Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3v0u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NE GLU 13.A OE2 no hydrogen 3.014 N/A ARG 4.A NH1 THR 50.A OG1 no hydrogen 2.938 N/A ARG 4.A NH2 THR 50.A OG1 no hydrogen 3.396 N/A VAL 5.A N VAL 14.A O no hydrogen 2.828 N/A LYS 6.A NZ GLU 13.A OE1 no hydrogen 2.943 N/A LEU 7.A N LEU 12.A O no hydrogen 2.859 N/A THR 9.A OG1 GLN 10.A OE1 no hydrogen 3.323 N/A VAL 14.A N VAL 5.A O no hydrogen 2.838 N/A SER 15.A OG LEU 17.A O no hydrogen 2.958 N/A LYS 16.A N PRO 3.A O no hydrogen 2.928 N/A LYS 16.A NZ LEU 234.A O no hydrogen 3.116 N/A LYS 16.A NZ GLY 237.A O no hydrogen 2.928 N/A LYS 16.A NZ VAL 240.A O no hydrogen 3.407 N/A GLY 18.A N PRO 242.A O no hydrogen 2.862 N/A PHE 19.A N PHE 51.A O no hydrogen 2.924 N/A GLY 20.A N PRO 244.A O no hydrogen 2.996 N/A CYS 21.A N ASP 53.A O no hydrogen 2.797 N/A LEU 24.A N CYS 21.A O no hydrogen 2.817 N/A SER 25.A OG MET 22.A O no hydrogen 3.114 N/A GLY 37.A N PRO 33.A O no hydrogen 3.275 N/A ILE 38.A N GLU 34.A O no hydrogen 2.943 N/A ALA 39.A N GLU 35.A O no hydrogen 3.006 N/A VAL 40.A N GLN 36.A O no hydrogen 3.043 N/A ILE 41.A N GLY 37.A O no hydrogen 3.287 N/A LYS 42.A N ILE 38.A O no hydrogen 2.863 N/A GLU 43.A N ALA 39.A O no hydrogen 2.812 N/A ALA 44.A N VAL 40.A O no hydrogen 2.911 N/A PHE 45.A N ILE 41.A O no hydrogen 2.976 N/A ASN 46.A N LYS 42.A O no hydrogen 2.928 N/A CYS 47.A N GLU 43.A O no hydrogen 2.791 N/A CYS 47.A SG GLU 43.A O no hydrogen 3.495 N/A CYS 47.A SG GLU 43.A OE2 no hydrogen 3.513 N/A GLY 48.A N PHE 45.A O no hydrogen 2.841 N/A ILE 49.A N ALA 44.A O no hydrogen 3.181 N/A THR 50.A N SER 15.A OG no hydrogen 3.030 N/A THR 50.A OG1 GLN 81.A OE1 no hydrogen 2.555 N/A PHE 52.A N GLN 81.A O no hydrogen 2.798 N/A ASP 53.A N PHE 19.A O no hydrogen 2.836 N/A THR 54.A N GLY 83.A O no hydrogen 2.925 N/A THR 54.A OG1 SER 55.A O no hydrogen 3.550 N/A THR 54.A OG1 ASN 64.A OD1 no hydrogen 2.372 N/A SER 55.A OG HIS 127.A ND1 no hydrogen 2.800 N/A ASP 56.A N LYS 85.A O no hydrogen 3.256 N/A TYR 58.A N SER 55.A O no hydrogen 3.181 N/A SER 63.A N GLU 60.A O no hydrogen 2.941 N/A ASN 64.A ND2 CYS 21.A O no hydrogen 2.958 N/A GLU 66.A N GLY 62.A O no hydrogen 3.036 N/A LEU 67.A N SER 63.A O no hydrogen 3.112 N/A LEU 68.A N ASN 64.A O no hydrogen 3.155 N/A GLY 69.A N GLU 65.A O no hydrogen 2.920 N/A LYS 70.A N GLU 66.A O no hydrogen 2.990 N/A LYS 70.A NZ GLU 34.A OE1 no hydrogen 2.813 N/A LYS 70.A NZ GLU 34.A OE2 no hydrogen 3.270 N/A ALA 71.A N LEU 67.A O no hydrogen 2.945 N/A LEU 72.A N LEU 68.A O no hydrogen 2.836 N/A LYS 73.A N LYS 70.A O no hydrogen 3.194 N/A LYS 73.A NZ ASP 117.A OD2 no hydrogen 3.275 N/A GLN 74.A N ALA 71.A O no hydrogen 3.196 N/A LEU 75.A N LEU 72.A O no hydrogen 2.816 N/A ARG 77.A N LEU 75.A O no hydrogen 3.078 N/A ARG 77.A NE ILE 80.A O no hydrogen 3.323 N/A ARG 77.A NH2 TYR 120.A O no hydrogen 2.696 N/A ARG 77.A NH2 ASP 122.A OD2 no hydrogen 2.839 N/A LYS 79.A N PRO 76.A O no hydrogen 3.008 N/A GLN 81.A N THR 50.A O no hydrogen 2.515 N/A VAL 82.A N ASP 122.A OD2 no hydrogen 2.906 N/A GLY 83.A N PHE 52.A O no hydrogen 2.800 N/A THR 84.A N LEU 123.A O no hydrogen 2.861 N/A THR 84.A OG1 GLU 65.A OE2 no hydrogen 2.966 N/A LYS 85.A N THR 84.A OG1 no hydrogen 2.890 N/A LYS 85.A NZ ASP 53.A OD1 no hydrogen 3.185 N/A LYS 85.A NZ ASP 53.A OD2 no hydrogen 2.701 N/A LYS 85.A NZ THR 54.A O no hydrogen 2.982 N/A PHE 86.A N TYR 125.A O no hydrogen 3.089 N/A HIS 89.A N LYS 97.A O no hydrogen 2.820 N/A GLU 90.A N LYS 97.A O no hydrogen 3.382 N/A GLY 92.A N GLY 95.A O no hydrogen 2.984 N/A GLY 95.A N GLY 92.A O no hydrogen 2.491 N/A LYS 97.A N GLU 90.A O no hydrogen 3.146 N/A LYS 99.A N GLY 87.A O no hydrogen 2.765 N/A GLY 100.A N ASP 130.A OD2 no hydrogen 2.885 N/A TYR 104.A N THR 101.A OG1 no hydrogen 3.341 N/A VAL 105.A N THR 101.A O no hydrogen 2.931 N/A ARG 106.A N PRO 102.A O no hydrogen 3.157 N/A ARG 106.A NE GLU 141.A OE2 no hydrogen 2.778 N/A ARG 106.A NH1 GLU 148.A OE1 no hydrogen 2.619 N/A ARG 106.A NH1 GLU 148.A OE2 no hydrogen 3.383 N/A ARG 106.A NH2 GLU 141.A OE2 no hydrogen 2.600 N/A ARG 106.A NH2 GLU 148.A OE2 no hydrogen 3.152 N/A SER 107.A N ASP 103.A O no hydrogen 2.936 N/A SER 107.A OG ASP 103.A O no hydrogen 2.971 N/A SER 107.A OG TYR 104.A O no hydrogen 3.101 N/A CYS 108.A N TYR 104.A O no hydrogen 2.971 N/A CYS 108.A SG ASP 56.A OD2 no hydrogen 3.872 N/A CYS 108.A SG TYR 104.A O no hydrogen 3.134 N/A CYS 109.A N VAL 105.A O no hydrogen 3.088 N/A GLU 110.A N ARG 106.A O no hydrogen 2.975 N/A ALA 111.A N SER 107.A O no hydrogen 2.959 N/A SER 112.A N CYS 108.A O no hydrogen 2.918 N/A SER 112.A OG GLU 65.A OE1 no hydrogen 3.350 N/A SER 112.A OG GLU 65.A OE2 no hydrogen 2.669 N/A SER 112.A OG CYS 108.A O no hydrogen 3.075 N/A LEU 113.A N CYS 109.A O no hydrogen 2.978 N/A LYS 114.A N GLU 110.A O no hydrogen 3.042 N/A ARG 115.A N ALA 111.A O no hydrogen 3.011 N/A ARG 115.A NE GLU 65.A OE1 no hydrogen 2.701 N/A ARG 115.A NH2 GLU 65.A OE1 no hydrogen 2.875 N/A LEU 116.A N SER 112.A O no hydrogen 2.927 N/A ASP 117.A N LYS 114.A O no hydrogen 3.067 N/A VAL 118.A N LEU 113.A O no hydrogen 3.118 N/A ILE 121.A N LYS 150.A O no hydrogen 2.892 N/A ASP 122.A N VAL 82.A O no hydrogen 3.228 N/A LEU 123.A N VAL 82.A O no hydrogen 3.233 N/A PHE 124.A N TYR 153.A O no hydrogen 2.785 N/A TYR 125.A N THR 84.A O no hydrogen 2.755 N/A ILE 126.A N GLY 155.A O no hydrogen 2.980 N/A HIS 127.A N PHE 86.A O no hydrogen 2.597 N/A HIS 127.A ND1 SER 55.A OG no hydrogen 2.800 N/A THR 132.A N ASP 130.A OD1 no hydrogen 2.744 N/A THR 132.A OG1 ASP 130.A OD1 no hydrogen 2.871 N/A VAL 133.A N ASP 130.A O no hydrogen 3.278 N/A ILE 135.A N THR 279.A OG1 no hydrogen 3.029 N/A ILE 137.A N PRO 134.A O no hydrogen 2.915 N/A THR 138.A OG1 GLY 100.A O no hydrogen 2.712 N/A MET 139.A N ILE 135.A O no hydrogen 2.842 N/A GLY 140.A N GLU 136.A O no hydrogen 2.743 N/A GLU 141.A N ILE 137.A O no hydrogen 3.354 N/A GLU 141.A N THR 138.A O no hydrogen 3.255 N/A LEU 142.A N THR 138.A O no hydrogen 3.368 N/A LYS 143.A N MET 139.A O no hydrogen 3.126 N/A LYS 144.A N GLY 140.A O no hydrogen 3.376 N/A LEU 145.A N GLU 141.A O no hydrogen 3.106 N/A VAL 146.A N LEU 142.A O no hydrogen 2.946 N/A GLU 147.A N LYS 143.A O no hydrogen 2.961 N/A GLU 148.A N LYS 144.A O no hydrogen 2.804 N/A GLY 149.A N VAL 146.A O no hydrogen 2.897 N/A LYS 150.A N LEU 145.A O no hydrogen 2.874 N/A LYS 150.A NZ GLU 110.A OE2 no hydrogen 2.425 N/A ILE 151.A N LEU 145.A O no hydrogen 3.216 N/A LYS 152.A N ILE 121.A O no hydrogen 2.948 N/A GLY 155.A N PHE 124.A O no hydrogen 2.983 N/A LEU 156.A N ALA 175.A O no hydrogen 2.843 N/A GLU 158.A N GLN 177.A O no hydrogen 2.974 N/A SER 160.A OG ASN 278.A OD1 no hydrogen 2.807 N/A THR 163.A N SER 160.A OG no hydrogen 3.018 N/A ILE 164.A N SER 160.A O no hydrogen 2.941 N/A ARG 165.A N PRO 161.A O no hydrogen 2.844 N/A ARG 166.A N ASP 162.A O no hydrogen 3.066 N/A ARG 166.A NE GLU 136.A OE2 no hydrogen 2.999 N/A ARG 166.A NH1 ASP 162.A OD2 no hydrogen 3.212 N/A ARG 166.A NH1 THR 279.A O no hydrogen 2.854 N/A ARG 166.A NH2 GLU 136.A OE1 no hydrogen 2.891 N/A ARG 166.A NH2 GLU 136.A OE2 no hydrogen 3.485 N/A ARG 166.A NH2 PRO 280.A O no hydrogen 3.177 N/A ALA 167.A N THR 163.A O no hydrogen 2.903 N/A HIS 168.A N ILE 164.A O no hydrogen 3.009 N/A ALA 169.A N ARG 165.A O no hydrogen 3.178 N/A VAL 170.A N ARG 166.A O no hydrogen 3.467 N/A HIS 171.A N ALA 167.A O no hydrogen 2.998 N/A VAL 173.A N HIS 168.A ND1 no hydrogen 2.848 N/A THR 174.A N VAL 154.A O no hydrogen 2.681 N/A ALA 175.A N VAL 154.A O no hydrogen 3.382 N/A LEU 176.A N GLY 201.A O no hydrogen 2.714 N/A GLN 177.A N LEU 156.A O no hydrogen 2.738 N/A GLN 177.A NE2 ASP 53.A OD1 no hydrogen 3.431 N/A ILE 178.A N VAL 203.A O no hydrogen 3.440 N/A TYR 180.A OH GLU 188.A OE2 no hydrogen 2.736 N/A SER 181.A N THR 184.A O no hydrogen 3.192 N/A TRP 183.A N SER 181.A OG no hydrogen 3.166 N/A THR 184.A N SER 181.A O no hydrogen 2.980 N/A ARG 185.A NE LEU 182.A O no hydrogen 3.087 N/A ARG 185.A NH2 SER 272.A O no hydrogen 2.918 N/A GLU 188.A N ARG 185.A O no hydrogen 2.996 N/A ASP 189.A N ASP 186.A O no hydrogen 3.433 N/A VAL 192.A N ILE 187.A O no hydrogen 2.738 N/A LEU 194.A N GLU 190.A O no hydrogen 2.916 N/A CYS 195.A N ILE 191.A O no hydrogen 2.987 N/A CYS 195.A SG ILE 191.A O no hydrogen 3.440 N/A ARG 196.A N VAL 192.A O no hydrogen 2.930 N/A ARG 196.A NE ASP 239.A OD2 no hydrogen 2.702 N/A ARG 196.A NH2 GLN 236.A O no hydrogen 3.019 N/A ARG 196.A NH2 ASP 239.A OD1 no hydrogen 2.655 N/A ARG 196.A NH2 ASP 239.A OD2 no hydrogen 3.314 N/A GLN 197.A N PRO 193.A O no hydrogen 2.877 N/A LEU 198.A N LEU 194.A O no hydrogen 3.010 N/A ILE 200.A N CYS 195.A O no hydrogen 2.721 N/A GLY 201.A N THR 174.A O no hydrogen 3.005 N/A ILE 202.A N ASP 239.A O no hydrogen 2.879 N/A VAL 203.A N LEU 176.A O no hydrogen 2.954 N/A TYR 205.A N ILE 178.A O no hydrogen 3.053 N/A SER 206.A OG TYR 205.A O no hydrogen 3.003 N/A SER 206.A OG SER 206.A O no hydrogen 2.521 N/A GLN 209.A N GLN 209.A OE1 no hydrogen 2.313 N/A ILE 210.A N ASN 207.A O no hydrogen 3.209 N/A TYR 212.A N LYS 208.A O no hydrogen 2.922 N/A ARG 213.A N GLN 209.A O no hydrogen 2.710 N/A ARG 213.A NH1 ALA 274.A O no hydrogen 2.756 N/A ILE 214.A N ILE 210.A O no hydrogen 3.032 N/A GLU 215.A N TYR 211.A O no hydrogen 2.818 N/A ALA 216.A N TYR 212.A O no hydrogen 2.745 N/A LEU 217.A N ARG 213.A O no hydrogen 2.908 N/A SER 218.A N ILE 214.A O no hydrogen 2.691 N/A SER 218.A OG GLU 215.A O no hydrogen 2.895 N/A SER 218.A OG CYS 223.A O no hydrogen 3.181 N/A GLN 219.A N GLU 215.A O no hydrogen 2.719 N/A LYS 220.A N ALA 216.A O no hydrogen 3.204 N/A LYS 220.A NZ GLU 270.A OE1 no hydrogen 3.163 N/A HIS 221.A N LEU 217.A O no hydrogen 3.131 N/A HIS 221.A ND1 LEU 217.A O no hydrogen 3.031 N/A GLY 222.A N GLN 219.A O no hydrogen 2.997 N/A CYS 223.A N SER 218.A O no hydrogen 2.944 N/A CYS 223.A SG SER 218.A O no hydrogen 3.850 N/A CYS 223.A SG THR 224.A O no hydrogen 3.656 N/A THR 224.A N GLN 227.A OE1 no hydrogen 2.685 N/A GLN 227.A N THR 224.A OG1 no hydrogen 3.254 N/A GLN 227.A NE2 ASN 254.A O no hydrogen 2.968 N/A LEU 228.A N THR 224.A O no hydrogen 2.765 N/A ALA 229.A N PRO 225.A O no hydrogen 2.952 N/A LEU 230.A N VAL 226.A O no hydrogen 3.004 N/A ALA 231.A N GLN 227.A O no hydrogen 2.809 N/A TRP 232.A N LEU 228.A O no hydrogen 2.865 N/A VAL 233.A N ALA 229.A O no hydrogen 3.167 N/A LEU 234.A N LEU 230.A O no hydrogen 2.896 N/A HIS 235.A N ALA 231.A O no hydrogen 3.083 N/A HIS 235.A N TRP 232.A O no hydrogen 3.187 N/A HIS 235.A ND1 ALA 231.A O no hydrogen 2.703 N/A GLN 236.A N VAL 233.A O no hydrogen 2.927 N/A GLN 236.A NE2 TRP 232.A O no hydrogen 2.756 N/A ASP 239.A N ASP 239.A OD1 no hydrogen 2.502 N/A VAL 240.A N GLY 237.A O no hydrogen 3.353 N/A VAL 241.A N ILE 202.A O no hydrogen 2.916 N/A ILE 243.A N PRO 204.A O no hydrogen 2.919 N/A THR 246.A OG1 LYS 248.A O no hydrogen 3.467 N/A LYS 248.A N THR 246.A OG1 no hydrogen 3.293 N/A ASN 251.A ND2 THR 246.A OG1 no hydrogen 3.091 N/A LEU 252.A N LYS 248.A O no hydrogen 3.201 N/A HIS 253.A N ILE 249.A O no hydrogen 2.799 N/A HIS 253.A NE2 GLU 43.A OE2 no hydrogen 2.907 N/A ASN 254.A N LYS 250.A O no hydrogen 2.764 N/A ASN 255.A N ASN 251.A O no hydrogen 2.817 N/A VAL 256.A N LEU 252.A O no hydrogen 2.925 N/A GLY 257.A N HIS 253.A O no hydrogen 2.973 N/A ALA 258.A N ASN 255.A O no hydrogen 2.942 N/A LEU 259.A N VAL 256.A O no hydrogen 2.885 N/A LYS 260.A N GLY 257.A O no hydrogen 2.998 N/A LEU 263.A N HIS 235.A NE2 no hydrogen 2.949 N/A THR 264.A N ASP 267.A OD2 no hydrogen 3.109 N/A THR 264.A OG1 GLU 266.A OE1 no hydrogen 3.337 N/A LYS 265.A NZ GLU 266.A OE2 no hydrogen 3.531 N/A GLU 266.A N GLU 266.A OE1 no hydrogen 2.744 N/A ASP 267.A N THR 264.A OG1 no hydrogen 3.009 N/A LEU 268.A N THR 264.A O no hydrogen 2.985 N/A LYS 269.A N LYS 265.A O no hydrogen 3.139 N/A LYS 269.A NZ ASP 273.A OD2 no hydrogen 2.938 N/A GLU 270.A N GLU 266.A O no hydrogen 3.112 N/A ILE 271.A N ASP 267.A O no hydrogen 3.010 N/A SER 272.A N LEU 268.A O no hydrogen 2.888 N/A SER 272.A OG LEU 268.A O no hydrogen 3.003 N/A SER 272.A OG LYS 269.A O no hydrogen 3.397 N/A ASP 273.A N LYS 269.A O no hydrogen 2.674 N/A ALA 274.A N GLU 270.A O no hydrogen 3.167 N/A ALA 274.A N ILE 271.A O no hydrogen 3.213 N/A