG 116.A NE THR 147.A OG1 no hydrogen 2.862 N/A ARG 116.A NH1 THR 33.A OG1 no hydrogen 3.054 N/A ARG 116.A NH1 TYR 114.A OH no hydrogen 2.902 N/A ASP 117.A N THR 147.A O no hydrogen 2.807 N/A SER 118.A OG ILE 51.A O no hydrogen 3.522 N/A SER 118.A OG GLY 52.A O no hydrogen 3.506 N/A SER 118.A OG ARG 116.A O no hydrogen 3.028 N/A LEU 120.A N ASP 148.A OD1 no hydrogen 3.075 N/A HIS 121.A N SER 118.A O no hydrogen 3.198 N/A HIS 121.A NE2 TYR 8.A OH no hydrogen 2.768 N/A LEU 122.A N ILE 119.A O no hydrogen 2.938 N/A ASP 126.A N SER 123.A OG no hydrogen 3.029 N/A LYS 127.A N SER 123.A O no hydrogen 2.776 N/A LYS 127.A NZ ILE 119.A O no hydrogen 3.382 N/A LYS 127.A NZ LEU 122.A O no hydrogen 2.645 N/A LYS 127.A NZ THR 171.A O no hydrogen 2.804 N/A LYS 128.A N TYR 124.A O no hydrogen 3.026 N/A LYS 128.A NZ GLU 132.A OE2 no hydrogen 2.847 N/A MET 129.A N ALA 125.A O no hydrogen 3.050 N/A LEU 130.A N ASP 126.A O no hydrogen 2.862 N/A PHE 131.A N LYS 127.A O no hydrogen 2.888 N/A GLU 132.A N LYS 128.A O no hydrogen 2.986 N/A LYS 133.A N MET 129.A O no hydrogen 3.041 N/A CYS 134.A N LEU 130.A O no hydrogen 2.768 N/A CYS 134.A SG LEU 130.A O no hydrogen 3.339 N/A TYR 135.A N PHE 131.A O no hydrogen 2.946 N/A LYS 136.A N GLU 132.A O no hydrogen 3.284 N/A TRP 137.A N LYS 133.A O no hydrogen 2.876 N/A LEU 138.A N CYS 134.A O no hydrogen 3.035 N/A LYS 139.A N PHE 110.A O no hydrogen 2.833 N/A LYS 139.A NZ ASP 111.A OD1 no hydrogen 3.553 N/A LYS 139.A NZ ASP 111.A OD2 no hydrogen 3.020 N/A ASN 141.A N LYS 254.A O no hydrogen 2.693 N/A GLY 142.A N LYS 139.A O no hydrogen 2.811 N/A ILE 143.A N ASP 111.A O no hydrogen 3.007 N/A LEU 144.A N ALA 252.A O no hydrogen 2.844 N/A LEU 145.A N ILE 113.A O no hydrogen 2.837 N/A ILE 146.A N PHE 250.A O no hydrogen 2.809 N/A THR 147.A N SER 115.A O no hydrogen 3.008 N/A THR 147.A OG1 ASP 117.A OD1 no hydrogen 2.956 N/A ASP 148.A N GLY 248.A O no hydrogen 3.040 N/A CYS 150.A N LYS 246.A O no hydrogen 2.853 N/A CYS 150.A SG ASP 148.A O no hydrogen 3.965 N/A ALA 151.A N MET 173.A O no hydrogen 3.091 N/A ASP 152.A N LEU 244.A O no hydrogen 2.923 N/A LYS 153.A N ASP 152.A OD1 no hydrogen 2.488 N/A GLU 155.A N GLU 155.A OE2 no hydrogen 2.781 N/A ASN 156.A N LYS 153.A O no hydrogen 2.938 N/A ASN 156.A ND2 ASP 152.A OD2 no hydrogen 2.838 N/A TRP 157.A N ILE 154.A O no hydrogen 2.953 N/A TRP 157.A NE1 ASP 152.A O no hydrogen 2.925 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.647 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.995 N/A PHE 161.A N ASP 158.A OD1 no hydrogen 3.108 N/A LYS 162.A N ASP 158.A O no hydrogen 3.012 N/A ALA 163.A N GLU 159.A O no hydrogen 3.021 N/A TYR 164.A N GLU 160.A O no hydrogen 3.009 N/A ILE 165.A N PHE 161.A O no hydrogen 2.949 N/A LYS 166.A N LYS 162.A O no hydrogen 3.021 N/A LYS 167.A N ALA 163.A O no hydrogen 2.947 N/A ARG 168.A N TYR 164.A O no hydrogen 2.969 N/A LYS 169.A N LYS 166.A O no hydrogen 3.182 N/A TYR 170.A N ILE 165.A O no hydrogen 3.223 N/A THR 171.A N LEU 120.A O no hydrogen 2.937 N/A GLN 176.A NE2.A ALA 192.A O no hydrogen 2.990 N/A TYR 178.A N PRO 174.A O no hydrogen 3.109 N/A TYR 178.A OH ASP 148.A OD2 no hydrogen 2.750 N/A GLY 179.A N ILE 175.A O no hydrogen 2.917 N/A ASP 180.A N GLN 176.A O.A no hydrogen 2.875 N/A ASP 180.A N GLN 176.A O.B no hydrogen 2.831 N/A LEU 181.A N GLU 177.A O no hydrogen 2.999 N/A ILE 182.A N TYR 178.A O no hydrogen 3.060 N/A LYS 183.A N GLY 179.A O no hydrogen 2.851 N/A SER 184.A N ASP 180.A O no hydrogen 2.854 N/A SER 184.A OG LEU 181.A O no hydrogen 2.708 N/A CYS 185.A N ILE 182.A O no hydrogen 3.096 N/A CYS 185.A SG LYS 128.A O no hydrogen 4.036 N/A CYS 185.A SG LEU 181.A O no hydrogen 3.469 N/A LYS 186.A N LYS 183.A O no hydrogen 2.904 N/A GLN 188.A N GLN 253.A O no hydrogen 2.841 N/A ASN 189.A ND2 GLN 253.A OE1 no hydrogen 2.960 N/A GLU 191.A N LYS 251.A O no hydrogen 2.774 N/A LYS 193.A N TYR 249.A O no hydrogen 2.809 N/A ILE 195.A N TRP 247.A O no hydrogen 2.916 N/A SER 196.A N ASP 194.A OD1 no hydrogen 2.920 N/A SER 196.A OG ASP 194.A OD1 no hydrogen 2.597 N/A TRP 199.A N ILE 195.A O no hydrogen 2.996 N/A TRP 199.A NE1 SER 27.A OG no hydrogen 2.917 N/A LEU 200.A N SER 196.A O no hydrogen 2.834 N/A GLU 201.A N ASP 197.A O no hydrogen 3.198 N/A LEU 202.A N TYR 198.A O no hydrogen 3.027 N/A LEU 203.A N TRP 199.A O no hydrogen 2.793 N/A GLN 204.A N LEU 200.A O no hydrogen 2.905 N/A LEU 205.A N GLU 201.A O no hydrogen 2.993 N/A GLU 206.A N LEU 202.A O no hydrogen 2.831 N/A LEU 207.A N LEU 203.A O no hydrogen 2.940 N/A SER 208.A N GLN 204.A O no hydrogen 2.930 N/A SER 208.A OG GLN 204.A O no hydrogen 3.446 N/A SER 208.A OG LEU 205.A O no hydrogen 2.842 N/A LYS 209.A N LEU 205.A O no hydrogen 2.991 N/A LYS 209.A NZ GLU 212.A OE1 no hydrogen 2.921 N/A LEU 210.A N GLU 206.A O no hydrogen 3.012 N/A GLU 211.A N LEU 207.A O no hydrogen 2.928 N/A GLU 212.A N SER 208.A O no hydrogen 3.036 N/A LYS 213.A N LYS 209.A O no hydrogen 3.102 N/A LYS 213.A N LEU 210.A O no hydrogen 3.041 N/A LYS 214.A N GLU 211.A O no hydrogen 3.306 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 2.665 N/A PHE 217.A N LYS 213.A O no hydrogen 2.870 N/A LEU 218.A N LYS 214.A O no hydrogen 2.944 N/A LYS 219.A N GLU 216.A O no hydrogen 3.245 N/A VAL 220.A N PHE 217.A O no hydrogen 3.123 N/A TYR 221.A N PHE 217.A O no hydrogen 2.859 N/A LYS 224.A N SER 222.A OG.A no hydrogen 2.910 N/A TYR 226.A N SER 222.A O.A no hydrogen 2.792 N/A TYR 226.A N SER 222.A O.B no hydrogen 2.765 N/A ASN 227.A N ILE 223.A O no hydrogen 2.766 N/A SER 228.A N LYS 224.A O no hydrogen 2.843 N/A LEU 229.A N GLU 225.A O no hydrogen 2.965 N/A LYS 230.A N TYR 226.A O no hydrogen 2.892 N/A ASP 231.A N ASN 227.A O no hydrogen 2.835 N/A GLY 232.A N SER 228.A O no hydrogen 3.005 N/A TRP 233.A N LEU 229.A O no hydrogen 2.934 N/A TRP 233.A NE1 GLU 206.A OE1 no hydrogen 2.836 N/A THR 234.A N LYS 230.A O no hydrogen 2.891 N/A THR 234.A OG1 LYS 230.A O no hydrogen 2.934 N/A ARG 235.A N ASP 231.A O no hydrogen 2.952 N/A ARG 235.A NH1 ASP 239.A OD2 no hydrogen 2.828 N/A ARG 235.A NH1 GLN 245.A OE1 no hydrogen 2.952 N/A ARG 235.A NH2 GLN 245.A OE1 no hydrogen 2.945 N/A LYS 236.A N GLY 232.A O no hydrogen 3.075 N/A ILE 237.A N TRP 233.A O no hydrogen 2.930 N/A LYS 238.A N THR 234.A O no hydrogen 3.058 N/A LYS 238.A NZ ASP 239.A OD1 no hydrogen 2.883 N/A ASP 239.A N ARG 235.A O no hydrogen 2.770 N/A THR 240.A N LYS 236.A O no hydrogen 2.856 N/A THR 240.A OG1 GLN 245.A O no hydrogen 2.954 N/A LYS 241.A N ILE 237.A O no hydrogen 3.170 N/A ARG 242.A N LYS 238.A O no hydrogen 3.328 N/A ARG 242.A NE ASP 239.A OD1 no hydrogen 2.823 N/A ARG 242.A NH1 ASP 158.A OD2 no hydrogen 3.562 N/A ARG 242.A NH2 ASP 158.A OD2 no hydrogen 2.621 N/A ARG 242.A NH2 ASP 239.A OD1 no hydrogen 2.667 N/A ASP 243.A N THR 240.A O no hydrogen 3.094 N/A LEU 244.A N ASP 239.A O no hydrogen 2.828 N/A GLN 245.A N ASP 239.A O no hydrogen 3.143 N/A GLN 245.A NE2 TYR 164.A OH no hydrogen 3.173 N/A LYS 246.A N CYS 150.A O no hydrogen 2.873 N/A TRP 247.A N SER 196.A OG no hydrogen 2.930 N/A TRP 247.A NE1 ASP 117.A OD1 no hydrogen 2.868 N/A GLY 248.A N ASP 148.A O no hydrogen 2.848 N/A TYR 249.A N LYS 193.A O no hydrogen 2.880 N/A PHE 250.A N ILE 146.A O no hydrogen 2.846 N/A LYS 251.A N GLU 191.A O no hydrogen 2.992 N/A LYS 251.A NZ ASP 39.A OD2 no hydrogen 3.508 N/A ALA 252.A N LEU 144.A O no hydrogen 2.878 N/A GLN 253.A N GLN 188.A O no hydrogen 2.860 N/A GLN 253.A NE2 ASN 141.A O no hydrogen 2.917 N/A LYS 254.A N GLY 142.A O no hydrogen 3.053 N/A LYS 254.A NZ GLU 107.A OE2 no hydrogen 2.646 N/A LYS 254.A NZ TYR 135.A O no hydrogen 2.852 N/A LYS 254.A NZ LEU 138.A O no hydrogen 2.814 N/A