Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2zub_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 10.A NE2 GLN 10.A O no hydrogen 3.276 N/A GLN 10.A NE2 ASN 14.A OD1 no hydrogen 3.580 N/A VAL 12.A N SER 9.A O no hydrogen 2.817 N/A ILE 13.A N SER 9.A O no hydrogen 3.194 N/A ASN 14.A N GLN 10.A O no hydrogen 3.241 N/A LYS 15.A NZ ALA 39.A O no hydrogen 2.521 N/A LEU 16.A N VAL 12.A O no hydrogen 2.901 N/A ILE 17.A N ILE 13.A O no hydrogen 3.257 N/A GLU 18.A N ASN 14.A O no hydrogen 2.541 N/A ALA 19.A N LEU 16.A O no hydrogen 2.645 N/A GLY 20.A N LEU 16.A O no hydrogen 2.833 N/A TYR 21.A N LEU 16.A O no hydrogen 3.000 N/A SER 23.A N SER 22.A OG no hydrogen 2.725 N/A SER 23.A OG THR 26.A OG1 no hydrogen 3.154 N/A THR 26.A OG1 SER 23.A OG no hydrogen 3.154 N/A ALA 28.A N LEU 24.A O no hydrogen 2.893 N/A SER 31.A OG ASP 34.A OD2 no hydrogen 2.874 N/A ASP 34.A N SER 31.A O no hydrogen 2.843 N/A LEU 35.A N SER 31.A O no hydrogen 2.546 N/A SER 36.A N PRO 32.A O no hydrogen 3.248 N/A SER 36.A OG ILE 41.A O no hydrogen 2.711 N/A ALA 38.A N LEU 35.A O no hydrogen 2.866 N/A ALA 39.A N LEU 35.A O no hydrogen 3.216 N/A ILE 41.A N ALA 39.A O no hydrogen 2.327 N/A THR 45.A OG1 PRO 42.A O no hydrogen 2.935 N/A ALA 46.A N PRO 42.A O no hydrogen 2.691 N/A GLN 47.A N LEU 43.A O no hydrogen 2.901 N/A GLN 47.A NE2 LEU 43.A O no hydrogen 3.328 N/A LYS 48.A N SER 44.A O no hydrogen 3.029 N/A ILE 49.A N ALA 46.A O no hydrogen 2.665 N/A ILE 50.A N ALA 46.A O no hydrogen 3.067 N/A LYS 51.A N GLN 47.A O no hydrogen 3.022 N/A ARG 54.A NE ALA 28.A O no hydrogen 3.385 N/A ARG 54.A NH2 ALA 28.A O no hydrogen 3.192 N/A ASP 55.A N LYS 51.A O no hydrogen 3.320 N/A ASP 58.A N ASP 55.A O no hydrogen 3.166 N/A LYS 62.A NZ GLU 70.A OE1 no hydrogen 2.663 N/A LYS 62.A NZ GLU 70.A OE2 no hydrogen 3.567 N/A GLU 66.A N THR 63.A OG1 no hydrogen 2.967 N/A VAL 67.A N THR 63.A O no hydrogen 3.060 N/A LYS 68.A N ALA 64.A O no hydrogen 3.117 N/A LYS 69.A N LEU 65.A O no hydrogen 3.203 N/A LYS 69.A N GLU 66.A O no hydrogen 2.939 N/A GLU 70.A N GLU 66.A O no hydrogen 3.023 N/A ARG 71.A N VAL 67.A O no hydrogen 2.823 N/A MET 72.A N LYS 69.A O no hydrogen 2.799 N/A ASN 73.A N LYS 69.A O no hydrogen 2.774 N/A VAL 74.A N GLU 70.A O no hydrogen 3.046 N/A LYS 75.A NZ MET 72.A O no hydrogen 3.414 N/A LYS 76.A NZ LEU 88.A O no hydrogen 3.414 N/A LYS 76.A NZ ALA 89.A O no hydrogen 3.054 N/A ILE 77.A N ILE 92.A O no hydrogen 3.074 N/A SER 78.A N GLY 126.A O no hydrogen 2.908 N/A SER 78.A OG GLY 126.A O no hydrogen 3.155 N/A THR 79.A N ASP 85.A OD1 no hydrogen 2.769 N/A THR 79.A OG1 SER 81.A O no hydrogen 3.241 N/A THR 79.A OG1 ASP 85.A OD1 no hydrogen 3.298 N/A SER 81.A N THR 79.A OG1 no hydrogen 3.415 N/A SER 81.A OG ASP 289.A OD2 no hydrogen 2.862 N/A GLN 82.A N ASP 289.A OD1 no hydrogen 2.819 N/A ALA 83.A N ASP 289.A OD2 no hydrogen 2.932 N/A LEU 84.A N SER 81.A OG no hydrogen 3.074 N/A ASP 85.A N SER 81.A O no hydrogen 2.837 N/A GLY 86.A N GLN 82.A O no hydrogen 3.012 N/A LEU 87.A N ALA 83.A O no hydrogen 2.886 N/A LEU 88.A N LEU 84.A O no hydrogen 2.948 N/A ALA 89.A N GLY 86.A O no hydrogen 2.691 N/A GLY 90.A N ASP 85.A O no hydrogen 2.666 N/A ILE 92.A N ILE 77.A O no hydrogen 2.946 N/A THR 94.A OG1 ASP 236.A OD2 no hydrogen 2.588 N/A ARG 95.A N ILE 237.A O no hydrogen 2.751 N/A THR 96.A OG1 MET 97.A O no hydrogen 3.515 N/A THR 98.A N VAL 239.A O no hydrogen 2.933 N/A GLU 99.A N ILE 251.A O no hydrogen 2.575 N/A PHE 100.A N ILE 241.A O no hydrogen 3.098 N/A PHE 101.A N ILE 253.A O no hydrogen 2.947 N/A GLY 102.A N ASN 243.A O no hydrogen 3.218 N/A SER 106.A N GLU 103.A O no hydrogen 2.762 N/A SER 106.A OG GLU 103.A O no hydrogen 2.550 N/A SER 106.A OG LEU 255.A O no hydrogen 3.545 N/A LYS 108.A NZ GLN 244.A OE1 no hydrogen 2.961 N/A LEU 111.A N GLY 107.A O no hydrogen 2.795 N/A CYS 112.A N THR 109.A O no hydrogen 2.787 N/A CYS 112.A SG LYS 108.A O no hydrogen 3.044 N/A CYS 112.A SG ASP 198.A OD1 no hydrogen 3.739 N/A HIS 113.A N THR 109.A O no hydrogen 3.164 N/A HIS 113.A ND1 THR 109.A O no hydrogen 2.887 N/A GLN 114.A N GLN 110.A O no hydrogen 2.772 N/A GLN 114.A NE2 ILE 287.A O no hydrogen 3.647 N/A LEU 115.A N LEU 111.A O no hydrogen 3.108 N/A SER 116.A N CYS 112.A O no hydrogen 2.984 N/A SER 116.A OG CYS 112.A O no hydrogen 3.033 N/A VAL 117.A N HIS 113.A O no hydrogen 3.012 N/A VAL 117.A N GLN 114.A O no hydrogen 3.180 N/A ASN 118.A N GLN 114.A O no hydrogen 3.022 N/A ASN 118.A ND2 SER 78.A O no hydrogen 3.544 N/A VAL 119.A N LEU 115.A O no hydrogen 3.058 N/A GLN 120.A NE2 ASN 159.A O no hydrogen 3.676 N/A LEU 121.A N ASN 118.A O no hydrogen 3.233 N/A LYS 125.A N PRO 122.A O no hydrogen 2.679 N/A GLY 126.A N PRO 123.A O no hydrogen 2.946 N/A GLY 127.A N PRO 122.A O no hydrogen 3.188 N/A LEU 128.A N VAL 119.A O no hydrogen 3.304 N/A SER 129.A N LEU 121.A O no hydrogen 2.544 N/A GLY 130.A N VAL 119.A O no hydrogen 2.788 N/A LYS 131.A N SER 191.A O no hydrogen 2.686 N/A LYS 131.A NZ ASP 189.A OD2 no hydrogen 2.708 N/A ALA 132.A N ASN 163.A O no hydrogen 3.006 N/A VAL 133.A N LEU 194.A O no hydrogen 2.865 N/A TYR 134.A N TYR 165.A O no hydrogen 2.747 N/A TYR 134.A OH THR 140.A OG1 no hydrogen 2.748 N/A ILE 135.A N VAL 196.A O no hydrogen 2.584 N/A ASP 136.A N ILE 167.A O no hydrogen 2.760 N/A THR 137.A OG1 GLN 175.A OE1 no hydrogen 3.328 N/A THR 140.A N ASP 136.A OD1 no hydrogen 2.613 N/A THR 140.A OG1 TYR 134.A OH no hydrogen 2.748 N/A THR 140.A OG1 ASP 136.A OD1 no hydrogen 3.454 N/A PHE 141.A N ASP 136.A OD1 no hydrogen 3.370 N/A PHE 141.A N ASP 136.A OD2 no hydrogen 3.069 N/A ARG 142.A N HIS 113.A NE2 no hydrogen 3.251 N/A ARG 142.A NH1 GLY 139.A O no hydrogen 2.815 N/A ARG 142.A NH1 PHE 141.A O no hydrogen 2.543 N/A GLU 144.A N GLU 144.A OE2 no hydrogen 2.456 N/A GLU 147.A N TRP 143.A O no hydrogen 3.124 N/A ASN 148.A N GLU 144.A O no hydrogen 3.104 N/A MET 149.A N ARG 145.A O no hydrogen 2.914 N/A ALA 150.A N ILE 146.A O no hydrogen 3.211 N/A LYS 151.A N GLU 147.A O no hydrogen 2.628 N/A ALA 152.A N ASN 148.A O no hydrogen 2.911 N/A LEU 153.A N MET 149.A O no hydrogen 3.220 N/A GLY 154.A N LYS 151.A O no hydrogen 2.642 N/A LEU 155.A N ALA 150.A O no hydrogen 2.673 N/A ILE 157.A N LEU 155.A O no hydrogen 3.033 N/A ASN 159.A N ASP 156.A OD2 no hydrogen 3.385 N/A VAL 160.A N ASP 156.A O no hydrogen 3.010 N/A VAL 160.A N ILE 157.A O no hydrogen 3.267 N/A MET 161.A N ILE 157.A O no hydrogen 3.096 N/A ASN 163.A N VAL 160.A O no hydrogen 3.185 N/A TYR 165.A N ALA 132.A O no hydrogen 2.681 N/A TYR 165.A OH ASP 189.A OD2 no hydrogen 2.370 N/A TYR 166.A OH ASP 136.A OD2 no hydrogen 2.938 N/A ILE 167.A N TYR 134.A O no hydrogen 3.280 N/A ALA 169.A N ASP 136.A O no hydrogen 2.560 N/A THR 172.A N GLU 207.A OE2 no hydrogen 2.998 N/A THR 172.A OG1 GLU 207.A OE1 no hydrogen 2.235 N/A HIS 174.A N ASN 171.A OD1 no hydrogen 2.827 N/A GLN 175.A N ASN 171.A O no hydrogen 2.776 N/A GLN 175.A NE2 VAL 200.A O no hydrogen 2.905 N/A ILE 176.A N THR 172.A O no hydrogen 2.728 N/A ALA 177.A N ASP 173.A O no hydrogen 2.974 N/A ILE 178.A N HIS 174.A O no hydrogen 2.786 N/A VAL 179.A N GLN 175.A O no hydrogen 3.090 N/A ASP 180.A N ILE 176.A O no hydrogen 3.223 N/A ASP 181.A N ALA 177.A O no hydrogen 3.186 N/A LEU 182.A N VAL 179.A O no hydrogen 3.228 N/A GLN 183.A N ASP 180.A O no hydrogen 3.380 N/A LEU 185.A N ASP 181.A O no hydrogen 3.007 N/A VAL 186.A N LEU 182.A O no hydrogen 3.416 N/A SER 187.A OG GLN 183.A O no hydrogen 3.358 N/A LYS 188.A N GLU 184.A O no hydrogen 3.136 N/A ASP 189.A N LEU 185.A O no hydrogen 2.766 N/A SER 191.A N ASP 189.A OD1 no hydrogen 2.856 N/A ILE 192.A N ASP 189.A O no hydrogen 3.430 N/A LYS 193.A N LYS 131.A O no hydrogen 3.030 N/A LEU 194.A N LYS 131.A O no hydrogen 3.216 N/A ILE 195.A N ALA 238.A O no hydrogen 2.976 N/A VAL 196.A N VAL 133.A O no hydrogen 2.886 N/A VAL 197.A N ILE 240.A O no hydrogen 2.811 N/A ASP 198.A N ILE 135.A O no hydrogen 3.196 N/A SER 199.A N THR 242.A OG1 no hydrogen 2.456 N/A SER 199.A OG GLU 138.A OE1 no hydrogen 2.717 N/A SER 199.A OG ASP 198.A OD2 no hydrogen 3.364 N/A VAL 200.A N THR 242.A O no hydrogen 3.187 N/A SER 202.A N SER 199.A O no hydrogen 2.959 N/A HIS 203.A NE2 THR 137.A O no hydrogen 3.055 N/A ARG 205.A N THR 201.A O no hydrogen 2.890 N/A ARG 205.A NH1 GLN 244.A O no hydrogen 2.500 N/A ALA 206.A N SER 202.A O no hydrogen 3.115 N/A GLU 207.A N HIS 203.A O no hydrogen 2.855 N/A TYR 208.A N PHE 204.A O no hydrogen 3.099 N/A ASN 213.A ND2 GLU 212.A OE2 no hydrogen 3.213 N/A VAL 216.A N ASN 213.A O no hydrogen 2.698 N/A ARG 217.A N ASN 213.A O no hydrogen 3.021 N/A ARG 217.A NH2 TYR 208.A O no hydrogen 2.975 N/A GLN 218.A N LEU 214.A O no hydrogen 3.261 N/A GLN 219.A N ALA 215.A O no hydrogen 3.284 N/A LYS 220.A N VAL 216.A O no hydrogen 2.429 N/A LEU 221.A N ARG 217.A O no hydrogen 2.940 N/A ASN 222.A N GLN 218.A O no hydrogen 3.091 N/A ASN 222.A ND2 GLN 218.A O no hydrogen 2.945 N/A LYS 223.A N GLN 219.A O no hydrogen 3.388 N/A HIS 224.A N LYS 220.A O no hydrogen 3.035 N/A LEU 225.A N LEU 221.A O no hydrogen 2.703 N/A HIS 226.A N ASN 222.A O no hydrogen 2.681 N/A GLN 227.A N LYS 223.A O no hydrogen 3.078 N/A GLN 227.A NE2 LYS 223.A O no hydrogen 3.269 N/A LEU 228.A N HIS 224.A O no hydrogen 3.380 N/A THR 229.A N LEU 225.A O no hydrogen 2.975 N/A THR 229.A OG1 LEU 225.A O no hydrogen 3.300 N/A ARG 230.A N HIS 226.A O no hydrogen 2.834 N/A LEU 231.A N GLN 227.A O no hydrogen 3.178 N/A ALA 232.A N LEU 228.A O no hydrogen 3.122 N/A GLU 233.A N THR 229.A O no hydrogen 3.124 N/A VAL 234.A N ARG 230.A O no hydrogen 2.725 N/A TYR 235.A N LEU 231.A O no hydrogen 2.974 N/A ILE 237.A N ALA 232.A O no hydrogen 3.102 N/A ALA 238.A N LYS 193.A O no hydrogen 2.620 N/A VAL 239.A N THR 96.A O no hydrogen 3.169 N/A ILE 240.A N ILE 195.A O no hydrogen 2.754 N/A ILE 241.A N THR 98.A O no hydrogen 2.979 N/A THR 242.A N VAL 197.A O no hydrogen 3.032 N/A ASN 243.A N PHE 100.A O no hydrogen 3.013 N/A ASN 243.A ND2 THR 201.A OG1 no hydrogen 2.421 N/A VAL 245.A N GLY 102.A O no hydrogen 2.930 N/A ILE 251.A N MET 97.A O no hydrogen 2.904 N/A ARG 252.A N ASP 269.A O no hydrogen 2.941 N/A ARG 252.A NE GLU 99.A OE2 no hydrogen 3.060 N/A ILE 253.A N GLU 99.A O no hydrogen 2.515 N/A GLN 254.A N ARG 266.A O no hydrogen 2.915 N/A LEU 255.A N PHE 101.A O no hydrogen 2.850 N/A LYS 256.A N ILE 264.A O no hydrogen 2.882 N/A SER 258.A N ARG 262.A O no hydrogen 3.041 N/A ASN 261.A N ARG 259.A O no hydrogen 2.312 N/A ARG 262.A N ARG 259.A O no hydrogen 3.464 N/A ARG 263.A N PHE 280.A O no hydrogen 3.076 N/A ARG 263.A NE GLY 105.A O no hydrogen 2.779 N/A ARG 263.A NH1 ARG 262.A O no hydrogen 2.813 N/A ARG 263.A NH2 GLY 105.A O no hydrogen 3.551 N/A ILE 264.A N LYS 256.A O no hydrogen 2.842 N/A ALA 265.A N VAL 278.A O no hydrogen 2.813 N/A ARG 266.A N GLN 254.A O no hydrogen 2.923 N/A VAL 267.A N GLY 276.A O no hydrogen 3.330 N/A VAL 268.A N ARG 252.A O no hydrogen 2.982 N/A GLU 277.A N GLU 25.A OE2 no hydrogen 3.360 N/A VAL 278.A N ALA 265.A O no hydrogen 2.948 N/A PHE 280.A N ARG 263.A O no hydrogen 2.855 N/A ALA 281.A N ARG 288.A O no hydrogen 2.903 N/A LEU 282.A N ASN 261.A O no hydrogen 3.257 N/A THR 283.A N GLY 286.A O no hydrogen 2.803 N/A THR 283.A OG1 GLY 286.A O no hydrogen 2.923 N/A GLU 285.A N THR 283.A OG1 no hydrogen 2.886 N/A GLY 286.A N THR 283.A OG1 no hydrogen 2.862 N/A ARG 288.A N ALA 281.A O no hydrogen 3.052 N/A