Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ujb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ GLU 5.A OE1 no hydrogen 3.457 N/A LYS 1.A NZ GLU 5.A OE2 no hydrogen 2.683 N/A LYS 1.A NZ SER 78.A OG.B no hydrogen 3.120 N/A GLU 5.A N LYS 1.A O no hydrogen 2.951 N/A ASN 6.A N THR 2.A O no hydrogen 2.996 N/A ASN 7.A N LEU 4.A O no hydrogen 3.415 N/A ASN 7.A ND2 PHE 3.A O no hydrogen 2.874 N/A GLN 8.A NE2 TYR 17.A OH no hydrogen 3.123 N/A GLN 8.A NE2 TYR 171.A OH no hydrogen 3.001 N/A TYR 9.A N LEU 4.A O no hydrogen 2.849 N/A TYR 9.A OH HIS 122.A NE2 no hydrogen 2.843 N/A GLY 13.A N THR 10.A OG1 no hydrogen 2.985 N/A VAL 14.A N THR 10.A O no hydrogen 2.885 N/A LYS 15.A N ASP 11.A O no hydrogen 3.019 N/A VAL 16.A N GLU 12.A O no hydrogen 2.822 N/A TYR 17.A N GLY 13.A O no hydrogen 3.059 N/A GLU 18.A N VAL 14.A O no hydrogen 2.893 N/A PHE 19.A N LYS 15.A O no hydrogen 3.005 N/A ILE 20.A N VAL 16.A O no hydrogen 3.399 N/A PHE 21.A N TYR 17.A O no hydrogen 2.855 N/A GLY 22.A N GLU 18.A O no hydrogen 2.853 N/A ASN 24.A N GLU 18.A OE2 no hydrogen 2.854 N/A TYR 25.A N GLY 22.A O no hydrogen 2.972 N/A SER 28.A OG ASP 118.A OD2 no hydrogen 2.714 N/A GLY 29.A N GLU 207.A OE2 no hydrogen 2.829 N/A GLY 30.A N SER 27.A O no hydrogen 3.233 N/A ALA 33.A N GLY 29.A O no hydrogen 3.130 N/A THR 34.A N GLY 30.A O no hydrogen 3.167 N/A THR 34.A OG1 GLY 30.A O no hydrogen 3.031 N/A LYS 35.A N LEU 31.A O no hydrogen 2.932 N/A LYS 35.A NZ GLU 32.A OE2 no hydrogen 3.372 N/A LYS 36.A N GLU 32.A O no hydrogen 3.235 N/A ILE 37.A N ALA 33.A O no hydrogen 2.825 N/A LEU 38.A N THR 34.A O no hydrogen 3.074 N/A SER 39.A N LYS 36.A O no hydrogen 3.150 N/A SER 39.A OG LYS 36.A O no hydrogen 2.784 N/A ILE 41.A N LEU 38.A O no hydrogen 3.151 N/A ASN 44.A N SER 47.A OG no hydrogen 2.863 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.637 N/A ASN 46.A N ASN 44.A OD1 no hydrogen 2.949 N/A SER 47.A N ASN 44.A O no hydrogen 3.015 N/A SER 47.A OG ASN 44.A O no hydrogen 3.308 N/A SER 47.A OG ASN 44.A OD1 no hydrogen 3.494 N/A LYS 48.A N ASP 112.A OD2 no hydrogen 2.747 N/A LYS 48.A NZ ASN 110.A OD1 no hydrogen 2.897 N/A VAL 49.A N HIS 70.A O no hydrogen 2.853 N/A LEU 50.A N LEU 113.A O no hydrogen 2.951 N/A ASP 51.A N HIS 72.A O no hydrogen 2.899 N/A ILE 52.A N TYR 115.A O no hydrogen 2.857 N/A GLY 53.A N ILE 74.A O no hydrogen 2.756 N/A SER 54.A N ILE 74.A O no hydrogen 3.022 N/A GLY 55.A N ASP 75.A OD2 no hydrogen 2.857 N/A GLY 57.A N SER 54.A O no hydrogen 3.050 N/A GLY 58.A N ASN 24.A O no hydrogen 3.054 N/A CYS 60.A SG ASP 51.A OD2 no hydrogen 3.841 N/A MET 61.A N GLY 57.A O no hydrogen 2.899 N/A TYR 62.A N GLY 58.A O no hydrogen 2.909 N/A ILE 63.A N GLY 59.A O no hydrogen 2.898 N/A ASN 64.A N CYS 60.A O no hydrogen 2.931 N/A ASN 64.A ND2 ALA 69.A O no hydrogen 2.991 N/A GLU 65.A N MET 61.A O no hydrogen 2.952 N/A LYS 66.A N TYR 62.A O no hydrogen 2.796 N/A LYS 66.A NZ TYR 67.A OH no hydrogen 2.888 N/A TYR 67.A N ILE 63.A O no hydrogen 3.002 N/A TYR 67.A OH ILE 41.A O no hydrogen 2.672 N/A GLY 68.A N ASN 64.A O no hydrogen 2.853 N/A HIS 70.A N SER 47.A O no hydrogen 2.939 N/A HIS 70.A ND1 SER 47.A O no hydrogen 3.261 N/A THR 71.A N LYS 93.A O no hydrogen 2.806 N/A THR 71.A OG1 LYS 93.A O no hydrogen 3.269 N/A HIS 72.A N VAL 49.A O no hydrogen 2.930 N/A HIS 72.A NE2 GLU 97.A OE1 no hydrogen 2.807 N/A GLY 73.A N ILE 95.A O no hydrogen 2.794 N/A ILE 74.A N ASP 51.A O no hydrogen 2.983 N/A ASP 75.A N GLU 97.A O no hydrogen 3.018 N/A CYS 77.A N ASP 75.A OD1 no hydrogen 3.011 N/A SER 78.A N GLU 5.A OE2 no hydrogen 2.953 N/A SER 78.A OG.A GLU 5.A OE2 no hydrogen 3.085 N/A ASN 79.A ND2 TYR 9.A O no hydrogen 2.950 N/A ASN 79.A ND2 ASP 11.A OD1 no hydrogen 2.934 N/A VAL 81.A N CYS 77.A O no hydrogen 3.081 N/A ASN 82.A N SER 78.A O no hydrogen 2.936 N/A MET 83.A N ASN 79.A O no hydrogen 3.178 N/A ALA 84.A N ILE 80.A O no hydrogen 2.875 N/A ASN 85.A N VAL 81.A O no hydrogen 2.908 N/A GLU 86.A N ASN 82.A O no hydrogen 3.214 N/A GLU 86.A N MET 83.A O no hydrogen 3.100 N/A ARG 87.A N ALA 84.A O no hydrogen 3.147 N/A ARG 87.A NE MET 83.A O no hydrogen 3.149 N/A ARG 87.A NH1 GLU 18.A OE2 no hydrogen 2.694 N/A ARG 87.A NH1 ASN 24.A OD1 no hydrogen 3.006 N/A ASN 91.A ND2 ASN 64.A OD1 no hydrogen 2.917 N/A LYS 93.A N ASN 91.A OD1 no hydrogen 2.934 N/A LYS 93.A NZ GLU 45.A O no hydrogen 2.864 N/A LYS 93.A NZ GLY 68.A O no hydrogen 2.804 N/A ILE 94.A N ASN 91.A O no hydrogen 3.380 N/A ILE 95.A N THR 71.A O no hydrogen 3.043 N/A GLU 97.A N GLY 73.A O no hydrogen 2.889 N/A ASN 99.A N ASP 75.A O no hydrogen 2.969 N/A ASN 99.A ND2 GLU 97.A OE2 no hydrogen 2.671 N/A LEU 102.A N ASP 100.A OD1 no hydrogen 3.013 N/A THR 103.A N ASP 100.A O no hydrogen 3.165 N/A THR 103.A OG1 ASP 100.A O no hydrogen 3.395 N/A LYS 104.A N ILE 101.A O no hydrogen 3.344 N/A LYS 104.A NZ GLU 97.A OE1 no hydrogen 3.095 N/A LYS 104.A NZ GLU 97.A OE2 no hydrogen 2.671 N/A ASN 109.A N LYS 137.A O no hydrogen 2.883 N/A ASN 110.A N TRP 138.A O no hydrogen 2.782 N/A PHE 111.A N TRP 138.A O no hydrogen 3.018 N/A ASP 112.A N LYS 48.A O no hydrogen 2.760 N/A LEU 113.A N LYS 48.A O no hydrogen 3.346 N/A ILE 114.A N THR 144.A O no hydrogen 2.975 N/A TYR 115.A N LEU 50.A O no hydrogen 2.813 N/A SER 116.A N LEU 146.A O no hydrogen 2.995 N/A SER 116.A OG ILE 52.A O no hydrogen 2.839 N/A ARG 117.A NE THR 148.A OG1 no hydrogen 2.837 N/A ARG 117.A NH1 THR 34.A OG1 no hydrogen 3.099 N/A ARG 117.A NH1 TYR 115.A OH no hydrogen 2.917 N/A ASP 118.A N THR 148.A O no hydrogen 2.849 N/A LEU 121.A N ASP 149.A OD1 no hydrogen 3.062 N/A HIS 122.A N ALA 119.A O no hydrogen 3.229 N/A HIS 122.A NE2 TYR 9.A OH no hydrogen 2.843 N/A LEU 123.A N ILE 120.A O no hydrogen 2.885 N/A ASN 127.A N SER 124.A OG no hydrogen 3.175 N/A LYS 128.A N SER 124.A O no hydrogen 2.808 N/A LYS 128.A NZ ILE 120.A O no hydrogen 2.992 N/A LYS 128.A NZ LEU 123.A O no hydrogen 2.820 N/A LYS 128.A NZ THR 172.A O no hydrogen 2.899 N/A ASN 129.A N LEU 125.A O no hydrogen 3.223 N/A LYS 130.A N GLU 126.A O no hydrogen 3.081 N/A LEU 131.A N ASN 127.A O no hydrogen 2.821 N/A PHE 132.A N LYS 128.A O no hydrogen 2.980 N/A GLN 133.A N ASN 129.A O no hydrogen 3.029 N/A LYS 134.A N LYS 130.A O no hydrogen 3.107 N/A LYS 134.A NZ LEU 102.A O no hydrogen 3.076 N/A LYS 134.A NZ LYS 104.A O no hydrogen 2.953 N/A CYS 135.A N LEU 131.A O no hydrogen 2.887 N/A CYS 135.A SG LEU 131.A O no hydrogen 3.437 N/A TYR 136.A N PHE 132.A O no hydrogen 2.977 N/A LYS 137.A N GLN 133.A O no hydrogen 3.347 N/A TRP 138.A N LYS 134.A O no hydrogen 2.915 N/A LEU 139.A N CYS 135.A O no hydrogen 2.938 N/A LYS 140.A N PHE 111.A O no hydrogen 2.808 N/A LYS 140.A NZ ASP 112.A OD1 no hydrogen 3.545 N/A LYS 140.A NZ ASP 112.A OD2 no hydrogen 3.303 N/A GLY 143.A N LYS 140.A O no hydrogen 2.860 N/A THR 144.A N ASP 112.A O no hydrogen 2.923 N/A LEU 145.A N ALA 253.A O no hydrogen 2.786 N/A LEU 146.A N ILE 114.A O no hydrogen 2.874 N/A ILE 147.A N PHE 251.A O no hydrogen 2.853 N/A THR 148.A N SER 116.A O no hydrogen 2.938 N/A THR 148.A OG1 ASP 118.A OD1 no hydrogen 3.011 N/A ASP 149.A N GLY 249.A O no hydrogen 2.947 N/A TYR 150.A N ASP 149.A OD1 no hydrogen 3.018 N/A CYS 151.A N ARG 247.A O no hydrogen 2.857 N/A CYS 151.A SG ASP 149.A O no hydrogen 3.935 N/A ALA 152.A N ILE 174.A O no hydrogen 3.050 N/A THR 153.A N MET 245.A O no hydrogen 2.979 N/A ASN 157.A N GLU 154.A O no hydrogen 2.911 N/A ASN 157.A ND2 THR 153.A OG1 no hydrogen 3.102 N/A TRP 158.A N LYS 155.A O no hydrogen 3.120 N/A TRP 158.A NE1 THR 153.A O no hydrogen 2.888 N/A PHE 162.A N ASP 159.A OD1 no hydrogen 3.022 N/A LYS 163.A N ASP 159.A O no hydrogen 2.879 N/A GLU 164.A N ASP 160.A O no hydrogen 2.992 N/A TYR 165.A N GLU 161.A O no hydrogen 3.122 N/A VAL 166.A N PHE 162.A O no hydrogen 3.000 N/A LYS 167.A N LYS 163.A O no hydrogen 2.981 N/A GLN 168.A N GLU 164.A O no hydrogen 2.892 N/A ARG 169.A N TYR 165.A O no hydrogen 2.959 N/A ARG 169.A NH1 GLN 168.A OE1 no hydrogen 2.816 N/A LYS 170.A N LYS 167.A O no hydrogen 3.176 N/A TYR 171.A N VAL 166.A O no hydrogen 3.238 N/A THR 172.A N LEU 121.A O no hydrogen 2.933 N/A THR 175.A N GLU 178.A OE1 no hydrogen 3.049 N/A GLU 178.A N THR 175.A OG1 no hydrogen 2.978 N/A TYR 179.A N THR 175.A O no hydrogen 3.006 N/A TYR 179.A OH ASP 149.A OD2 no hydrogen 2.778 N/A ALA 180.A N VAL 176.A O no hydrogen 2.997 N/A ASP 181.A N GLU 177.A O no hydrogen 2.991 N/A ILE 182.A N GLU 178.A O no hydrogen 3.066 N/A LEU 183.A N TYR 179.A O no hydrogen 3.258 N/A THR 184.A N ALA 180.A O no hydrogen 2.975 N/A THR 184.A OG1 ALA 180.A O no hydrogen 3.259 N/A ALA 185.A N ASP 181.A O no hydrogen 2.859 N/A CYS 186.A N ILE 182.A O no hydrogen 2.943 N/A CYS 186.A SG ASN 129.A O no hydrogen 3.996 N/A CYS 186.A SG ASN 129.A OD1.A no hydrogen 3.317 N/A CYS 186.A SG ILE 182.A O no hydrogen 3.441 N/A ASN 187.A N THR 184.A O no hydrogen 2.913 N/A ASN 187.A ND2.B TYR 136.A OH no hydrogen 3.401 N/A PHE 188.A N LEU 183.A O no hydrogen 3.164 N/A LYS 189.A N THR 254.A O no hydrogen 2.807 N/A LYS 189.A NZ ASN 187.A O no hydrogen 3.089 N/A ASN 190.A ND2 THR 254.A OG1 no hydrogen 2.949 N/A VAL 192.A N LYS 252.A O no hydrogen 2.852 N/A LYS 194.A N TYR 250.A O no hydrogen 2.880 N/A LEU 196.A N TRP 248.A O no hydrogen 2.796 N/A SER 197.A N ASP 195.A OD1 no hydrogen 3.043 N/A SER 197.A OG ASP 195.A OD1 no hydrogen 2.576 N/A TRP 200.A N LEU 196.A O no hydrogen 2.818 N/A TRP 200.A NE1 SER 28.A OG no hydrogen 2.966 N/A ASN 201.A N SER 197.A O no hydrogen 2.828 N/A ASN 201.A ND2 SER 241.A OG no hydrogen 2.984 N/A GLN 202.A N ASP 198.A O no hydrogen 3.090 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 2.844 N/A GLU 205.A N ASN 201.A O no hydrogen 2.946 N/A VAL 206.A N GLN 202.A O no hydrogen 3.094 N/A GLU 207.A N LEU 203.A O no hydrogen 3.044 N/A HIS 208.A N LEU 204.A O no hydrogen 2.865 N/A HIS 208.A NE2 ASP 231.A O no hydrogen 3.223 N/A LYS 209.A N GLU 205.A O no hydrogen 2.941 N/A TYR 210.A N VAL 206.A O no hydrogen 2.952 N/A LEU 211.A N GLU 207.A O no hydrogen 2.871 N/A HIS 212.A N HIS 208.A O no hydrogen 3.017 N/A HIS 212.A NE2 ASP 231.A OD1 no hydrogen 2.681 N/A GLU 213.A N LYS 209.A O no hydrogen 2.914 N/A ASN 214.A N TYR 210.A O no hydrogen 3.020 N/A ASN 214.A N LEU 211.A O no hydrogen 3.348 N/A ASN 214.A ND2 TYR 210.A O no hydrogen 2.924 N/A PHE 218.A N ASN 214.A O no hydrogen 2.998 N/A LEU 219.A N LYS 215.A O no hydrogen 2.856 N/A LYS 220.A N GLU 216.A O no hydrogen 3.132 N/A LEU 221.A N GLU 217.A O no hydrogen 3.101 N/A PHE 222.A N PHE 218.A O no hydrogen 2.843 N/A LYS 226.A N SER 223.A OG no hydrogen 3.140 N/A PHE 227.A N SER 223.A O no hydrogen 2.967 N/A ILE 228.A N GLU 224.A O no hydrogen 2.929 N/A SER 229.A N LYS 225.A O no hydrogen 3.089 N/A SER 229.A OG LYS 225.A O no hydrogen 3.310 N/A LEU 230.A N LYS 226.A O no hydrogen 3.019 N/A ASP 231.A N PHE 227.A O no hydrogen 2.809 N/A ASP 232.A N ILE 228.A O no hydrogen 2.894 N/A GLY 233.A N SER 229.A O no hydrogen 2.915 N/A TRP 234.A N LEU 230.A O no hydrogen 2.960 N/A TRP 234.A NE1 GLU 207.A OE1 no hydrogen 2.849 N/A SER 235.A N ASP 231.A O no hydrogen 2.955 N/A SER 235.A OG.A ASP 231.A O no hydrogen 3.153 N/A ARG 236.A N ASP 232.A O no hydrogen 3.029 N/A ARG 236.A NH1 ASP 240.A OD2 no hydrogen 2.796 N/A ARG 236.A NH1 GLN 246.A OE1 no hydrogen 2.863 N/A ARG 236.A NH2 GLN 246.A OE1 no hydrogen 2.954 N/A LYS 237.A N GLY 233.A O no hydrogen 3.196 N/A ILE 238.A N TRP 234.A O no hydrogen 2.896 N/A LYS 239.A N SER 235.A O no hydrogen 3.044 N/A ASP 240.A N ARG 236.A O no hydrogen 2.772 N/A SER 241.A N LYS 237.A O no hydrogen 2.865 N/A SER 241.A OG LYS 237.A O no hydrogen 2.809 N/A SER 241.A OG ILE 238.A O no hydrogen 3.141 N/A LYS 242.A N ILE 238.A O no hydrogen 3.106 N/A ARG 243.A N LYS 239.A O no hydrogen 3.237 N/A ARG 243.A NE ASP 240.A OD1 no hydrogen 2.861 N/A ARG 243.A NH2 ASP 159.A OD2 no hydrogen 2.765 N/A ARG 243.A NH2 ASP 240.A OD1 no hydrogen 2.797 N/A LYS 244.A N SER 241.A O no hydrogen 3.163 N/A LYS 244.A NZ ASP 198.A OD1 no hydrogen 2.881 N/A MET 245.A N ASP 240.A O no hydrogen 2.786 N/A GLN 246.A N ASP 240.A O no hydrogen 3.239 N/A GLN 246.A NE2 TYR 165.A OH no hydrogen 3.182 N/A ARG 247.A N CYS 151.A O no hydrogen 2.910 N/A ARG 247.A NE LYS 244.A O no hydrogen 2.895 N/A ARG 247.A NH1 ASP 195.A OD2 no hydrogen 3.422 N/A ARG 247.A NH2 LYS 244.A O no hydrogen 3.468 N/A TRP 248.A N SER 197.A OG no hydrogen 3.180 N/A TRP 248.A NE1 ASP 118.A OD1 no hydrogen 2.864 N/A GLY 249.A N ASP 149.A O no hydrogen 2.919 N/A TYR 250.A N LYS 194.A O no hydrogen 2.954 N/A PHE 251.A N ILE 147.A O no hydrogen 2.862 N/A LYS 252.A N VAL 192.A O no hydrogen 2.930 N/A LYS 252.A NZ ASP 40.A OD2 no hydrogen 3.294 N/A ALA 253.A N LEU 145.A O no hydrogen 2.955 N/A THR 254.A N LYS 189.A O no hydrogen 2.912 N/A THR 254.A OG1 LYS 189.A O no hydrogen 3.363 N/A THR 254.A OG1 ASN 256.A O no hydrogen 2.697 N/A LYS 255.A N GLY 143.A O no hydrogen 3.427 N/A LYS 255.A NZ ASN 109.A OD1 no hydrogen 2.961 N/A LYS 255.A NZ TYR 136.A O no hydrogen 2.825 N/A LYS 255.A NZ LYS 137.A O no hydrogen 3.203 N/A LYS 255.A NZ LEU 139.A O no hydrogen 2.852 N/A