Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sxj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A N SER 2.A O no hydrogen 3.172 N/A ASN 6.A N PHE 3.A O no hydrogen 2.856 N/A TYR 7.A N ILE 4.A O no hydrogen 2.733 N/A TYR 7.A OH GLN 197.A OE1 no hydrogen 2.645 N/A PHE 8.A N ILE 4.A O no hydrogen 3.095 N/A LYS 9.A N CYS 5.A O no hydrogen 2.914 N/A LYS 9.A NZ ASP 68.A OD2 no hydrogen 2.737 N/A LEU 10.A N TYR 7.A O no hydrogen 3.289 N/A ARG 13.A NH2 GLU 109.A OE2 no hydrogen 3.010 N/A GLN 14.A NE2 PHE 8.A O no hydrogen 3.322 N/A GLN 14.A NE2 THR 45.A OG1 no hydrogen 2.850 N/A GLY 17.A N CYS 188.A O no hydrogen 3.154 N/A SER 18.A OG GLU 20.A OE1 no hydrogen 3.513 N/A ALA 21.A N SER 18.A OG no hydrogen 3.165 N/A THR 22.A N SER 18.A O no hydrogen 3.217 N/A THR 22.A OG1 SER 18.A O no hydrogen 3.446 N/A THR 22.A OG1 GLU 109.A OE1 no hydrogen 3.004 N/A ARG 23.A N PRO 19.A O no hydrogen 3.114 N/A LYS 24.A N GLU 20.A O no hydrogen 2.829 N/A ALA 25.A N ALA 21.A O no hydrogen 2.912 N/A VAL 26.A N THR 22.A O no hydrogen 3.002 N/A SER 27.A N ARG 23.A O no hydrogen 3.187 N/A SER 27.A OG LYS 24.A O no hydrogen 2.543 N/A PHE 28.A N ALA 25.A O no hydrogen 3.043 N/A ILE 29.A N VAL 26.A O no hydrogen 3.027 N/A ALA 36.A N THR 33.A O no hydrogen 2.838 N/A LYS 37.A N ASP 104.A OD2 no hydrogen 2.812 N/A ILE 38.A N GLN 59.A O no hydrogen 2.816 N/A ALA 39.A N LEU 105.A O no hydrogen 2.904 N/A ASP 40.A N THR 61.A O no hydrogen 3.089 N/A ILE 41.A N TRP 107.A O no hydrogen 2.743 N/A GLY 42.A N ILE 63.A O no hydrogen 2.743 N/A CYS 43.A N ILE 63.A O no hydrogen 3.225 N/A CYS 43.A SG GLY 44.A O no hydrogen 3.393 N/A GLY 44.A N ASP 64.A OD1 no hydrogen 3.171 N/A THR 45.A N GLN 14.A OE1 no hydrogen 2.986 N/A THR 45.A OG1 LYS 12.A O no hydrogen 3.531 N/A THR 45.A OG1 GLN 14.A OE1 no hydrogen 3.040 N/A GLY 46.A N CYS 43.A O no hydrogen 3.279 N/A GLN 48.A NE2 ASP 40.A OD2 no hydrogen 2.667 N/A GLN 48.A NE2 CYS 43.A O no hydrogen 3.241 N/A THR 49.A N GLY 46.A O no hydrogen 3.236 N/A THR 49.A OG1 ASP 40.A OD2 no hydrogen 2.351 N/A LEU 50.A N GLY 46.A O no hydrogen 3.301 N/A LEU 52.A N GLN 48.A O no hydrogen 3.078 N/A ALA 53.A N THR 49.A O no hydrogen 2.873 N/A ASP 54.A N LEU 50.A O no hydrogen 3.319 N/A ASP 54.A N PHE 51.A O no hydrogen 2.933 N/A TYR 55.A N LEU 52.A O no hydrogen 3.092 N/A TYR 55.A OH PRO 19.A O no hydrogen 3.229 N/A VAL 56.A N LEU 52.A O no hydrogen 3.157 N/A GLN 59.A N ALA 36.A O no hydrogen 2.855 N/A GLN 59.A NE2 ASP 34.A O no hydrogen 3.688 N/A ILE 60.A N ARG 85.A O no hydrogen 2.742 N/A THR 61.A N ILE 38.A O no hydrogen 2.841 N/A GLY 62.A N LYS 87.A O no hydrogen 3.139 N/A ILE 63.A N ASP 40.A O no hydrogen 2.984 N/A PHE 66.A N ASP 64.A OD2 no hydrogen 3.363 N/A PHE 69.A N PHE 66.A O no hydrogen 3.200 N/A ILE 70.A N PHE 66.A O no hydrogen 3.360 N/A GLU 71.A N PRO 67.A O no hydrogen 2.851 N/A PHE 73.A N PHE 69.A O no hydrogen 2.909 N/A ASN 74.A N ILE 70.A O no hydrogen 3.150 N/A ASN 74.A ND2 GLY 88.A O no hydrogen 3.542 N/A GLU 75.A N GLU 71.A O no hydrogen 3.246 N/A ASN 76.A N ILE 72.A O no hydrogen 2.845 N/A ALA 77.A N PHE 73.A O no hydrogen 2.879 N/A VAL 78.A N ASN 74.A O no hydrogen 2.925 N/A LYS 79.A N GLU 75.A O no hydrogen 3.154 N/A ALA 80.A N ALA 77.A O no hydrogen 3.166 N/A ASN 81.A N VAL 78.A O no hydrogen 3.177 N/A CYS 82.A N ALA 77.A O no hydrogen 3.199 N/A CYS 82.A SG ALA 77.A O no hydrogen 3.812 N/A ASP 84.A N ASP 84.A OD1 no hydrogen 2.526 N/A ARG 85.A NE GLY 58.A O no hydrogen 2.924 N/A ARG 85.A NH1 ALA 53.A O no hydrogen 3.002 N/A ARG 85.A NH2 ALA 53.A O no hydrogen 3.428 N/A ARG 85.A NH2 VAL 56.A O no hydrogen 2.624 N/A ARG 85.A NH2 GLY 58.A O no hydrogen 3.318 N/A VAL 86.A N CYS 82.A O no hydrogen 2.770 N/A LYS 87.A N ILE 60.A O no hydrogen 3.193 N/A GLY 88.A N ASN 74.A OD1 no hydrogen 2.950 N/A ILE 89.A N GLY 62.A O no hydrogen 2.983 N/A GLY 91.A N ASP 64.A O no hydrogen 2.722 N/A SER 92.A OG ASP 94.A OD1 no hydrogen 2.882 N/A GLN 99.A N GLU 102.A OE1 no hydrogen 2.735 N/A GLU 101.A N LYS 126.A O no hydrogen 2.931 N/A GLU 102.A N GLN 99.A O no hydrogen 3.319 N/A LEU 103.A N TYR 127.A O no hydrogen 2.872 N/A ASP 104.A N LYS 37.A O no hydrogen 2.844 N/A LEU 105.A N LYS 37.A O no hydrogen 3.381 N/A ILE 106.A N PHE 133.A O no hydrogen 2.993 N/A TRP 107.A N ALA 39.A O no hydrogen 2.677 N/A TRP 107.A NE1 GLU 109.A OE1 no hydrogen 3.064 N/A SER 108.A N ALA 135.A O no hydrogen 3.172 N/A SER 108.A OG ILE 41.A O no hydrogen 2.738 N/A GLY 110.A N SER 137.A O no hydrogen 3.268 N/A GLY 110.A N SER 137.A OG no hydrogen 2.914 N/A ASN 114.A N ALA 111.A O no hydrogen 2.999 N/A ILE 115.A N ILE 112.A O no hydrogen 3.138 N/A PHE 117.A N TYR 158.A OH no hydrogen 3.182 N/A GLU 118.A N GLU 160.A OE2 no hydrogen 2.924 N/A ARG 119.A NE GLU 123.A OE2 no hydrogen 2.462 N/A GLY 120.A N GLY 116.A O no hydrogen 2.941 N/A MET 121.A N PHE 117.A O no hydrogen 2.981 N/A ASN 122.A N GLU 118.A O no hydrogen 3.118 N/A GLU 123.A N ARG 119.A O no hydrogen 2.803 N/A TRP 124.A N GLY 120.A O no hydrogen 2.834 N/A TYR 127.A N TRP 124.A O no hydrogen 2.899 N/A LEU 128.A N SER 125.A O no hydrogen 2.666 N/A LYS 129.A N LEU 103.A O no hydrogen 2.903 N/A LYS 129.A NZ GLU 101.A O no hydrogen 3.408 N/A LYS 130.A NZ GLU 101.A OE1 no hydrogen 3.468 N/A LYS 130.A NZ GLU 101.A OE2 no hydrogen 2.924 N/A GLY 131.A N LYS 244.A O no hydrogen 2.744 N/A GLY 132.A N LYS 129.A O no hydrogen 3.201 N/A PHE 133.A N ASP 104.A O no hydrogen 3.073 N/A ILE 134.A N GLY 242.A O no hydrogen 2.972 N/A ALA 135.A N ILE 106.A O no hydrogen 2.887 N/A VAL 136.A N TYR 240.A O no hydrogen 2.978 N/A SER 137.A N SER 108.A O no hydrogen 3.029 N/A GLU 138.A N VAL 238.A O no hydrogen 2.684 N/A SER 140.A N GLY 236.A O no hydrogen 2.786 N/A SER 140.A OG TYR 240.A OH no hydrogen 3.008 N/A TRP 141.A N SER 162.A O no hydrogen 3.155 N/A PHE 142.A N TYR 234.A O no hydrogen 2.976 N/A THR 143.A OG1 GLU 145.A O no hydrogen 2.962 N/A GLU 151.A N PRO 147.A O no hydrogen 3.180 N/A ASP 152.A N ALA 148.A O no hydrogen 2.942 N/A PHE 153.A N GLU 149.A O no hydrogen 3.226 N/A TRP 154.A N ILE 150.A O no hydrogen 3.406 N/A MET 155.A N GLU 151.A O no hydrogen 2.975 N/A ASP 156.A N ASP 152.A O no hydrogen 3.035 N/A ALA 157.A N PHE 153.A O no hydrogen 2.936 N/A TYR 158.A N TRP 154.A O no hydrogen 2.486 N/A TYR 158.A OH GLU 138.A OE1 no hydrogen 2.666 N/A ILE 161.A N TYR 158.A O no hydrogen 3.273 N/A THR 166.A N VAL 163.A O no hydrogen 3.006 N/A CYS 167.A N VAL 163.A O no hydrogen 3.353 N/A CYS 167.A SG SER 140.A OG no hydrogen 3.677 N/A CYS 167.A SG SER 162.A OG no hydrogen 3.676 N/A CYS 167.A SG VAL 163.A O no hydrogen 3.986 N/A CYS 167.A SG TYR 240.A OH no hydrogen 3.479 N/A ILE 168.A N ILE 164.A O no hydrogen 3.237 N/A ASP 169.A N PRO 165.A O no hydrogen 3.141 N/A LYS 170.A N THR 166.A O no hydrogen 3.075 N/A MET 171.A N CYS 167.A O no hydrogen 3.018 N/A MET 171.A N ILE 168.A O no hydrogen 3.064 N/A GLU 172.A N ILE 168.A O no hydrogen 3.321 N/A ARG 173.A N ASP 169.A O no hydrogen 3.421 N/A ARG 173.A NH1 ASP 169.A OD1 no hydrogen 2.978 N/A ALA 174.A N LYS 170.A O no hydrogen 3.293 N/A GLY 175.A N GLU 172.A O no hydrogen 2.698 N/A TYR 176.A N MET 171.A O no hydrogen 2.920 N/A TYR 176.A OH MET 121.A O no hydrogen 3.194 N/A THR 177.A N GLN 243.A O no hydrogen 2.900 N/A THR 177.A OG1 GLN 243.A O no hydrogen 3.462 N/A THR 179.A N THR 177.A O no hydrogen 2.566 N/A THR 179.A OG1 THR 177.A O no hydrogen 3.307 N/A ALA 180.A N ILE 241.A O no hydrogen 3.132 N/A PHE 182.A N PHE 239.A O no hydrogen 3.059 N/A LEU 184.A N TYR 237.A O no hydrogen 2.891 N/A CYS 188.A N PRO 185.A O no hydrogen 2.910 N/A CYS 188.A SG SER 18.A OG no hydrogen 3.440 N/A TRP 189.A N GLU 186.A O no hydrogen 3.015 N/A THR 190.A N GLU 186.A O no hydrogen 3.280 N/A THR 190.A OG1 GLU 186.A O no hydrogen 3.500 N/A HIS 192.A N ASN 187.A O no hydrogen 3.172 N/A TYR 193.A N TRP 189.A O no hydrogen 3.061 N/A TYR 193.A OH GLU 224.A OE2 no hydrogen 3.294 N/A PHE 194.A N TRP 189.A O no hydrogen 2.824 N/A ALA 195.A N THR 190.A O no hydrogen 2.781 N/A GLN 197.A N PHE 194.A O no hydrogen 2.676 N/A GLN 197.A NE2 TYR 193.A O no hydrogen 3.543 N/A ASP 198.A N ALA 195.A O no hydrogen 3.138 N/A GLU 199.A N PRO 196.A O no hydrogen 3.327 N/A ARG 201.A N ASP 198.A O no hydrogen 3.363 N/A ARG 201.A NH2 ASP 198.A OD1 no hydrogen 3.236 N/A THR 203.A OG1 VAL 200.A O no hydrogen 3.489 N/A MET 205.A N ARG 201.A O no hydrogen 2.686 N/A LYS 206.A N GLU 202.A O no hydrogen 3.149 N/A HIS 208.A N PHE 204.A O no hydrogen 3.289 N/A ALA 209.A N LYS 206.A O no hydrogen 3.501 N/A ASN 211.A N HIS 208.A O no hydrogen 2.995 N/A ALA 214.A N ASN 211.A OD1 no hydrogen 3.361 N/A MET 215.A N ASN 211.A O no hydrogen 3.094 N/A ASP 216.A N LYS 212.A O no hydrogen 3.022 N/A PHE 217.A N THR 213.A O no hydrogen 3.047 N/A MET 218.A N ALA 214.A O no hydrogen 3.001 N/A LYS 219.A N MET 215.A O no hydrogen 2.835 N/A GLY 220.A N ASP 216.A O no hydrogen 3.087 N/A GLN 221.A N PHE 217.A O no hydrogen 2.864 N/A GLN 221.A NE2 GLN 197.A OE1 no hydrogen 3.492 N/A GLN 222.A N MET 218.A O no hydrogen 3.032 N/A TYR 223.A N LYS 219.A O no hydrogen 2.864 N/A TYR 223.A N GLY 220.A O no hydrogen 3.043 N/A TYR 223.A OH GLU 149.A OE2 no hydrogen 2.653 N/A GLU 224.A N GLY 220.A O no hydrogen 3.068 N/A ARG 225.A NH1 ASP 198.A OD2 no hydrogen 2.861 N/A SER 226.A N GLN 222.A O no hydrogen 3.365 N/A SER 226.A OG GLN 222.A O no hydrogen 2.934 N/A LEU 227.A N TYR 223.A O no hydrogen 3.017 N/A TYR 228.A N GLU 224.A O no hydrogen 2.866 N/A SER 229.A N ARG 225.A O no hydrogen 2.852 N/A SER 229.A OG ARG 225.A O no hydrogen 3.065 N/A LYS 230.A N SER 226.A O no hydrogen 3.156 N/A LYS 230.A NZ GLU 149.A OE1 no hydrogen 3.325 N/A TYR 231.A N LEU 227.A O no hydrogen 2.788 N/A TYR 231.A OH GLU 149.A OE1 no hydrogen 2.849 N/A LYS 232.A NZ GLU 186.A OE2 no hydrogen 3.267 N/A TYR 234.A N TYR 231.A O no hydrogen 2.871 N/A GLY 236.A N SER 140.A O no hydrogen 3.279 N/A VAL 238.A N GLU 138.A O no hydrogen 2.597 N/A PHE 239.A N PHE 182.A O no hydrogen 2.879 N/A TYR 240.A N VAL 136.A O no hydrogen 2.686 N/A TYR 240.A OH SER 140.A OG no hydrogen 3.008 N/A ILE 241.A N ALA 180.A O no hydrogen 2.855 N/A GLY 242.A N ILE 134.A O no hydrogen 2.835 N/A GLN 243.A N THR 177.A O no hydrogen 3.132 N/A LYS 244.A N GLY 132.A O no hydrogen 2.837 N/A LYS 244.A NZ SER 125.A O no hydrogen 2.958 N/A LYS 244.A NZ LEU 128.A O no hydrogen 2.567 N/A ARG 245.A N GLY 175.A O no hydrogen 2.994 N/A