Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a4f_S.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 ILE 37.A O no hydrogen 2.994 N/A VAL 6.A N SER 38.A O no hydrogen 2.802 N/A VAL 7.A N ILE 69.A O no hydrogen 2.972 N/A TRP 8.A N TYR 41.A O no hydrogen 2.874 N/A TRP 8.A NE1 GLU 73.A OE1.A no hydrogen 2.847 N/A ILE 9.A N ALA 71.A O no hydrogen 2.926 N/A HIS 10.A ND1 GLU 13.A OE1.A no hydrogen 3.133 N/A HIS 10.A ND1 GLU 13.A OE1.B no hydrogen 2.771 N/A HIS 10.A ND1 GLU 13.A OE2.B no hydrogen 2.847 N/A HIS 10.A NE2 ASP 42.A OD1 no hydrogen 2.900 N/A GLY 11.A N GLU 73.A O.A no hydrogen 2.884 N/A GLY 11.A N GLU 73.A O.B no hydrogen 2.923 N/A LEU 12.A N ASN 75.A O no hydrogen 2.887 N/A THR 15.A OG1 GLU 13.A OE1.A no hydrogen 3.069 N/A THR 15.A OG1 GLU 13.A OE2.A no hydrogen 3.461 N/A THR 15.A OG1 GLU 13.A OE2.B no hydrogen 2.625 N/A CYS 17.A N GLU 73.A OE2.B no hydrogen 2.816 N/A THR 18.A N GLU 73.A OE2.A no hydrogen 3.015 N/A THR 18.A N GLU 73.A OE2.B no hydrogen 3.282 N/A THR 18.A OG1 GLU 73.A OE1.A no hydrogen 2.497 N/A THR 18.A OG1 GLU 73.A OE1.B no hydrogen 2.721 N/A THR 18.A OG1 GLU 73.A OE2.A no hydrogen 3.242 N/A GLU 19.A N THR 15.A O no hydrogen 3.071 N/A SER 20.A N CYS 16.A O no hydrogen 2.764 N/A SER 20.A OG PRO 148.A O no hydrogen 2.684 N/A PHE 21.A N CYS 17.A O no hydrogen 2.958 N/A ILE 22.A N THR 18.A O no hydrogen 3.125 N/A ARG 23.A N GLU 19.A O no hydrogen 3.265 N/A ARG 23.A N SER 20.A O no hydrogen 2.886 N/A ARG 23.A NH1 GLU 19.A OE1 no hydrogen 2.735 N/A ARG 23.A NH2 GLU 19.A OE1 no hydrogen 3.227 N/A SER 24.A N PHE 21.A O no hydrogen 3.030 N/A SER 24.A OG PRO 27.A O no hydrogen 2.621 N/A SER 24.A OG ASP 151.A OD1 no hydrogen 3.235 N/A SER 24.A OG SER 154.A OG no hydrogen 2.716 N/A ALA 25.A N ASP 151.A OD1 no hydrogen 2.814 N/A VAL 32.A N LEU 28.A O no hydrogen 3.012 N/A ILE 33.A N ALA 29.A O no hydrogen 2.943 N/A LEU 34.A N LYS 30.A O no hydrogen 2.903 N/A SER 35.A N ASP 31.A O no hydrogen 2.869 N/A LEU 36.A N VAL 32.A O no hydrogen 2.999 N/A ILE 37.A N VAL 32.A O no hydrogen 3.031 N/A SER 38.A N ILE 4.A O no hydrogen 2.832 N/A SER 38.A OG ASP 40.A OD1 no hydrogen 2.594 N/A ASP 40.A N VAL 6.A O no hydrogen 2.860 N/A THR 44.A N ASP 42.A OD1 no hydrogen 3.182 N/A LEU 45.A N ASP 42.A O no hydrogen 3.177 N/A MET 46.A N ASP 42.A O no hydrogen 3.052 N/A ALA 53.A N ALA 49.A O no hydrogen 3.059 N/A GLU 54.A N GLY 50.A O no hydrogen 2.882 N/A GLU 55.A N THR 51.A O no hydrogen 2.948 N/A VAL 56.A N GLN 52.A O no hydrogen 3.142 N/A PHE 57.A N ALA 53.A O no hydrogen 2.985 N/A GLU 58.A N GLU 54.A O no hydrogen 2.993 N/A ASP 59.A N GLU 55.A O no hydrogen 2.941 N/A ILE 60.A N VAL 56.A O no hydrogen 2.924 N/A ILE 61.A N PHE 57.A O no hydrogen 3.051 N/A THR 62.A N GLU 58.A O no hydrogen 3.071 N/A THR 62.A OG1 GLU 58.A O no hydrogen 2.789 N/A THR 62.A OG1 GLU 58.A OE2.A no hydrogen 3.241 N/A GLN 63.A N ASP 59.A O no hydrogen 2.847 N/A TYR 64.A N ILE 60.A O no hydrogen 2.949 N/A ASN 65.A N THR 62.A O no hydrogen 3.320 N/A GLY 66.A N GLY 102.A O no hydrogen 2.696 N/A LYS 67.A N TYR 64.A O no hydrogen 2.806 N/A TYR 68.A OH ALA 99.A O no hydrogen 2.603 N/A ILE 69.A N PRO 5.A O no hydrogen 2.935 N/A LEU 70.A N ALA 105.A O no hydrogen 3.024 N/A ALA 71.A N VAL 7.A O no hydrogen 2.787 N/A VAL 72.A N ILE 107.A O no hydrogen 2.869 N/A GLU 73.A N.A ILE 9.A O no hydrogen 3.011 N/A GLU 73.A N.B ILE 9.A O no hydrogen 3.007 N/A ASN 75.A N LEU 12.A O no hydrogen 2.976 N/A ASN 75.A ND2 CYS 112.A O no hydrogen 2.873 N/A ASN 75.A ND2 GLY 116.A O no hydrogen 2.962 N/A LEU 78.A N GLN 127.A O no hydrogen 2.927 N/A GLY 79.A N THR 126.A O no hydrogen 2.948 N/A GLY 82.A N GLY 79.A O no hydrogen 2.816 N/A MET 83.A N GLU 80.A O no hydrogen 2.893 N/A CYS 85.A N GLY 82.A O no hydrogen 3.264 N/A SER 87.A N ARG 90.A O no hydrogen 2.830 N/A ARG 90.A N SER 87.A O no hydrogen 3.115 N/A PHE 92.A N CYS 85.A O no hydrogen 2.817 N/A GLU 94.A N PRO 91.A O no hydrogen 2.941 N/A LYS 95.A NZ TYR 41.A OH no hydrogen 2.775 N/A LYS 95.A NZ SER 87.A OG.B no hydrogen 3.347 N/A LEU 96.A N PHE 92.A O no hydrogen 2.935 N/A LYS 97.A N ILE 93.A O no hydrogen 2.881 N/A ARG 98.A N GLU 94.A O no hydrogen 3.020 N/A ARG 98.A NH1.A GLU 58.A OE1.A no hydrogen 3.170 N/A ARG 98.A NH1.A GLU 58.A OE1.B no hydrogen 2.620 N/A ARG 98.A NH2.A GLU 58.A OE1.A no hydrogen 3.495 N/A ARG 98.A NH2.A GLU 58.A OE1.B no hydrogen 2.732 N/A ARG 98.A NH2.A GLU 58.A OE2.A no hydrogen 3.045 N/A ALA 99.A N LYS 95.A O no hydrogen 2.906 N/A ALA 100.A N LEU 96.A O no hydrogen 2.799 N/A ALA 101.A N LYS 97.A O no hydrogen 3.008 N/A ALA 103.A N ALA 100.A O no hydrogen 3.072 N/A SER 104.A N TYR 68.A O no hydrogen 2.890 N/A SER 104.A OG TYR 68.A O no hydrogen 3.411 N/A ILE 106.A N PRO 139.A O no hydrogen 2.865 N/A ILE 107.A N LEU 70.A O no hydrogen 2.827 N/A ALA 108.A N ILE 141.A O no hydrogen 2.825 N/A TRP 109.A N VAL 72.A O no hydrogen 2.927 N/A GLY 110.A N VAL 143.A O no hydrogen 2.774 N/A THR 111.A N GLY 145.A O no hydrogen 2.934 N/A THR 111.A OG1 CYS 249.A O no hydrogen 2.761 N/A CYS 112.A SG GLN 119.A OE1 no hydrogen 3.717 N/A SER 114.A N GLY 110.A O no hydrogen 3.014 N/A SER 114.A OG ALA 108.A O no hydrogen 3.397 N/A SER 114.A OG GLY 110.A O no hydrogen 2.867 N/A TRP 115.A N THR 111.A O no hydrogen 2.807 N/A GLY 116.A N THR 111.A O no hydrogen 2.897 N/A GLN 119.A N GLN 119.A OE1 no hydrogen 2.749 N/A GLN 119.A NE2 ASN 75.A OD1 no hydrogen 2.992 N/A ALA 120.A N CYS 117.A O no hydrogen 2.939 N/A ALA 121.A N VAL 118.A O no hydrogen 2.993 N/A ARG 122.A N ASP 256.A OD1 no hydrogen 3.441 N/A ARG 122.A N ASP 256.A OD2 no hydrogen 2.858 N/A ASN 124.A N ALA 121.A O no hydrogen 2.766 N/A ASN 124.A ND2 ALA 128.A O no hydrogen 3.135 N/A GLN 127.A N ASN 124.A O no hydrogen 3.151 N/A ALA 128.A N ASN 124.A OD1 no hydrogen 2.872 N/A THR 129.A N PRO 76.A O no hydrogen 2.960 N/A THR 129.A OG1 GLN 127.A O no hydrogen 2.846 N/A ILE 131.A N ALA 113.A O no hydrogen 3.087 N/A LYS 133.A N PRO 130.A O no hydrogen 3.082 N/A VAL 134.A N ILE 131.A O no hydrogen 2.978 N/A ILE 135.A N ILE 131.A O no hydrogen 2.873 N/A LYS 138.A NZ ALA 101.A O no hydrogen 3.144 N/A LYS 138.A NZ ALA 103.A O no hydrogen 2.783 N/A ILE 141.A N ILE 106.A O no hydrogen 2.858 N/A LYS 142.A N GLY 173.A O no hydrogen 2.890 N/A LYS 142.A NZ ASP 132.A OD2 no hydrogen 2.830 N/A LYS 142.A NZ MET 172.A O no hydrogen 2.878 N/A VAL 143.A N ALA 108.A O no hydrogen 2.935 N/A GLY 145.A N THR 111.A OG1 no hydrogen 2.858 N/A MET 153.A N ILE 149.A O no hydrogen 2.986 N/A SER 154.A N PRO 150.A O no hydrogen 3.050 N/A SER 154.A OG SER 24.A OG no hydrogen 2.716 N/A SER 154.A OG PRO 150.A O no hydrogen 3.509 N/A SER 154.A OG ASP 151.A O no hydrogen 3.383 N/A ALA 155.A N ASP 151.A O no hydrogen 2.959 N/A ILE 156.A N VAL 152.A O no hydrogen 2.913 N/A ILE 157.A N MET 153.A O no hydrogen 3.089 N/A THR 158.A N SER 154.A O no hydrogen 2.886 N/A THR 158.A OG1 SER 154.A O no hydrogen 3.403 N/A THR 158.A OG1 ALA 155.A O no hydrogen 3.086 N/A TYR 159.A N ALA 155.A O no hydrogen 2.865 N/A MET 160.A N ILE 156.A O no hydrogen 3.053 N/A VAL 161.A N ILE 157.A O no hydrogen 3.002 N/A THR 162.A N THR 158.A O no hydrogen 2.851 N/A THR 162.A OG1 THR 158.A O no hydrogen 2.990 N/A PHE 163.A N TYR 159.A O no hydrogen 2.857 N/A ASP 170.A N ARG 174.A O no hydrogen 2.909 N/A MET 172.A N ASP 170.A OD1 no hydrogen 2.877 N/A GLY 173.A N ASP 170.A O no hydrogen 3.016 N/A ARG 174.A N ASP 170.A OD1 no hydrogen 2.937 N/A ARG 174.A NE ASP 170.A OD2 no hydrogen 2.831 N/A ARG 174.A NH1 GLU 251.A OE2 no hydrogen 3.016 N/A ARG 174.A NH2 ASP 170.A OD2 no hydrogen 3.272 N/A LEU 176.A N ASP 168.A O no hydrogen 2.980 N/A PHE 178.A N PRO 175.A O no hydrogen 3.293 N/A TYR 179.A N PRO 175.A O no hydrogen 2.992 N/A TYR 179.A OH PRO 144.A O no hydrogen 2.618 N/A ARG 182.A NH1 ASP 185.A OD2 no hydrogen 2.981 N/A ILE 183.A N THR 223.A O no hydrogen 2.804 N/A HIS 184.A N GLY 220.A O no hydrogen 3.313 N/A ASP 185.A N ARG 182.A O no hydrogen 3.030 N/A LYS 186.A N ILE 183.A O no hydrogen 3.132 N/A LYS 186.A NZ GLN 181.A OE1 no hydrogen 2.776 N/A ARG 189.A NE TYR 188.A OH no hydrogen 3.192 N/A ARG 189.A NH1 TYR 211.A O no hydrogen 2.888 N/A ARG 189.A NH2 TYR 188.A OH no hydrogen 3.133 N/A ARG 190.A N CYS 187.A O no hydrogen 3.032 N/A ARG 190.A NE ASP 194.A OD1 no hydrogen 2.966 N/A ARG 190.A NH1 HIS 184.A O no hydrogen 3.073 N/A ARG 190.A NH1 ASP 185.A OD1 no hydrogen 3.253 N/A HIS 192.A N ARG 189.A O no hydrogen 2.925 N/A HIS 192.A ND1 GLU 197.A OE1 no hydrogen 2.850 N/A PHE 193.A N ARG 189.A O no hydrogen 3.259 N/A ASP 194.A N ARG 190.A O no hydrogen 2.888 N/A ALA 195.A N ALA 191.A O no hydrogen 3.107 N/A GLY 196.A N PHE 193.A O no hydrogen 3.168 N/A GLU 197.A N HIS 192.A O no hydrogen 2.818 N/A VAL 199.A N CYS 212.A O no hydrogen 2.950 N/A GLN 200.A N ASP 204.A OD2 no hydrogen 2.908 N/A SER 201.A N ASP 204.A OD2 no hydrogen 3.109 N/A ASP 204.A N SER 201.A O no hydrogen 3.217 N/A ALA 207.A N ASP 204.A OD1 no hydrogen 2.848 N/A ARG 208.A N ASP 204.A O no hydrogen 3.139 N/A ARG 208.A NE ASP 203.A OD1 no hydrogen 2.826 N/A ARG 208.A NH2 ASP 203.A OD1 no hydrogen 3.326 N/A ARG 208.A NH2 ASP 203.A OD2 no hydrogen 3.002 N/A LYS 209.A N ALA 206.A O no hydrogen 3.049 N/A LYS 209.A NZ TYR 211.A OH no hydrogen 3.315 N/A GLY 210.A N ALA 207.A O no hydrogen 3.187 N/A TYR 211.A N ALA 206.A O no hydrogen 3.059 N/A CYS 212.A N GLU 197.A O no hydrogen 3.178 N/A MET 216.A N LEU 213.A O no hydrogen 2.918 N/A GLY 217.A N TYR 214.A O no hydrogen 3.059 N/A CYS 218.A N LEU 213.A O no hydrogen 3.178 N/A LYS 219.A N CYS 246.A O no hydrogen 2.865 N/A LYS 219.A NZ GLY 217.A O no hydrogen 2.822 N/A LYS 219.A NZ SER 259.A O no hydrogen 3.310 N/A LYS 219.A NZ SER 262.A O no hydrogen 2.777 N/A THR 222.A N LYS 219.A O no hydrogen 3.043 N/A THR 222.A OG1 LYS 219.A O no hydrogen 3.365 N/A THR 223.A N GLY 220.A O no hydrogen 3.276 N/A THR 223.A OG1 LYS 219.A O no hydrogen 2.721 N/A TYR 224.A N GLU 251.A OE2 no hydrogen 2.890 N/A ALA 226.A N ASN 225.A OD1 no hydrogen 2.780 N/A SER 228.A OG ILE 183.A O no hydrogen 2.913 N/A SER 229.A N ALA 226.A O no hydrogen 3.132 N/A SER 229.A OG.B ALA 226.A O no hydrogen 3.169 N/A THR 230.A N ALA 226.A O no hydrogen 2.902 N/A ARG 231.A N ALA 226.A O no hydrogen 3.376 N/A ARG 231.A NE.A GLY 235.A O no hydrogen 3.177 N/A ARG 231.A NH2.A GLY 235.A O no hydrogen 2.906 N/A ARG 231.A NH2.A VAL 236.A O no hydrogen 3.256 N/A TRP 232.A N SER 237.A O no hydrogen 2.792 N/A VAL 236.A N TRP 232.A O no hydrogen 2.910 N/A SER 237.A N TRP 232.A O no hydrogen 3.331 N/A SER 237.A OG PHE 238.A O no hydrogen 3.428 N/A SER 237.A OG SER 242.A OG no hydrogen 2.768 N/A GLN 241.A NE2 VAL 236.A O no hydrogen 3.189 N/A SER 242.A N PHE 238.A O no hydrogen 3.197 N/A SER 242.A N PRO 239.A O no hydrogen 3.242 N/A SER 242.A OG SER 237.A OG no hydrogen 2.768 N/A GLY 243.A N ILE 240.A O no hydrogen 2.976 N/A HIS 244.A N PRO 239.A O no hydrogen 3.105 N/A HIS 244.A ND1 GLY 245.A O no hydrogen 2.840 N/A HIS 244.A NE2 TYR 261.A OH no hydrogen 2.729 N/A GLU 251.A N GLY 248.A O no hydrogen 2.927 N/A PHE 254.A N GLU 251.A O no hydrogen 3.238 N/A ASP 256.A N GLY 253.A O no hydrogen 3.047 N/A ARG 257.A NH1 ASN 252.A O no hydrogen 2.820 N/A ARG 257.A NH2 ASN 252.A O no hydrogen 2.654 N/A TYR 261.A N SER 259.A OG no hydrogen 3.071 N/A TYR 261.A OH HIS 244.A NE2 no hydrogen 2.729 N/A SER 262.A N SER 259.A O no hydrogen 3.104 N/A