Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ap2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG ARG 8.A O no hydrogen 3.360 N/A VAL 5.A N ARG 8.A O no hydrogen 2.902 N/A LYS 6.A N GLU 77.A OE2 no hydrogen 2.921 N/A LYS 6.A NZ ASP 75.A OD1 no hydrogen 3.367 N/A LYS 6.A NZ TYR 76.A O no hydrogen 2.841 N/A TYR 10.A N MET 3.A O no hydrogen 2.855 N/A SER 11.A N LEU 28.A O no hydrogen 2.795 N/A LEU 13.A N GLN 26.A O no hydrogen 2.773 N/A LYS 14.A N GLN 26.A O no hydrogen 3.340 N/A GLY 17.A N VAL 24.A O no hydrogen 3.325 N/A SER 18.A N GLN 157.A O no hydrogen 3.255 N/A SER 18.A N ASP 159.A OD1 no hydrogen 3.164 N/A SER 18.A OG ASP 159.A OD1 no hydrogen 3.011 N/A SER 18.A OG ASP 159.A OD2 no hydrogen 3.309 N/A GLY 19.A N SER 22.A O no hydrogen 2.948 N/A LYS 23.A N TYR 39.A O no hydrogen 2.722 N/A VAL 24.A N GLY 17.A O no hydrogen 2.772 N/A PHE 25.A N ILE 37.A O no hydrogen 3.175 N/A GLN 26.A N LYS 14.A O no hydrogen 2.814 N/A VAL 27.A N TYR 35.A O no hydrogen 2.827 N/A LEU 28.A N SER 11.A O no hydrogen 2.831 N/A ASN 29.A N GLN 33.A O no hydrogen 2.994 N/A ASN 29.A ND2 GLN 33.A OE1 no hydrogen 2.982 N/A LYS 32.A N ASN 29.A O no hydrogen 2.927 N/A GLN 33.A N ASN 29.A OD1 no hydrogen 2.952 N/A TYR 35.A N VAL 27.A O no hydrogen 3.024 N/A ALA 36.A N MET 87.A O no hydrogen 2.844 N/A ILE 37.A N PHE 25.A O no hydrogen 3.035 N/A LYS 38.A N MET 85.A O no hydrogen 3.105 N/A LYS 38.A NZ GLU 56.A OE1 no hydrogen 3.398 N/A TYR 39.A N LYS 23.A O no hydrogen 2.790 N/A VAL 40.A N ILE 83.A O no hydrogen 2.823 N/A LEU 42.A N GLN 81.A O no hydrogen 2.760 N/A ALA 45.A N LEU 42.A O no hydrogen 3.341 N/A GLN 48.A N ASN 47.A OD1 no hydrogen 2.870 N/A THR 49.A N ASP 46.A OD2 no hydrogen 3.194 N/A THR 49.A OG1 ASP 46.A OD1 no hydrogen 2.703 N/A THR 49.A OG1 ASP 46.A OD2 no hydrogen 2.723 N/A LEU 50.A N ASP 46.A O no hydrogen 3.030 N/A ASP 51.A N ASN 47.A O no hydrogen 3.239 N/A SER 52.A N GLN 48.A O no hydrogen 3.195 N/A SER 52.A OG GLN 48.A O no hydrogen 3.545 N/A SER 52.A OG ILE 152.A O no hydrogen 3.454 N/A TYR 53.A N LEU 50.A O no hydrogen 3.258 N/A ARG 54.A N LEU 50.A O no hydrogen 3.168 N/A ARG 54.A NH1 ASP 51.A OD1 no hydrogen 2.870 N/A ASN 55.A N ASP 51.A O no hydrogen 2.977 N/A GLU 56.A N SER 52.A O no hydrogen 3.067 N/A ILE 57.A N TYR 53.A O no hydrogen 2.907 N/A ALA 58.A N ARG 54.A O no hydrogen 3.165 N/A TYR 59.A N ASN 55.A O no hydrogen 2.993 N/A LEU 60.A N GLU 56.A O no hydrogen 3.031 N/A ASN 61.A N ILE 57.A O no hydrogen 2.905 N/A ASN 61.A N ALA 58.A O no hydrogen 3.035 N/A LYS 62.A N ALA 58.A O no hydrogen 2.847 N/A LEU 63.A N TYR 59.A O no hydrogen 3.057 N/A GLN 64.A N ASN 61.A O no hydrogen 3.424 N/A GLN 64.A NE2 LEU 60.A O no hydrogen 3.281 N/A GLN 64.A NE2 ILE 71.A O no hydrogen 2.867 N/A GLN 65.A NE2 ASN 61.A O no hydrogen 3.042 N/A HIS 66.A N LEU 63.A O no hydrogen 3.007 N/A HIS 66.A ND1 LYS 62.A O no hydrogen 2.965 N/A SER 67.A N LEU 63.A O no hydrogen 3.138 N/A SER 67.A OG GLU 118.A OE2 no hydrogen 2.693 N/A LYS 69.A N SER 67.A OG no hydrogen 2.961 N/A LYS 69.A NZ ASP 68.A OD1 no hydrogen 3.306 N/A LYS 69.A NZ ASP 68.A OD2 no hydrogen 2.839 N/A LYS 69.A NZ GLU 118.A OE1 no hydrogen 2.807 N/A ILE 71.A N LEU 147.A O no hydrogen 3.253 N/A ARG 72.A N GLU 88.A OE2 no hydrogen 2.783 N/A ARG 72.A NE GLN 64.A OE1 no hydrogen 3.304 N/A ARG 72.A NH2 SER 67.A O no hydrogen 2.751 N/A LEU 73.A N GLN 64.A OE1 no hydrogen 2.830 N/A TYR 74.A N VAL 86.A O no hydrogen 2.768 N/A ASP 75.A N VAL 86.A O no hydrogen 3.496 N/A GLU 77.A N TYR 84.A O no hydrogen 2.977 N/A THR 79.A N TYR 82.A O no hydrogen 2.981 N/A THR 79.A OG1 TYR 82.A O no hydrogen 3.249 N/A TYR 82.A N THR 79.A OG1 no hydrogen 3.044 N/A ILE 83.A N VAL 40.A O no hydrogen 2.945 N/A TYR 84.A N GLU 77.A O no hydrogen 2.863 N/A VAL 86.A N ASP 75.A O no hydrogen 2.769 N/A MET 87.A N ALA 36.A O no hydrogen 2.846 N/A GLU 88.A N ARG 72.A O no hydrogen 3.027 N/A CYS 89.A SG GLY 90.A O no hydrogen 3.669 N/A ASN 91.A N ILE 140.A O no hydrogen 2.822 N/A LEU 94.A N PHE 138.A O no hydrogen 2.926 N/A SER 96.A N ASP 93.A OD2 no hydrogen 2.947 N/A SER 96.A OG ASP 93.A OD1 no hydrogen 2.767 N/A SER 96.A OG ASP 93.A OD2 no hydrogen 3.401 N/A TRP 97.A N ASP 93.A O no hydrogen 3.167 N/A LEU 98.A N LEU 94.A O no hydrogen 2.767 N/A LYS 99.A N ASN 95.A O no hydrogen 3.024 N/A LYS 100.A N SER 96.A O no hydrogen 3.098 N/A LYS 101.A N TRP 97.A O no hydrogen 2.623 N/A LYS 102.A N LEU 98.A O no hydrogen 3.405 N/A TRP 107.A N ASP 105.A OD1 no hydrogen 3.409 N/A GLU 108.A N ASP 105.A O no hydrogen 3.129 N/A ARG 109.A N ASP 105.A O no hydrogen 3.179 N/A ARG 109.A NH1 MET 189.A O no hydrogen 2.758 N/A ARG 109.A NH2 GLU 223.A OE2 no hydrogen 3.169 N/A LYS 110.A N PRO 106.A O no hydrogen 3.239 N/A SER 111.A N TRP 107.A O no hydrogen 3.414 N/A TYR 112.A N GLU 108.A O no hydrogen 2.964 N/A TRP 113.A N ARG 109.A O no hydrogen 2.834 N/A LYS 114.A N LYS 110.A O no hydrogen 3.042 N/A ASN 115.A N SER 111.A O no hydrogen 3.153 N/A MET 116.A N TYR 112.A O no hydrogen 2.964 N/A LEU 117.A N TRP 113.A O no hydrogen 2.956 N/A GLU 118.A N LYS 114.A O no hydrogen 2.940 N/A ALA 119.A N ASN 115.A O no hydrogen 2.960 N/A VAL 120.A N MET 116.A O no hydrogen 3.170 N/A HIS 121.A N LEU 117.A O no hydrogen 2.722 N/A THR 122.A N GLU 118.A O no hydrogen 3.216 N/A THR 122.A OG1 GLU 118.A O no hydrogen 2.881 N/A ILE 123.A N ALA 119.A O no hydrogen 3.214 N/A HIS 124.A N VAL 120.A O no hydrogen 3.180 N/A HIS 124.A NE2 ASP 178.A OD2 no hydrogen 2.953 N/A GLN 125.A N HIS 121.A O no hydrogen 3.111 N/A HIS 126.A N ILE 123.A O no hydrogen 3.293 N/A HIS 126.A ND1 THR 122.A O no hydrogen 3.297 N/A GLY 127.A N HIS 124.A O no hydrogen 2.872 N/A ILE 128.A N ILE 123.A O no hydrogen 3.017 N/A HIS 130.A N ASP 178.A OD2 no hydrogen 3.020 N/A HIS 130.A NE2 ASP 149.A O no hydrogen 3.153 N/A SER 131.A N ASP 178.A OD1 no hydrogen 3.047 N/A SER 131.A OG HIS 130.A O no hydrogen 2.678 N/A ASP 132.A N HIS 130.A O no hydrogen 2.918 N/A LYS 134.A N ASN 137.A OD1 no hydrogen 2.808 N/A ASN 137.A N LYS 134.A O no hydrogen 3.098 N/A ASN 137.A ND2 ASP 149.A OD1 no hydrogen 2.782 N/A PHE 138.A N PRO 135.A O no hydrogen 3.244 N/A LEU 139.A N LYS 146.A O no hydrogen 2.810 N/A ILE 140.A N ILE 92.A O no hydrogen 2.787 N/A VAL 141.A N MET 144.A O no hydrogen 2.659 N/A LEU 145.A N ASN 115.A OD1 no hydrogen 3.352 N/A LYS 146.A N LEU 139.A O no hydrogen 2.805 N/A LYS 146.A NZ ASP 68.A O no hydrogen 2.778 N/A LYS 146.A NZ GLU 88.A OE2 no hydrogen 3.121 N/A LEU 147.A N LYS 69.A O no hydrogen 2.824 N/A ILE 148.A N ASN 137.A O no hydrogen 2.747 N/A GLY 151.A N ASP 149.A OD2 no hydrogen 3.036 N/A ASP 159.A N ILE 16.A O no hydrogen 3.106 N/A MET 165.A N VAL 162.A O no hydrogen 3.337 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.801 N/A ALA 169.A N PRO 166.A O no hydrogen 3.125 N/A LYS 171.A N PRO 167.A O no hydrogen 2.788 N/A ASP 172.A N GLU 168.A O no hydrogen 3.161 N/A MET 173.A N LYS 171.A O no hydrogen 2.808 N/A LYS 176.A N SER 174.A OG no hydrogen 3.247 N/A LYS 176.A NZ PRO 238.A O no hydrogen 3.051 N/A LYS 176.A NZ ARG 241.A O no hydrogen 2.780 N/A SER 177.A N SER 174.A O no hydrogen 3.058 N/A SER 177.A OG GLU 168.A OE2 no hydrogen 2.987 N/A SER 177.A OG SER 174.A O no hydrogen 2.718 N/A ASP 178.A N PRO 175.A O no hydrogen 3.196 N/A VAL 179.A N LYS 176.A O no hydrogen 3.054 N/A TRP 180.A N LYS 176.A O no hydrogen 3.266 N/A SER 181.A N SER 177.A O no hydrogen 3.289 N/A SER 181.A OG TYR 164.A O no hydrogen 2.964 N/A SER 181.A OG SER 177.A O no hydrogen 3.267 N/A LEU 182.A N ASP 178.A O no hydrogen 2.976 N/A GLY 183.A N VAL 179.A O no hydrogen 2.773 N/A CYS 184.A N TRP 180.A O no hydrogen 3.043 N/A CYS 184.A SG ASN 163.A O no hydrogen 3.387 N/A CYS 184.A SG TRP 180.A O no hydrogen 3.392 N/A ILE 185.A N SER 181.A O no hydrogen 3.235 N/A LEU 186.A N LEU 182.A O no hydrogen 2.954 N/A TYR 187.A N GLY 183.A O no hydrogen 2.863 N/A TYR 187.A OH GLU 217.A O no hydrogen 2.743 N/A TYR 188.A N CYS 184.A O no hydrogen 3.038 N/A MET 189.A N ILE 185.A O no hydrogen 3.349 N/A THR 190.A N TYR 187.A O no hydrogen 3.375 N/A THR 190.A OG1 LEU 186.A O no hydrogen 2.969 N/A TYR 191.A N TYR 187.A O no hydrogen 2.862 N/A TYR 191.A OH PRO 219.A O no hydrogen 2.702 N/A GLY 192.A N TYR 188.A O no hydrogen 2.798 N/A GLN 197.A N THR 194.A O no hydrogen 3.250 N/A ILE 199.A N PHE 196.A O no hydrogen 3.436 N/A GLN 202.A NE2 ILE 200.A O no hydrogen 3.569 N/A ILE 203.A N ASN 201.A OD1 no hydrogen 3.284 N/A LYS 205.A N ASN 201.A O no hydrogen 2.882 N/A LEU 206.A N GLN 202.A O no hydrogen 3.102 N/A HIS 207.A N SER 204.A O no hydrogen 3.223 N/A ALA 208.A N SER 204.A O no hydrogen 3.134 N/A ALA 208.A N LYS 205.A O no hydrogen 2.880 N/A ILE 209.A N LYS 205.A O no hydrogen 3.258 N/A ASP 211.A N HIS 207.A O no hydrogen 3.150 N/A HIS 214.A N ASP 211.A O no hydrogen 3.460 N/A GLN 227.A N GLU 223.A O no hydrogen 3.303 N/A ASP 228.A N LYS 224.A O no hydrogen 3.092 N/A VAL 229.A N ASP 225.A O no hydrogen 2.941 N/A LEU 230.A N LEU 226.A O no hydrogen 3.242 N/A LYS 231.A N GLN 227.A O no hydrogen 3.184 N/A CYS 232.A N ASP 228.A O no hydrogen 2.959 N/A CYS 232.A SG ASP 228.A O no hydrogen 3.383 N/A CYS 232.A SG ASP 228.A OD1 no hydrogen 3.900 N/A CYS 232.A SG ASP 228.A OD2 no hydrogen 3.546 N/A CYS 233.A N VAL 229.A O no hydrogen 3.118 N/A CYS 233.A SG VAL 229.A O no hydrogen 3.424 N/A LEU 234.A N LEU 230.A O no hydrogen 3.223 N/A ARG 236.A NE ILE 209.A O no hydrogen 2.763 N/A ARG 236.A NH2 ALA 208.A O no hydrogen 2.810 N/A LYS 239.A N ASP 237.A OD1 no hydrogen 3.219 N/A GLN 240.A N ASP 237.A O no hydrogen 2.952 N/A ARG 241.A N ASP 237.A O no hydrogen 3.162 N/A ARG 241.A NE LYS 235.A O no hydrogen 2.886 N/A ARG 241.A NH1 GLU 168.A OE1 no hydrogen 3.536 N/A ARG 241.A NH1 GLU 168.A OE2 no hydrogen 2.751 N/A ARG 241.A NH1 LYS 176.A O no hydrogen 2.899 N/A ARG 241.A NH2 GLU 168.A OE1 no hydrogen 2.739 N/A ARG 241.A NH2 LYS 235.A O no hydrogen 3.217 N/A ILE 242.A N CYS 232.A O no hydrogen 3.481 N/A GLU 246.A N SER 243.A OG no hydrogen 3.402 N/A LEU 247.A N SER 243.A O no hydrogen 2.905 N/A LEU 248.A N ILE 244.A O no hydrogen 2.804 N/A ALA 249.A N GLU 246.A O no hydrogen 3.362 N/A HIS 250.A N LEU 247.A O no hydrogen 3.178 N/A HIS 250.A NE2 ASP 228.A OD2 no hydrogen 2.955 N/A TYR 252.A N HIS 250.A ND1 no hydrogen 2.963 N/A VAL 253.A N HIS 250.A O no hydrogen 2.992 N/A GLN 254.A N HIS 250.A O no hydrogen 3.110 N/A GLN 254.A NE2 LEU 248.A O no hydrogen 2.793 N/A ILE 255.A N PRO 251.A O no hydrogen 2.791 N/A