Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1u54_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG GLN 1.A O no hydrogen 2.531 N/A THR 4.A OG1 HIS 56.A ND1 no hydrogen 3.427 N/A CYS 5.A N TYR 67.A O no hydrogen 3.347 N/A CYS 5.A SG LEU 6.A O no hydrogen 3.970 N/A ILE 7.A N VAL 69.A O no hydrogen 3.023 N/A ASP 11.A N GLY 8.A O no hydrogen 2.673 N/A ARG 13.A N GLU 27.A O no hydrogen 3.289 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 3.330 N/A GLY 19.A N VAL 23.A O no hydrogen 3.451 N/A VAL 23.A N GLY 19.A O no hydrogen 2.788 N/A ARG 24.A N VAL 40.A O no hydrogen 3.042 N/A ARG 25.A N GLU 16.A O no hydrogen 3.035 N/A ARG 25.A NH1 SER 37.A OG no hydrogen 3.175 N/A GLY 26.A N VAL 38.A O no hydrogen 2.888 N/A GLU 27.A N ARG 13.A O no hydrogen 3.160 N/A TRP 28.A N VAL 36.A O no hydrogen 2.805 N/A ASP 29.A N ASP 11.A O no hydrogen 2.858 N/A ALA 30.A N TRP 28.A O no hydrogen 2.631 N/A ALA 30.A N LYS 34.A O no hydrogen 2.780 N/A THR 35.A OG1 ASP 29.A OD1 no hydrogen 2.364 N/A VAL 36.A N TRP 28.A O no hydrogen 2.854 N/A VAL 38.A N GLY 26.A O no hydrogen 3.255 N/A ALA 39.A N THR 79.A O no hydrogen 2.914 N/A LYS 41.A N MET 77.A O no hydrogen 2.884 N/A LYS 41.A NZ GLU 51.A OE1 no hydrogen 2.776 N/A LYS 41.A NZ GLU 51.A OE2 no hydrogen 2.624 N/A CYS 42.A SG VAL 40.A O no hydrogen 3.879 N/A PHE 48.A N MET 45.A O no hydrogen 3.179 N/A ILE 49.A N MET 45.A O no hydrogen 3.188 N/A ARG 50.A N ASP 46.A O no hydrogen 3.233 N/A ARG 50.A NE ASP 46.A O no hydrogen 3.518 N/A VAL 52.A N PHE 48.A O no hydrogen 3.026 N/A ASN 53.A N ILE 49.A O no hydrogen 3.142 N/A ALA 54.A N GLU 51.A O no hydrogen 3.094 N/A MET 55.A N GLU 51.A O no hydrogen 3.066 N/A SER 57.A OG ASN 53.A O no hydrogen 3.295 N/A SER 57.A OG ALA 54.A O no hydrogen 2.349 N/A ASP 59.A N TYR 116.A OH no hydrogen 3.104 N/A ASN 62.A N HIS 60.A ND1 no hydrogen 2.831 N/A ASN 62.A ND2 VAL 140.A O no hydrogen 3.009 N/A LEU 63.A N HIS 60.A O no hydrogen 3.086 N/A ILE 64.A N ILE 142.A O no hydrogen 2.994 N/A ARG 65.A N GLU 80.A OE1 no hydrogen 3.214 N/A TYR 67.A N VAL 78.A O no hydrogen 2.820 N/A VAL 69.A N CYS 5.A O no hydrogen 3.071 N/A VAL 70.A N LYS 76.A O no hydrogen 2.752 N/A LYS 76.A N VAL 70.A O no hydrogen 2.788 N/A LYS 76.A NZ PRO 74.A O no hydrogen 3.483 N/A MET 77.A N LYS 41.A O no hydrogen 3.075 N/A VAL 78.A N GLY 68.A O no hydrogen 2.919 N/A THR 79.A N ALA 39.A O no hydrogen 2.895 N/A THR 79.A OG1 ALA 39.A O no hydrogen 3.378 N/A GLU 80.A N ARG 65.A O no hydrogen 2.969 N/A LEU 84.A N LEU 134.A O no hydrogen 3.120 N/A GLY 85.A N ALA 82.A O no hydrogen 3.052 N/A LEU 87.A N LEU 132.A O no hydrogen 3.399 N/A ARG 90.A N SER 86.A O no hydrogen 2.933 N/A ARG 90.A NH1 LEU 84.A O no hydrogen 2.634 N/A LEU 91.A N LEU 87.A O no hydrogen 2.725 N/A ARG 92.A N LEU 88.A O no hydrogen 3.114 N/A ARG 92.A NE GLY 199.A O no hydrogen 2.875 N/A ARG 92.A NH2 GLY 199.A O no hydrogen 3.103 N/A LYS 93.A N ARG 90.A O no hydrogen 3.297 N/A HIS 94.A N ARG 90.A O no hydrogen 3.163 N/A GLN 95.A NE2 TYR 198.A O no hydrogen 3.539 N/A HIS 97.A N HIS 94.A O no hydrogen 3.160 N/A THR 102.A N LEU 99.A O no hydrogen 2.902 N/A SER 104.A N LEU 100.A O no hydrogen 3.273 N/A SER 104.A OG LEU 100.A O no hydrogen 3.037 N/A ARG 105.A N GLY 101.A O no hydrogen 3.069 N/A TYR 106.A N THR 102.A O no hydrogen 3.189 N/A TYR 106.A OH ARG 137.A O no hydrogen 2.744 N/A ALA 107.A N LEU 103.A O no hydrogen 2.987 N/A VAL 108.A N SER 104.A O no hydrogen 2.970 N/A GLN 109.A N ARG 105.A O no hydrogen 3.230 N/A GLN 109.A NE2 ASP 138.A O no hydrogen 2.741 N/A VAL 110.A N TYR 106.A O no hydrogen 2.660 N/A ALA 111.A N ALA 107.A O no hydrogen 2.989 N/A ALA 111.A N VAL 108.A O no hydrogen 2.811 N/A GLU 112.A N VAL 108.A O no hydrogen 2.894 N/A GLY 113.A N GLN 109.A O no hydrogen 2.970 N/A MET 114.A N VAL 110.A O no hydrogen 2.900 N/A GLY 115.A N GLU 112.A O no hydrogen 3.165 N/A TYR 116.A N GLU 112.A O no hydrogen 3.192 N/A LEU 117.A N GLY 113.A O no hydrogen 3.499 N/A GLU 118.A N MET 114.A O no hydrogen 3.107 N/A SER 119.A N GLY 115.A O no hydrogen 3.012 N/A SER 119.A OG TYR 116.A O no hydrogen 2.478 N/A LYS 120.A N TYR 116.A O no hydrogen 3.058 N/A ARG 121.A N GLU 118.A O no hydrogen 3.136 N/A ARG 121.A NH2 PRO 152.A O no hydrogen 2.665 N/A ARG 121.A NH2 ASP 155.A O no hydrogen 2.674 N/A PHE 122.A N LEU 117.A O no hydrogen 3.158 N/A ILE 123.A N ARG 149.A O no hydrogen 2.835 N/A HIS 124.A N ASP 184.A OD2 no hydrogen 2.567 N/A ARG 125.A N ASP 184.A OD1 no hydrogen 2.901 N/A ARG 125.A NE LEU 147.A O no hydrogen 2.866 N/A ARG 125.A NH2 LEU 147.A O no hydrogen 3.465 N/A ASP 126.A N HIS 124.A ND1 no hydrogen 3.281 N/A ALA 129.A N GLU 194.A OE1 no hydrogen 2.928 N/A ASN 131.A N ALA 128.A O no hydrogen 2.782 N/A LEU 132.A N ALA 129.A O no hydrogen 3.345 N/A LEU 133.A N LYS 141.A O no hydrogen 2.779 N/A LEU 134.A N GLY 85.A O no hydrogen 3.113 N/A THR 136.A N LEU 139.A O no hydrogen 3.253 N/A LEU 139.A N THR 136.A O no hydrogen 3.418 N/A VAL 140.A N GLN 109.A OE1 no hydrogen 3.144 N/A LYS 141.A N LEU 133.A O no hydrogen 2.679 N/A LYS 141.A NZ GLU 80.A OE2 no hydrogen 2.262 N/A ILE 142.A N ASN 62.A O no hydrogen 2.892 N/A GLY 146.A N ASP 144.A OD2 no hydrogen 3.288 N/A MET 148.A N PHE 145.A O no hydrogen 3.209 N/A ARG 149.A N ILE 123.A O no hydrogen 2.990 N/A ARG 149.A NH1 GLY 146.A O no hydrogen 3.285 N/A ARG 149.A NH1 MET 148.A O no hydrogen 2.477 N/A ARG 149.A NH2 GLY 146.A O no hydrogen 3.542 N/A LEU 151.A N ARG 121.A O no hydrogen 3.113 N/A MET 159.A N ARG 177.A O no hydrogen 3.107 N/A ARG 163.A N GLN 160.A O no hydrogen 3.214 N/A TRP 168.A N PRO 165.A O no hydrogen 3.480 N/A TRP 168.A NE1 GLU 194.A OE1 no hydrogen 2.833 N/A CYS 169.A N PHE 166.A O no hydrogen 2.748 N/A CYS 169.A SG PRO 165.A O no hydrogen 3.390 N/A CYS 169.A SG PHE 166.A O no hydrogen 3.007 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 3.294 N/A SER 173.A N ALA 170.A O no hydrogen 3.055 N/A SER 173.A OG THR 178.A O no hydrogen 3.019 N/A LEU 174.A N PRO 171.A O no hydrogen 2.934 N/A LYS 175.A N PRO 171.A O no hydrogen 3.356 N/A THR 176.A N GLU 172.A O no hydrogen 3.108 N/A THR 176.A OG1 GLU 172.A O no hydrogen 2.606 N/A THR 176.A OG1 THR 178.A OG1 no hydrogen 2.587 N/A THR 178.A OG1 THR 176.A O no hydrogen 3.028 N/A THR 178.A OG1 THR 176.A OG1 no hydrogen 2.587 N/A SER 180.A N SER 183.A OG no hydrogen 2.775 N/A SER 180.A OG GLU 172.A OE2 no hydrogen 3.312 N/A SER 183.A OG SER 180.A O no hydrogen 2.671 N/A ASP 184.A N SER 180.A O no hydrogen 3.264 N/A THR 185.A N HIS 181.A O no hydrogen 3.151 N/A THR 185.A N ALA 182.A O no hydrogen 2.954 N/A THR 185.A OG1 HIS 181.A O no hydrogen 3.445 N/A THR 185.A OG1 PRO 248.A O no hydrogen 3.381 N/A TRP 186.A N ALA 182.A O no hydrogen 2.941 N/A MET 187.A N SER 183.A O no hydrogen 2.996 N/A PHE 188.A N ASP 184.A O no hydrogen 3.090 N/A GLY 189.A N THR 185.A O no hydrogen 3.079 N/A VAL 190.A N TRP 186.A O no hydrogen 3.180 N/A THR 191.A N MET 187.A O no hydrogen 2.939 N/A THR 191.A OG1 MET 187.A O no hydrogen 2.667 N/A LEU 192.A N PHE 188.A O no hydrogen 2.678 N/A TRP 193.A N GLY 189.A O no hydrogen 2.872 N/A TRP 193.A NE1 PRO 223.A O no hydrogen 2.824 N/A GLU 194.A N VAL 190.A O no hydrogen 2.984 N/A MET 195.A N THR 191.A O no hydrogen 3.162 N/A MET 195.A N LEU 192.A O no hydrogen 2.905 N/A PHE 196.A N LEU 192.A O no hydrogen 3.301 N/A THR 197.A N GLU 194.A O no hydrogen 3.313 N/A THR 197.A OG1 TRP 193.A O no hydrogen 2.860 N/A TYR 198.A OH PHE 98.A O no hydrogen 3.281 N/A GLY 199.A N GLU 194.A O no hydrogen 2.752 N/A GLN 200.A N THR 197.A OG1 no hydrogen 3.332 N/A LEU 206.A N TRP 203.A O no hydrogen 3.158 N/A ASN 207.A N GLN 210.A OE1 no hydrogen 2.738 N/A ASN 207.A ND2 GLN 210.A OE1 no hydrogen 3.399 N/A LEU 212.A N SER 209.A O no hydrogen 3.056 N/A HIS 213.A N SER 209.A O no hydrogen 3.109 N/A HIS 213.A NE2 GLU 218.A OE2 no hydrogen 2.528 N/A LYS 214.A N GLN 210.A O no hydrogen 3.378 N/A LYS 214.A NZ GLU 220.A OE1 no hydrogen 2.696 N/A ILE 215.A N ILE 211.A O no hydrogen 2.832 N/A ASP 216.A N LEU 212.A O no hydrogen 2.735 N/A GLU 218.A N HIS 213.A O no hydrogen 3.038 N/A GLU 220.A N LYS 214.A O no hydrogen 3.185 N/A ARG 221.A NE TRP 240.A O no hydrogen 3.222 N/A ARG 221.A NH1 ILE 215.A O no hydrogen 3.326 N/A ARG 221.A NH1 GLU 220.A O no hydrogen 3.359 N/A CYS 228.A SG PRO 229.A O no hydrogen 3.722 N/A GLN 230.A NE2 ASN 234.A OD1 no hydrogen 3.524 N/A TYR 233.A N PRO 229.A O no hydrogen 3.162 N/A TYR 233.A OH LEU 222.A O no hydrogen 3.003 N/A VAL 235.A N ASP 231.A O no hydrogen 3.471 N/A MET 236.A N ILE 232.A O no hydrogen 3.359 N/A VAL 237.A N TYR 233.A O no hydrogen 2.844 N/A GLN 238.A N ASN 234.A O no hydrogen 3.007 N/A CYS 239.A N VAL 235.A O no hydrogen 3.086 N/A CYS 239.A SG VAL 235.A O no hydrogen 3.217 N/A TRP 240.A N VAL 237.A O no hydrogen 3.199 N/A ALA 241.A N GLN 238.A O no hydrogen 2.641 N/A GLU 245.A N GLU 245.A OE1 no hydrogen 2.740 N/A ASP 246.A N LYS 243.A O no hydrogen 3.025 N/A ARG 247.A N PRO 244.A O no hydrogen 3.009 N/A ARG 247.A NE ALA 241.A O no hydrogen 2.905 N/A ARG 247.A NH1 GLU 172.A OE1 no hydrogen 3.244 N/A ARG 247.A NH1 GLU 172.A OE2 no hydrogen 3.398 N/A ARG 247.A NH2 GLU 172.A OE1 no hydrogen 3.104 N/A ALA 252.A N THR 249.A OG1 no hydrogen 3.282 N/A LEU 253.A N THR 249.A O no hydrogen 3.148 N/A ARG 254.A N PHE 250.A O no hydrogen 2.787 N/A ASP 255.A N VAL 251.A O no hydrogen 3.131 N/A PHE 256.A N ALA 252.A O no hydrogen 2.753 N/A LEU 257.A N LEU 253.A O no hydrogen 2.858 N/A LEU 258.A N ARG 254.A O no hydrogen 3.136 N/A GLU 259.A N PHE 256.A O no hydrogen 2.737 N/A ALA 260.A N LEU 257.A O no hydrogen 3.019 N/A