Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5x8x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG THR 3.A OG1 no hydrogen 3.041 N/A THR 3.A OG1 SER 1.A OG no hydrogen 3.041 N/A GLU 4.A N SER 1.A OG no hydrogen 3.276 N/A ILE 5.A N SER 1.A O no hydrogen 3.277 N/A GLU 6.A N LEU 2.A O no hydrogen 3.184 N/A HIS 7.A N THR 3.A O no hydrogen 3.063 N/A HIS 7.A ND1 THR 3.A O no hydrogen 2.723 N/A LEU 8.A N GLU 4.A O no hydrogen 3.263 N/A VAL 9.A N ILE 5.A O no hydrogen 3.059 N/A GLN 10.A N GLU 6.A O no hydrogen 3.029 N/A SER 11.A N HIS 7.A O no hydrogen 2.953 N/A VAL 12.A N LEU 8.A O no hydrogen 2.975 N/A CYS 13.A N VAL 9.A O no hydrogen 3.039 N/A CYS 13.A SG VAL 9.A O no hydrogen 3.357 N/A LYS 14.A N GLN 10.A O no hydrogen 2.838 N/A SER 15.A N SER 11.A O no hydrogen 3.067 N/A SER 15.A OG SER 11.A O no hydrogen 3.018 N/A SER 15.A OG VAL 12.A O no hydrogen 2.788 N/A TYR 16.A N VAL 12.A O no hydrogen 3.048 N/A ARG 17.A N CYS 13.A O no hydrogen 2.996 N/A GLU 18.A N LYS 14.A O no hydrogen 2.887 N/A THR 19.A N SER 15.A O no hydrogen 3.078 N/A THR 19.A N TYR 16.A O no hydrogen 3.268 N/A THR 19.A OG1 SER 15.A O no hydrogen 3.035 N/A THR 19.A OG1 TYR 16.A O no hydrogen 3.465 N/A CYS 20.A N ARG 17.A O no hydrogen 3.300 N/A CYS 20.A SG TYR 16.A O no hydrogen 3.152 N/A GLU 25.A N GLU 25.A OE1 no hydrogen 2.795 N/A LEU 27.A N ARG 23.A O no hydrogen 3.184 N/A LEU 28.A N LEU 24.A O no hydrogen 3.052 N/A ARG 29.A N GLU 25.A O no hydrogen 2.936 N/A GLN 30.A N ASP 26.A O no hydrogen 3.132 N/A ARG 31.A N LEU 28.A O no hydrogen 3.038 N/A SER 32.A OG ARG 29.A O no hydrogen 3.476 N/A PHE 35.A N TYR 117.A O no hydrogen 2.874 N/A SER 36.A N GLU 39.A OE1 no hydrogen 2.714 N/A SER 36.A OG GLU 38.A OE1 no hydrogen 3.341 N/A SER 36.A OG GLU 39.A OE1 no hydrogen 3.177 N/A GLU 39.A N SER 36.A OG no hydrogen 3.365 N/A VAL 40.A N SER 36.A O no hydrogen 3.026 N/A THR 41.A N ARG 37.A O no hydrogen 3.078 N/A THR 41.A OG1 ARG 37.A O no hydrogen 3.228 N/A GLY 42.A N GLU 38.A O no hydrogen 2.888 N/A TYR 43.A N GLU 39.A O no hydrogen 3.117 N/A TYR 43.A OH GLU 114.A OE1 no hydrogen 2.371 N/A GLN 44.A N VAL 40.A O no hydrogen 2.918 N/A GLN 44.A NE2 GLU 121.A O no hydrogen 3.210 N/A ARG 45.A N THR 41.A O no hydrogen 2.934 N/A LYS 46.A N TYR 43.A O no hydrogen 3.139 N/A LYS 46.A NZ GLU 50.A OE1 no hydrogen 2.769 N/A GLU 50.A N SER 47.A OG no hydrogen 3.219 N/A MET 51.A N SER 47.A O no hydrogen 2.985 N/A TRP 52.A N MET 48.A O no hydrogen 3.061 N/A TRP 52.A NE1 LEU 126.A O no hydrogen 3.014 N/A GLU 53.A N TRP 49.A O no hydrogen 2.768 N/A ARG 54.A N GLU 50.A O no hydrogen 3.046 N/A CYS 55.A N MET 51.A O no hydrogen 2.831 N/A CYS 55.A SG MET 51.A O no hydrogen 3.303 N/A ALA 56.A N TRP 52.A O no hydrogen 2.863 N/A HIS 57.A N GLU 53.A O no hydrogen 3.034 N/A HIS 58.A N ARG 54.A O no hydrogen 3.010 N/A LEU 59.A N CYS 55.A O no hydrogen 2.798 N/A THR 60.A N ALA 56.A O no hydrogen 2.872 N/A THR 60.A OG1 ALA 56.A O no hydrogen 2.923 N/A GLU 61.A N HIS 57.A O no hydrogen 2.920 N/A ALA 62.A N HIS 58.A O no hydrogen 2.933 N/A ILE 63.A N LEU 59.A O no hydrogen 3.034 N/A GLN 64.A N THR 60.A O no hydrogen 3.062 N/A TYR 65.A N GLU 61.A O no hydrogen 3.259 N/A VAL 66.A N ALA 62.A O no hydrogen 2.962 N/A VAL 67.A N ILE 63.A O no hydrogen 2.918 N/A GLU 68.A N GLN 64.A O no hydrogen 3.096 N/A PHE 69.A N TYR 65.A O no hydrogen 2.919 N/A ALA 70.A N VAL 66.A O no hydrogen 3.068 N/A LYS 71.A N VAL 67.A O no hydrogen 3.031 N/A LYS 71.A NZ GLU 68.A OE2 no hydrogen 3.392 N/A ARG 72.A N GLU 68.A O no hydrogen 3.151 N/A LEU 73.A N ALA 70.A O no hydrogen 2.951 N/A LEU 79.A N PHE 76.A O no hydrogen 3.231 N/A CYS 80.A N GLU 170.A OE1 no hydrogen 3.343 N/A ASN 82.A ND2 ASP 83.A OD1 no hydrogen 3.536 N/A ASN 82.A ND2 GLY 167.A O no hydrogen 2.977 N/A GLN 84.A N CYS 80.A O no hydrogen 3.069 N/A GLN 84.A NE2 PHE 76.A O no hydrogen 3.514 N/A GLN 84.A NE2 LEU 79.A O no hydrogen 2.891 N/A ILE 85.A N GLN 81.A O no hydrogen 3.116 N/A VAL 86.A N ASN 82.A O no hydrogen 2.941 N/A LEU 87.A N ASP 83.A O no hydrogen 2.958 N/A LEU 88.A N GLN 84.A O no hydrogen 3.203 N/A LYS 89.A N ILE 85.A O no hydrogen 2.856 N/A ALA 90.A N VAL 86.A O no hydrogen 3.108 N/A GLY 91.A N LEU 87.A O no hydrogen 2.856 N/A ALA 92.A N LEU 88.A O no hydrogen 2.841 N/A VAL 95.A N GLY 91.A O no hydrogen 3.028 N/A VAL 96.A N ALA 92.A O no hydrogen 2.950 N/A LEU 97.A N MET 93.A O no hydrogen 3.034 N/A VAL 98.A N GLU 94.A O no hydrogen 3.075 N/A ARG 99.A N VAL 95.A O no hydrogen 2.825 N/A ARG 99.A NH1 THR 19.A O no hydrogen 2.720 N/A ARG 99.A NH2 THR 19.A OG1 no hydrogen 2.788 N/A MET 100.A N VAL 96.A O no hydrogen 3.027 N/A MET 100.A N LEU 97.A O no hydrogen 3.270 N/A CYS 101.A N VAL 98.A O no hydrogen 3.111 N/A CYS 101.A SG VAL 98.A O no hydrogen 3.385 N/A ARG 102.A N ARG 99.A O no hydrogen 3.238 N/A ARG 102.A NH1 GLU 149.A OE1 no hydrogen 3.277 N/A ARG 102.A NH2 LEU 22.A O no hydrogen 2.781 N/A ALA 103.A N MET 100.A O no hydrogen 2.961 N/A TYR 104.A N CYS 101.A O no hydrogen 3.147 N/A TYR 104.A OH HIS 140.A ND1 no hydrogen 2.683 N/A ASN 105.A N THR 110.A O no hydrogen 2.861 N/A ASP 107.A N ASN 105.A OD1 no hydrogen 3.043 N/A THR 110.A N ASN 105.A O no hydrogen 3.325 N/A THR 110.A OG1 ASN 108.A OD1 no hydrogen 2.690 N/A VAL 111.A N GLY 118.A O no hydrogen 2.833 N/A PHE 112.A N ALA 103.A O no hydrogen 3.056 N/A PHE 113.A N LYS 116.A O no hydrogen 2.931 N/A LYS 116.A N PHE 113.A O no hydrogen 3.306 N/A LYS 116.A NZ GLU 39.A OE2 no hydrogen 3.078 N/A TYR 117.A N ASN 33.A O no hydrogen 3.084 N/A TYR 117.A OH LEU 27.A O no hydrogen 2.608 N/A GLY 118.A N VAL 111.A O no hydrogen 3.103 N/A LEU 122.A N GLY 119.A O no hydrogen 3.331 N/A PHE 123.A N MET 120.A O no hydrogen 3.090 N/A ARG 124.A N GLU 121.A O no hydrogen 3.120 N/A LEU 126.A N PHE 123.A O no hydrogen 3.135 N/A GLY 127.A N ARG 124.A O no hydrogen 3.037 N/A CYS 128.A SG HIS 214.A NE2 no hydrogen 3.744 N/A SER 129.A N GLY 127.A O no hydrogen 2.970 N/A ILE 132.A N CYS 128.A O no hydrogen 2.977 N/A SER 133.A N SER 129.A O no hydrogen 2.907 N/A SER 134.A N GLU 130.A O no hydrogen 3.145 N/A SER 134.A OG GLU 130.A O no hydrogen 2.719 N/A ILE 135.A N LEU 131.A O no hydrogen 3.028 N/A PHE 136.A N ILE 132.A O no hydrogen 3.022 N/A ASP 137.A N SER 133.A O no hydrogen 2.975 N/A PHE 138.A N SER 134.A O no hydrogen 2.907 N/A SER 139.A N ILE 135.A O no hydrogen 3.142 N/A HIS 140.A N PHE 136.A O no hydrogen 2.872 N/A HIS 140.A ND1 TYR 104.A OH no hydrogen 2.683 N/A SER 141.A N ASP 137.A O no hydrogen 2.980 N/A SER 141.A OG ASP 137.A O no hydrogen 3.310 N/A LEU 142.A N PHE 138.A O no hydrogen 3.202 N/A SER 143.A N SER 139.A O no hydrogen 2.950 N/A ALA 144.A N HIS 140.A O no hydrogen 3.026 N/A LEU 145.A N LEU 142.A O no hydrogen 3.178 N/A HIS 146.A N SER 143.A O no hydrogen 2.799 N/A SER 148.A N GLU 151.A OE1 no hydrogen 3.489 N/A GLU 151.A N SER 148.A OG no hydrogen 3.270 N/A ILE 152.A N SER 148.A O no hydrogen 3.028 N/A ALA 153.A N GLU 149.A O no hydrogen 2.987 N/A LEU 154.A N ASP 150.A O no hydrogen 3.038 N/A TYR 155.A N GLU 151.A O no hydrogen 2.900 N/A THR 156.A N ILE 152.A O no hydrogen 2.945 N/A THR 156.A OG1 ILE 152.A O no hydrogen 2.957 N/A THR 156.A OG1 ALA 153.A O no hydrogen 3.246 N/A ALA 157.A N ALA 153.A O no hydrogen 3.066 N/A LEU 158.A N LEU 154.A O no hydrogen 3.153 N/A VAL 159.A N TYR 155.A O no hydrogen 2.913 N/A LEU 160.A N THR 156.A O no hydrogen 3.156 N/A ILE 161.A N ALA 157.A O no hydrogen 2.925 N/A ASN 162.A N LEU 160.A O no hydrogen 2.956 N/A ALA 163.A N GLN 178.A OE1 no hydrogen 2.966 N/A HIS 164.A N ASN 162.A OD1 no hydrogen 2.653 N/A HIS 164.A ND1 ASN 162.A OD1 no hydrogen 2.949 N/A ARG 165.A NH2 VAL 159.A O no hydrogen 2.848 N/A GLN 169.A N ASP 83.A OD1 no hydrogen 2.717 N/A GLU 170.A N ASP 83.A OD2 no hydrogen 3.101 N/A ARG 172.A NH1 GLU 175.A OE1 no hydrogen 3.187 N/A ARG 172.A NH1 GLU 175.A OE2 no hydrogen 3.561 N/A VAL 174.A N GLU 170.A O no hydrogen 3.365 N/A GLU 175.A N LYS 171.A O no hydrogen 2.937 N/A GLN 176.A N ARG 172.A O no hydrogen 2.960 N/A LEU 177.A N LYS 173.A O no hydrogen 3.196 N/A GLN 178.A N VAL 174.A O no hydrogen 2.797 N/A GLN 178.A NE2 GLU 182.A OE2 no hydrogen 3.045 N/A TYR 179.A N GLU 175.A O no hydrogen 2.831 N/A ASN 180.A N GLN 176.A O no hydrogen 3.205 N/A LEU 181.A N LEU 177.A O no hydrogen 3.074 N/A GLU 182.A N GLN 178.A O no hydrogen 2.796 N/A LEU 183.A N TYR 179.A O no hydrogen 2.890 N/A ALA 184.A N ASN 180.A O no hydrogen 3.016 N/A PHE 185.A N LEU 181.A O no hydrogen 2.867 N/A HIS 186.A N GLU 182.A O no hydrogen 2.902 N/A HIS 187.A N LEU 183.A O no hydrogen 3.023 N/A HIS 188.A N ALA 184.A O no hydrogen 3.090 N/A LEU 189.A N PHE 185.A O no hydrogen 2.797 N/A CYS 190.A N HIS 186.A O no hydrogen 3.011 N/A CYS 190.A SG HIS 186.A NE2 no hydrogen 3.539 N/A CYS 190.A SG HIS 186.A O no hydrogen 3.530 N/A LYS 191.A N HIS 187.A O no hydrogen 3.137 N/A LYS 191.A NZ GLU 6.A OE2 no hydrogen 3.046 N/A THR 192.A N HIS 188.A O no hydrogen 3.272 N/A THR 192.A OG1 HIS 188.A O no hydrogen 3.143 N/A THR 192.A OG1 LEU 189.A O no hydrogen 3.328 N/A HIS 193.A N CYS 190.A O no hydrogen 3.034 N/A ARG 194.A N LEU 189.A O no hydrogen 2.987 N/A ARG 194.A NE GLU 151.A OE1 no hydrogen 3.466 N/A ARG 194.A NE GLU 151.A OE2 no hydrogen 3.047 N/A ARG 194.A NH1 LEU 145.A O no hydrogen 3.454 N/A ARG 194.A NH2 LEU 145.A O no hydrogen 2.831 N/A ARG 194.A NH2 GLU 151.A OE1 no hydrogen 2.835 N/A GLN 195.A N GLN 195.A OE1 no hydrogen 2.905 N/A ILE 197.A N ARG 194.A O no hydrogen 3.235 N/A ALA 199.A N SER 196.A O no hydrogen 3.203 N/A LYS 200.A N ILE 197.A O no hydrogen 2.949 N/A ALA 208.A N ALA 204.A O no hydrogen 3.074 N/A SER 209.A N GLY 205.A O no hydrogen 3.139 N/A LEU 210.A N LYS 206.A O no hydrogen 3.104 N/A CYS 211.A N LEU 207.A O no hydrogen 3.131 N/A CYS 211.A SG LEU 207.A O no hydrogen 3.446 N/A SER 212.A N ALA 208.A O no hydrogen 2.953 N/A SER 212.A OG ALA 208.A O no hydrogen 3.427 N/A GLN 213.A N SER 209.A O no hydrogen 2.958 N/A HIS 214.A N LEU 210.A O no hydrogen 2.981 N/A HIS 214.A ND1 LEU 210.A O no hydrogen 3.212 N/A VAL 215.A N CYS 211.A O no hydrogen 2.983 N/A GLU 216.A N SER 212.A O no hydrogen 2.921 N/A ARG 217.A N GLN 213.A O no hydrogen 2.861 N/A LEU 218.A N HIS 214.A O no hydrogen 3.230 N/A GLN 219.A N VAL 215.A O no hydrogen 3.325 N/A GLN 219.A NE2 VAL 215.A O no hydrogen 3.637 N/A ILE 220.A N GLU 216.A O no hydrogen 2.977 N/A PHE 221.A N ARG 217.A O no hydrogen 3.084 N/A HIS 225.A N GLN 222.A O no hydrogen 3.104 N/A HIS 225.A ND1 PHE 221.A O no hydrogen 3.192 N/A