Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uj6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N THR 4.A OG1 no hydrogen 3.359 N/A LYS 3.A NZ GLU 7.A OE2 no hydrogen 2.753 N/A LYS 3.A NZ SER 79.A OG no hydrogen 3.077 N/A PHE 5.A N SER 1.A O no hydrogen 2.869 N/A LEU 6.A N ASP 2.A O no hydrogen 2.996 N/A GLU 7.A N LYS 3.A O no hydrogen 2.882 N/A ASN 8.A N THR 4.A O no hydrogen 2.885 N/A ASN 9.A N LEU 6.A O no hydrogen 3.483 N/A ASN 9.A ND2 PHE 5.A O no hydrogen 2.662 N/A GLN 10.A NE2 TYR 19.A OH no hydrogen 3.331 N/A GLN 10.A NE2 TYR 171.A OH no hydrogen 2.901 N/A TYR 11.A N LEU 6.A O no hydrogen 2.847 N/A TYR 11.A OH HIS 122.A NE2 no hydrogen 2.849 N/A GLY 15.A N THR 12.A OG1 no hydrogen 3.052 N/A VAL 16.A N THR 12.A O no hydrogen 2.969 N/A LYS 17.A N ASP 13.A O no hydrogen 3.085 N/A VAL 18.A N GLU 14.A O no hydrogen 2.913 N/A TYR 19.A N GLY 15.A O no hydrogen 3.109 N/A GLU 20.A N VAL 16.A O no hydrogen 2.915 N/A PHE 21.A N LYS 17.A O no hydrogen 3.003 N/A ILE 22.A N VAL 18.A O no hydrogen 3.348 N/A PHE 23.A N TYR 19.A O no hydrogen 2.831 N/A GLY 24.A N GLU 20.A O no hydrogen 2.833 N/A ASN 26.A N GLU 20.A OE2 no hydrogen 2.827 N/A TYR 27.A N GLY 24.A O no hydrogen 2.911 N/A SER 30.A OG ASP 118.A OD2 no hydrogen 2.706 N/A GLY 31.A N GLU 207.A OE2 no hydrogen 2.812 N/A GLY 32.A N SER 29.A O no hydrogen 3.161 N/A ALA 35.A N GLY 31.A O no hydrogen 3.078 N/A THR 36.A N GLY 32.A O no hydrogen 3.191 N/A THR 36.A OG1 GLY 32.A O no hydrogen 3.103 N/A LYS 37.A N LEU 33.A O no hydrogen 2.949 N/A LYS 37.A NZ GLU 34.A OE2 no hydrogen 2.968 N/A LYS 38.A N GLU 34.A O no hydrogen 3.271 N/A ILE 39.A N ALA 35.A O no hydrogen 2.845 N/A LEU 40.A N THR 36.A O no hydrogen 3.040 N/A SER 41.A N LYS 38.A O no hydrogen 3.231 N/A SER 41.A OG LYS 38.A O no hydrogen 2.789 N/A ILE 43.A N LEU 40.A O no hydrogen 3.100 N/A ASN 46.A N SER 49.A OG no hydrogen 2.852 N/A GLU 47.A N GLU 47.A OE1 no hydrogen 2.687 N/A ASN 48.A N ASN 46.A OD1 no hydrogen 2.890 N/A SER 49.A N ASN 46.A O no hydrogen 3.029 N/A SER 49.A OG ASN 46.A O no hydrogen 3.195 N/A SER 49.A OG ASN 46.A OD1 no hydrogen 3.410 N/A LYS 50.A N ASP 112.A OD2 no hydrogen 2.761 N/A LYS 50.A NZ ASN 110.A OD1 no hydrogen 2.920 N/A VAL 51.A N HIS 71.A O no hydrogen 2.866 N/A LEU 52.A N LEU 113.A O no hydrogen 2.976 N/A ASP 53.A N HIS 73.A O no hydrogen 2.909 N/A ILE 54.A N TYR 115.A O no hydrogen 2.821 N/A GLY 55.A N ILE 75.A O no hydrogen 2.705 N/A SER 56.A N ILE 75.A O no hydrogen 2.985 N/A GLY 57.A N ASP 76.A OD2 no hydrogen 2.851 N/A GLY 59.A N SER 56.A O no hydrogen 3.004 N/A GLY 60.A N ASN 26.A O no hydrogen 3.061 N/A CYS 62.A SG ASP 53.A OD2 no hydrogen 3.800 N/A ILE 64.A N GLY 61.A O no hydrogen 2.918 N/A ASN 65.A N CYS 62.A O no hydrogen 2.924 N/A ASN 65.A ND2 ALA 70.A O no hydrogen 2.888 N/A LYS 67.A N TYR 63.A O no hydrogen 2.820 N/A LYS 67.A NZ TYR 68.A OH no hydrogen 2.813 N/A TYR 68.A N ILE 64.A O no hydrogen 3.016 N/A TYR 68.A OH ILE 43.A O no hydrogen 2.661 N/A GLY 69.A N ASN 65.A O no hydrogen 2.777 N/A HIS 71.A N SER 49.A O no hydrogen 3.000 N/A HIS 71.A ND1.A SER 49.A O no hydrogen 3.213 N/A THR 72.A N LYS 93.A O no hydrogen 2.737 N/A THR 72.A OG1 LYS 93.A O no hydrogen 3.432 N/A HIS 73.A N VAL 51.A O no hydrogen 2.896 N/A HIS 73.A NE2 GLU 97.A OE1 no hydrogen 2.771 N/A GLY 74.A N ILE 95.A O no hydrogen 2.708 N/A ILE 75.A N ASP 53.A O no hydrogen 2.971 N/A ASP 76.A N GLU 97.A O no hydrogen 3.049 N/A CYS 78.A N ASP 76.A OD1 no hydrogen 3.128 N/A SER 79.A N GLU 7.A OE2 no hydrogen 2.935 N/A ASN 80.A ND2 TYR 11.A O no hydrogen 2.862 N/A ASN 80.A ND2 ASP 13.A OD1 no hydrogen 2.966 N/A VAL 82.A N CYS 78.A O no hydrogen 3.128 N/A ASN 83.A N SER 79.A O no hydrogen 2.920 N/A ASN 85.A N VAL 82.A O no hydrogen 2.925 N/A ARG 87.A N ALA 84.A O no hydrogen 2.867 N/A ARG 87.A NH1 GLU 20.A OE2 no hydrogen 2.658 N/A ARG 87.A NH1 ASN 26.A OD1 no hydrogen 2.989 N/A ARG 87.A NH2 GLU 20.A OE1 no hydrogen 3.315 N/A ASN 91.A ND2 ASN 65.A OD1 no hydrogen 2.936 N/A LYS 93.A N ASN 91.A OD1 no hydrogen 2.918 N/A LYS 93.A NZ GLU 47.A O no hydrogen 2.824 N/A LYS 93.A NZ GLY 69.A O no hydrogen 2.704 N/A ILE 94.A N ASN 91.A O no hydrogen 3.469 N/A ILE 95.A N THR 72.A O no hydrogen 2.961 N/A GLU 97.A N GLY 74.A O no hydrogen 2.822 N/A ASN 99.A N ASP 76.A O no hydrogen 2.984 N/A ASN 99.A ND2 ALA 98.A O no hydrogen 3.276 N/A LEU 102.A N ASP 100.A OD1 no hydrogen 2.982 N/A THR 103.A N ASP 100.A O no hydrogen 3.080 N/A THR 103.A OG1 ASN 99.A OD1 no hydrogen 3.488 N/A THR 103.A OG1 ASP 100.A O no hydrogen 3.283 N/A LYS 104.A N ASP 100.A O no hydrogen 3.219 N/A LYS 104.A N ILE 101.A O no hydrogen 3.390 N/A LYS 104.A NZ GLU 97.A OE1 no hydrogen 3.008 N/A LYS 104.A NZ GLU 97.A OE2 no hydrogen 2.677 N/A ASN 109.A N LYS 137.A O no hydrogen 2.879 N/A ASN 110.A N TRP 138.A O no hydrogen 2.685 N/A PHE 111.A N TRP 138.A O no hydrogen 2.956 N/A ASP 112.A N LYS 50.A O no hydrogen 2.874 N/A LEU 113.A N LYS 50.A O no hydrogen 3.328 N/A ILE 114.A N THR 144.A O no hydrogen 2.947 N/A TYR 115.A N LEU 52.A O no hydrogen 2.802 N/A SER 116.A N LEU 146.A O no hydrogen 3.070 N/A SER 116.A OG ILE 54.A O no hydrogen 2.824 N/A ARG 117.A NE THR 148.A OG1 no hydrogen 2.914 N/A ARG 117.A NH1 THR 36.A OG1 no hydrogen 3.107 N/A ARG 117.A NH1 TYR 115.A OH no hydrogen 2.964 N/A ASP 118.A N THR 148.A O no hydrogen 2.766 N/A LEU 121.A N ASP 149.A OD1 no hydrogen 3.031 N/A HIS 122.A N ALA 119.A O no hydrogen 3.158 N/A HIS 122.A NE2 TYR 11.A OH no hydrogen 2.849 N/A LEU 123.A N ILE 120.A O no hydrogen 2.882 N/A ASN 127.A N SER 124.A OG no hydrogen 3.143 N/A LYS 128.A N SER 124.A O no hydrogen 2.774 N/A LYS 128.A NZ ILE 120.A O no hydrogen 2.999 N/A LYS 128.A NZ LEU 123.A O no hydrogen 2.832 N/A LYS 128.A NZ THR 172.A O no hydrogen 2.838 N/A ASN 129.A N LEU 125.A O no hydrogen 3.221 N/A ASN 129.A ND2.B LEU 125.A O no hydrogen 3.011 N/A LYS 130.A N GLU 126.A O no hydrogen 3.173 N/A LYS 130.A NZ GLU 126.A OE2 no hydrogen 3.049 N/A LEU 131.A N ASN 127.A O no hydrogen 2.877 N/A PHE 132.A N LYS 128.A O no hydrogen 3.025 N/A GLN 133.A N ASN 129.A O no hydrogen 3.101 N/A LYS 134.A N LYS 130.A O no hydrogen 3.157 N/A CYS 135.A N LEU 131.A O no hydrogen 2.816 N/A CYS 135.A SG LEU 131.A O no hydrogen 3.481 N/A TYR 136.A N PHE 132.A O no hydrogen 2.933 N/A LYS 137.A N GLN 133.A O no hydrogen 3.228 N/A TRP 138.A N LYS 134.A O no hydrogen 2.893 N/A LEU 139.A N CYS 135.A O no hydrogen 2.978 N/A LYS 140.A N PHE 111.A O no hydrogen 2.858 N/A LYS 140.A NZ ASP 112.A OD2 no hydrogen 3.367 N/A GLY 143.A N LYS 140.A O no hydrogen 2.692 N/A THR 144.A N ASP 112.A O no hydrogen 2.993 N/A LEU 145.A N ALA 252.A O no hydrogen 2.805 N/A LEU 146.A N ILE 114.A O no hydrogen 2.852 N/A ILE 147.A N PHE 250.A O no hydrogen 2.853 N/A THR 148.A N SER 116.A O no hydrogen 2.964 N/A THR 148.A OG1 ASP 118.A OD1 no hydrogen 2.963 N/A ASP 149.A N GLY 248.A O no hydrogen 2.958 N/A TYR 150.A N ASP 149.A OD1 no hydrogen 2.960 N/A CYS 151.A N ARG 246.A O no hydrogen 2.799 N/A CYS 151.A SG ASP 149.A O no hydrogen 3.852 N/A ALA 152.A N ILE 174.A O no hydrogen 2.964 N/A ASN 157.A N GLU 154.A O no hydrogen 2.909 N/A ASN 157.A ND2 THR 153.A OG1 no hydrogen 3.026 N/A TRP 158.A N LYS 155.A O no hydrogen 3.059 N/A TRP 158.A NE1 THR 153.A O no hydrogen 2.927 N/A PHE 162.A N ASP 159.A OD1 no hydrogen 3.066 N/A LYS 163.A N ASP 159.A O no hydrogen 2.923 N/A GLU 164.A N ASP 160.A O no hydrogen 3.022 N/A TYR 165.A N GLU 161.A O no hydrogen 2.994 N/A VAL 166.A N PHE 162.A O no hydrogen 2.996 N/A LYS 167.A N LYS 163.A O no hydrogen 2.930 N/A GLN 168.A N GLU 164.A O no hydrogen 2.906 N/A GLN 168.A NE2 GLU 164.A OE2 no hydrogen 2.812 N/A ARG 169.A N TYR 165.A O no hydrogen 3.328 N/A LYS 170.A N LYS 167.A O no hydrogen 3.123 N/A TYR 171.A N VAL 166.A O no hydrogen 3.134 N/A THR 172.A N LEU 121.A O no hydrogen 2.886 N/A THR 175.A N GLU 178.A OE1 no hydrogen 2.943 N/A THR 175.A OG1 GLU 177.A OE1 no hydrogen 3.473 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.742 N/A GLU 178.A N THR 175.A OG1 no hydrogen 2.998 N/A TYR 179.A N THR 175.A O no hydrogen 3.080 N/A TYR 179.A OH ASP 149.A OD2 no hydrogen 2.728 N/A ALA 180.A N VAL 176.A O no hydrogen 3.056 N/A ASP 181.A N GLU 177.A O no hydrogen 3.006 N/A ILE 182.A N GLU 178.A O no hydrogen 3.036 N/A LEU 183.A N TYR 179.A O no hydrogen 3.222 N/A THR 184.A N ALA 180.A O no hydrogen 2.983 N/A THR 184.A OG1 ALA 180.A O no hydrogen 3.181 N/A ALA 185.A N ASP 181.A O no hydrogen 2.820 N/A CYS 186.A N ILE 182.A O no hydrogen 2.918 N/A CYS 186.A N LEU 183.A O no hydrogen 3.092 N/A CYS 186.A SG ASN 129.A O no hydrogen 3.995 N/A CYS 186.A SG ASN 129.A OD1.A no hydrogen 3.504 N/A CYS 186.A SG ILE 182.A O no hydrogen 3.456 N/A ASN 187.A N THR 184.A O no hydrogen 2.887 N/A PHE 188.A N LEU 183.A O no hydrogen 3.250 N/A LYS 189.A N THR 253.A O no hydrogen 2.791 N/A LYS 189.A NZ ASN 187.A O no hydrogen 2.992 N/A LYS 189.A NZ ASN 187.A OD1 no hydrogen 2.965 N/A VAL 192.A N LYS 251.A O no hydrogen 2.780 N/A LYS 194.A N TYR 249.A O no hydrogen 2.853 N/A LEU 196.A N TRP 247.A O no hydrogen 2.798 N/A SER 197.A N ASP 195.A OD1 no hydrogen 2.999 N/A SER 197.A OG ASP 195.A OD1 no hydrogen 2.584 N/A TRP 200.A N LEU 196.A O no hydrogen 2.825 N/A TRP 200.A NE1 SER 30.A OG no hydrogen 2.968 N/A ASN 201.A N SER 197.A O no hydrogen 2.801 N/A ASN 201.A ND2 SER 241.A OG no hydrogen 2.887 N/A GLN 202.A N ASP 198.A O no hydrogen 3.049 N/A LEU 203.A N TYR 199.A O no hydrogen 2.938 N/A LEU 204.A N TRP 200.A O no hydrogen 2.888 N/A GLU 205.A N ASN 201.A O no hydrogen 3.031 N/A VAL 206.A N GLN 202.A O no hydrogen 3.180 N/A GLU 207.A N LEU 203.A O no hydrogen 2.968 N/A HIS 208.A N LEU 204.A O no hydrogen 2.821 N/A HIS 208.A NE2 ASP 231.A OD1 no hydrogen 2.645 N/A LYS 209.A N GLU 205.A O no hydrogen 2.973 N/A LYS 209.A NZ GLU 213.A OE2 no hydrogen 2.801 N/A TYR 210.A N VAL 206.A O no hydrogen 2.962 N/A LEU 211.A N GLU 207.A O no hydrogen 2.923 N/A HIS 212.A N HIS 208.A O no hydrogen 3.115 N/A HIS 212.A NE2 ASP 231.A OD1 no hydrogen 2.829 N/A GLU 213.A N LYS 209.A O no hydrogen 2.956 N/A ASN 214.A N TYR 210.A O no hydrogen 3.002 N/A ASN 214.A N LEU 211.A O no hydrogen 3.252 N/A ASN 214.A ND2 TYR 210.A O no hydrogen 2.774 N/A PHE 218.A N ASN 214.A O no hydrogen 2.943 N/A LEU 219.A N LYS 215.A O no hydrogen 2.819 N/A LYS 220.A N GLU 216.A O no hydrogen 3.117 N/A LEU 221.A N GLU 217.A O no hydrogen 3.063 N/A PHE 222.A N PHE 218.A O no hydrogen 2.850 N/A LYS 226.A N SER 223.A OG no hydrogen 3.130 N/A PHE 227.A N SER 223.A O no hydrogen 3.083 N/A ILE 228.A N GLU 224.A O no hydrogen 2.965 N/A SER 229.A N LYS 225.A O no hydrogen 3.137 N/A SER 229.A OG LYS 225.A O no hydrogen 3.209 N/A LEU 230.A N LYS 226.A O no hydrogen 3.049 N/A ASP 231.A N PHE 227.A O no hydrogen 2.839 N/A ASP 232.A N ILE 228.A O no hydrogen 2.857 N/A GLY 233.A N SER 229.A O no hydrogen 2.972 N/A TRP 234.A N LEU 230.A O no hydrogen 2.977 N/A TRP 234.A NE1 GLU 207.A OE1 no hydrogen 2.904 N/A SER 235.A N ASP 231.A O no hydrogen 2.945 N/A SER 235.A OG ASP 231.A O no hydrogen 3.131 N/A ARG 236.A N ASP 232.A O no hydrogen 3.014 N/A ARG 236.A NH1 ASP 240.A OD2 no hydrogen 2.772 N/A ARG 236.A NH1 GLN 245.A OE1 no hydrogen 2.878 N/A ARG 236.A NH2 GLN 245.A OE1 no hydrogen 2.904 N/A LYS 237.A N GLY 233.A O no hydrogen 3.133 N/A ILE 238.A N TRP 234.A O no hydrogen 2.876 N/A LYS 239.A N SER 235.A O no hydrogen 3.056 N/A ASP 240.A N ARG 236.A O no hydrogen 2.732 N/A SER 241.A N LYS 237.A O no hydrogen 2.878 N/A SER 241.A OG LYS 237.A O no hydrogen 2.884 N/A SER 241.A OG ILE 238.A O no hydrogen 3.154 N/A LYS 242.A N ILE 238.A O no hydrogen 3.131 N/A ARG 243.A N LYS 239.A O no hydrogen 3.278 N/A ARG 243.A NE ASP 240.A OD1 no hydrogen 2.927 N/A ARG 243.A NH2 ASP 159.A OD2 no hydrogen 2.836 N/A ARG 243.A NH2 ASP 240.A OD1 no hydrogen 2.709 N/A LYS 244.A N SER 241.A O no hydrogen 3.212 N/A LYS 244.A NZ ASP 198.A OD1 no hydrogen 3.505 N/A GLN 245.A NE2 TYR 165.A OH no hydrogen 3.289 N/A ARG 246.A N CYS 151.A O no hydrogen 2.899 N/A TRP 247.A N SER 197.A OG no hydrogen 3.209 N/A TRP 247.A NE1 ASP 118.A OD1 no hydrogen 2.881 N/A GLY 248.A N ASP 149.A O no hydrogen 2.958 N/A TYR 249.A N LYS 194.A O no hydrogen 2.909 N/A PHE 250.A N ILE 147.A O no hydrogen 2.878 N/A LYS 251.A N VAL 192.A O no hydrogen 2.882 N/A LYS 251.A NZ ASP 42.A OD2 no hydrogen 3.249 N/A ALA 252.A N LEU 145.A O no hydrogen 2.981 N/A THR 253.A N LYS 189.A O no hydrogen 2.914 N/A THR 253.A OG1 LYS 189.A O no hydrogen 3.451 N/A THR 253.A OG1 ASN 190.A OD1 no hydrogen 2.997 N/A THR 253.A OG1 ASN 255.A O no hydrogen 2.714 N/A LYS 254.A N GLY 143.A O no hydrogen 3.365 N/A LYS 254.A NZ ASN 109.A OD1 no hydrogen 2.961 N/A LYS 254.A NZ TYR 136.A O no hydrogen 2.855 N/A LYS 254.A NZ LEU 139.A O no hydrogen 2.770 N/A