Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xg9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ILE 71.A O no hydrogen 2.996 N/A ARG 5.A NH1 ARG 5.A O no hydrogen 2.698 N/A LYS 6.A N ASP 4.A OD2 no hydrogen 2.994 N/A LEU 7.A N ASP 4.A OD2 no hydrogen 3.222 N/A LEU 8.A N ARG 5.A O no hydrogen 3.310 N/A THR 9.A N TYR 27.A O no hydrogen 2.985 N/A GLU 11.A N LYS 25.A O no hydrogen 3.208 N/A LEU 15.A N VAL 23.A O no hydrogen 2.831 N/A SER 17.A OG GLU 14.A OE1 no hydrogen 2.646 N/A SER 17.A OG GLY 16.A O no hydrogen 2.906 N/A GLY 18.A N GLY 21.A O no hydrogen 3.307 N/A LYS 24.A N VAL 39.A O no hydrogen 2.966 N/A GLY 26.A N VAL 37.A O no hydrogen 2.781 N/A TYR 27.A N THR 9.A O no hydrogen 2.826 N/A TYR 27.A OH GLU 11.A OE1 no hydrogen 2.699 N/A TYR 28.A N LYS 35.A O no hydrogen 2.949 N/A GLN 29.A N LEU 7.A O no hydrogen 2.731 N/A MET 30.A N VAL 33.A O no hydrogen 3.145 N/A LYS 35.A N TYR 28.A O no hydrogen 2.906 N/A VAL 37.A N GLY 26.A O no hydrogen 2.829 N/A ALA 38.A N MET 81.A O no hydrogen 2.897 N/A VAL 39.A N LYS 24.A O no hydrogen 2.860 N/A LYS 40.A N LEU 79.A O no hydrogen 2.704 N/A LYS 40.A NZ GLU 53.A OE1 no hydrogen 2.623 N/A ILE 41.A N THR 22.A O no hydrogen 3.042 N/A LEU 42.A N TRP 77.A O no hydrogen 3.262 N/A LYS 43.A N PHE 20.A O no hydrogen 3.353 N/A ASP 48.A N PRO 44.A O no hydrogen 3.277 N/A ASP 48.A N ALA 45.A O no hydrogen 3.144 N/A GLU 49.A N ALA 45.A O no hydrogen 3.290 N/A LEU 50.A N LEU 46.A O no hydrogen 3.355 N/A LEU 51.A N LYS 47.A O no hydrogen 3.307 N/A ALA 52.A N ASP 48.A O no hydrogen 3.141 N/A GLU 53.A N GLU 49.A O no hydrogen 2.755 N/A ALA 54.A N LEU 50.A O no hydrogen 2.816 N/A ASN 55.A N LEU 51.A O no hydrogen 3.060 N/A VAL 56.A N ALA 52.A O no hydrogen 2.994 N/A MET 57.A N GLU 53.A O no hydrogen 3.133 N/A GLN 58.A N ALA 54.A O no hydrogen 2.839 N/A GLN 59.A N VAL 56.A O no hydrogen 3.152 N/A GLN 59.A NE2 ASN 55.A O no hydrogen 2.738 N/A LEU 60.A N MET 57.A O no hydrogen 3.295 N/A ASP 61.A N TYR 117.A OH no hydrogen 2.996 N/A TYR 64.A N ASN 62.A OD1 no hydrogen 2.756 N/A ILE 65.A N ASN 62.A O no hydrogen 3.208 N/A VAL 66.A N ILE 143.A O no hydrogen 2.850 N/A ILE 69.A N VAL 80.A O no hydrogen 2.903 N/A GLY 70.A N VAL 80.A O no hydrogen 3.071 N/A ILE 71.A N VAL 1.A O no hydrogen 2.785 N/A CYS 72.A N MET 78.A O no hydrogen 2.872 N/A CYS 72.A SG LEU 3.A O no hydrogen 3.489 N/A LEU 79.A N LYS 40.A O no hydrogen 2.885 N/A VAL 80.A N GLY 70.A O no hydrogen 2.751 N/A MET 81.A N ALA 38.A O no hydrogen 2.729 N/A GLU 82.A N ARG 67.A O no hydrogen 2.861 N/A MET 83.A N THR 36.A O no hydrogen 3.376 N/A GLY 87.A N ALA 84.A O no hydrogen 3.122 N/A LEU 89.A N VAL 133.A O no hydrogen 3.015 N/A LYS 91.A NZ GLN 94.A OE1 no hydrogen 2.795 N/A TYR 92.A N PRO 88.A O no hydrogen 3.300 N/A TYR 92.A OH GLN 138.A OE1 no hydrogen 2.806 N/A LEU 93.A N LEU 89.A O no hydrogen 2.995 N/A GLN 94.A N ASN 90.A O no hydrogen 2.713 N/A GLN 94.A NE2 GLY 196.A O no hydrogen 3.389 N/A GLN 95.A N LYS 91.A O no hydrogen 3.026 N/A ASN 96.A ND2 TYR 92.A O no hydrogen 3.000 N/A ASN 103.A N LYS 100.A O no hydrogen 2.796 N/A ASN 103.A ND2 GLN 138.A O no hydrogen 3.184 N/A ILE 104.A N LYS 100.A O no hydrogen 3.322 N/A ILE 105.A N ASP 101.A O no hydrogen 2.671 N/A GLU 106.A N LYS 102.A O no hydrogen 3.050 N/A LEU 107.A N ASN 103.A O no hydrogen 2.809 N/A VAL 108.A N ILE 104.A O no hydrogen 2.863 N/A HIS 109.A N ILE 105.A O no hydrogen 3.111 N/A HIS 109.A NE2 GLU 250.A OE2 no hydrogen 2.595 N/A GLN 110.A N GLU 106.A O no hydrogen 3.063 N/A GLN 110.A NE2 HIS 139.A O no hydrogen 2.850 N/A VAL 111.A N LEU 107.A O no hydrogen 3.330 N/A SER 112.A N VAL 108.A O no hydrogen 3.055 N/A SER 112.A OG HIS 109.A O no hydrogen 2.620 N/A MET 113.A N HIS 109.A O no hydrogen 2.924 N/A GLY 114.A N GLN 110.A O no hydrogen 2.916 N/A MET 115.A N VAL 111.A O no hydrogen 2.674 N/A LYS 116.A N SER 112.A O no hydrogen 2.722 N/A LYS 116.A NZ GLU 250.A OE1 no hydrogen 3.199 N/A TYR 117.A N MET 113.A O no hydrogen 3.027 N/A LEU 118.A N GLY 114.A O no hydrogen 3.169 N/A GLU 119.A N MET 115.A O no hydrogen 2.806 N/A GLU 120.A N LYS 116.A O no hydrogen 3.001 N/A SER 121.A N TYR 117.A O no hydrogen 2.947 N/A SER 121.A OG TYR 117.A O no hydrogen 2.840 N/A ASN 122.A N GLU 119.A O no hydrogen 2.916 N/A PHE 123.A N LEU 118.A O no hydrogen 3.088 N/A VAL 124.A N LYS 150.A O no hydrogen 2.787 N/A HIS 125.A N ASP 181.A OD2 no hydrogen 2.794 N/A HIS 125.A NE2 SER 144.A O no hydrogen 2.936 N/A ARG 126.A N ASP 181.A OD1 no hydrogen 3.174 N/A ARG 126.A NH1 LEU 148.A O no hydrogen 2.567 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 3.240 N/A ALA 130.A N GLU 191.A OE1 no hydrogen 3.396 N/A ARG 131.A NH2 ASP 127.A OD1 no hydrogen 3.092 N/A ASN 132.A N ALA 129.A O no hydrogen 2.989 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 2.794 N/A VAL 133.A N ALA 130.A O no hydrogen 3.090 N/A LEU 134.A N LYS 142.A O no hydrogen 2.729 N/A LEU 135.A N GLY 87.A O no hydrogen 2.768 N/A VAL 136.A N TYR 140.A O no hydrogen 2.720 N/A GLN 138.A NE2 ASN 103.A OD1 no hydrogen 2.724 N/A GLN 138.A NE2 HIS 139.A NE2 no hydrogen 3.414 N/A HIS 139.A ND1 GLU 106.A OE1 no hydrogen 3.274 N/A TYR 140.A N THR 137.A O no hydrogen 3.283 N/A TYR 140.A OH PRO 63.A O no hydrogen 2.561 N/A ALA 141.A N GLN 110.A OE1 no hydrogen 2.929 N/A LYS 142.A N LEU 134.A O no hydrogen 2.692 N/A LYS 142.A NZ PRO 63.A O no hydrogen 3.384 N/A LYS 142.A NZ ILE 65.A O no hydrogen 3.131 N/A LYS 142.A NZ GLU 82.A OE2 no hydrogen 3.444 N/A ILE 143.A N TYR 64.A O no hydrogen 2.681 N/A SER 144.A N ASN 132.A O no hydrogen 2.885 N/A SER 144.A OG ASN 132.A O no hydrogen 2.907 N/A SER 144.A OG ASP 145.A OD1 no hydrogen 2.822 N/A SER 149.A N PHE 146.A O no hydrogen 3.146 N/A SER 149.A OG HIS 125.A O no hydrogen 3.291 N/A LYS 150.A N VAL 124.A O no hydrogen 2.952 N/A LEU 152.A N ASN 122.A O no hydrogen 2.814 N/A ARG 153.A NE ASP 155.A OD1 no hydrogen 3.196 N/A ARG 153.A NH1 ASP 155.A OD1 no hydrogen 3.196 N/A ARG 153.A NH1 ASP 155.A OD2 no hydrogen 3.044 N/A GLU 156.A N ARG 153.A O no hydrogen 3.166 N/A TYR 159.A N PHE 176.A O no hydrogen 2.995 N/A LYS 160.A NZ TYR 173.A O no hydrogen 2.951 N/A ALA 161.A N TYR 174.A O no hydrogen 3.396 N/A LYS 164.A NZ TYR 200.A O no hydrogen 3.052 N/A LYS 164.A NZ MET 203.A O no hydrogen 3.171 N/A TRP 165.A N PRO 162.A O no hydrogen 3.223 N/A TRP 165.A NE1 GLU 191.A OE1 no hydrogen 2.675 N/A TYR 166.A N VAL 163.A O no hydrogen 3.285 N/A TYR 166.A OH ARG 126.A O no hydrogen 2.872 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 2.983 N/A CYS 170.A N ALA 167.A O no hydrogen 3.071 N/A CYS 170.A SG LYS 175.A O no hydrogen 3.286 N/A ILE 171.A N PRO 168.A O no hydrogen 2.992 N/A ASN 172.A N PRO 168.A O no hydrogen 3.058 N/A TYR 173.A N GLU 169.A O no hydrogen 3.091 N/A TYR 174.A N CYS 170.A O no hydrogen 3.190 N/A PHE 176.A N TYR 159.A O no hydrogen 2.851 N/A SER 177.A N SER 180.A OG no hydrogen 3.010 N/A LYS 179.A NZ VAL 240.A O no hydrogen 3.001 N/A LYS 179.A NZ ARG 243.A O no hydrogen 2.642 N/A SER 180.A N SER 177.A OG no hydrogen 2.950 N/A SER 180.A OG SER 177.A O no hydrogen 2.828 N/A ASP 181.A N SER 177.A O no hydrogen 3.162 N/A VAL 182.A N SER 178.A O no hydrogen 2.844 N/A TRP 183.A N LYS 179.A O no hydrogen 3.268 N/A SER 184.A N SER 180.A O no hydrogen 3.202 N/A SER 184.A OG LEU 128.A O no hydrogen 3.523 N/A SER 184.A OG TRP 165.A O no hydrogen 2.549 N/A PHE 185.A N ASP 181.A O no hydrogen 2.837 N/A GLY 186.A N VAL 182.A O no hydrogen 3.046 N/A VAL 187.A N TRP 183.A O no hydrogen 3.182 N/A LEU 188.A N SER 184.A O no hydrogen 2.723 N/A MET 189.A N PHE 185.A O no hydrogen 2.781 N/A TRP 190.A N GLY 186.A O no hydrogen 3.095 N/A TRP 190.A NE1 GLY 219.A O no hydrogen 3.181 N/A GLU 191.A N VAL 187.A O no hydrogen 2.957 N/A ALA 192.A N LEU 188.A O no hydrogen 2.970 N/A PHE 193.A N MET 189.A O no hydrogen 3.003 N/A SER 194.A N TRP 190.A O no hydrogen 2.890 N/A SER 194.A OG TRP 190.A O no hydrogen 2.917 N/A TYR 195.A N ALA 192.A O no hydrogen 2.901 N/A TYR 195.A OH VAL 99.A O no hydrogen 2.492 N/A GLY 196.A N GLU 191.A O no hydrogen 2.929 N/A MET 203.A N TYR 200.A O no hydrogen 3.449 N/A LYS 204.A N GLU 207.A OE1 no hydrogen 3.244 N/A VAL 208.A N LYS 204.A O no hydrogen 3.154 N/A THR 209.A N GLY 205.A O no hydrogen 3.002 N/A THR 209.A OG1 GLY 205.A O no hydrogen 3.394 N/A ALA 210.A N SER 206.A O no hydrogen 2.924 N/A MET 211.A N GLU 207.A O no hydrogen 3.113 N/A LEU 212.A N VAL 208.A O no hydrogen 3.173 N/A GLU 213.A N THR 209.A O no hydrogen 3.347 N/A LYS 214.A N MET 211.A O no hydrogen 3.124 N/A GLY 215.A N LEU 212.A O no hydrogen 2.957 N/A GLU 216.A N MET 211.A O no hydrogen 3.214 N/A ARG 217.A NE TRP 236.A O no hydrogen 2.940 N/A ARG 217.A NH1 LEU 212.A O no hydrogen 3.334 N/A ARG 217.A NH1 GLU 216.A O no hydrogen 2.787 N/A ARG 217.A NH2 TRP 236.A O no hydrogen 2.927 N/A CYS 220.A SG PRO 221.A O no hydrogen 3.491 N/A CYS 224.A N PRO 221.A O no hydrogen 3.159 N/A CYS 224.A SG PRO 225.A O no hydrogen 3.285 N/A GLU 227.A N GLU 227.A OE1 no hydrogen 2.795 N/A TYR 229.A N PRO 225.A O no hydrogen 3.235 N/A TYR 229.A OH MET 218.A O no hydrogen 2.558 N/A ASP 230.A N ARG 226.A O no hydrogen 3.096 N/A LEU 231.A N GLU 227.A O no hydrogen 3.182 N/A MET 232.A N MET 228.A O no hydrogen 3.232 N/A ASN 233.A N TYR 229.A O no hydrogen 3.242 N/A ASN 233.A ND2 TYR 229.A O no hydrogen 3.372 N/A LEU 234.A N ASP 230.A O no hydrogen 3.051 N/A CYS 235.A N LEU 231.A O no hydrogen 2.799 N/A CYS 235.A SG LEU 231.A O no hydrogen 3.333 N/A TRP 236.A N MET 232.A O no hydrogen 2.806 N/A THR 237.A N LEU 234.A O no hydrogen 3.231 N/A THR 237.A OG1 LEU 234.A O no hydrogen 2.816 N/A ASN 242.A N ASP 239.A OD2 no hydrogen 2.924 N/A ARG 243.A N ASP 239.A O no hydrogen 3.087 N/A ARG 243.A NE THR 237.A O no hydrogen 2.745 N/A ARG 243.A NH1 GLU 169.A OE1 no hydrogen 3.503 N/A ARG 243.A NH1 LYS 179.A O no hydrogen 3.011 N/A ARG 243.A NH2 GLU 169.A OE1 no hydrogen 3.153 N/A ARG 243.A NH2 THR 237.A O no hydrogen 2.990 N/A ARG 243.A NH2 TYR 238.A O no hydrogen 3.319 N/A PHE 246.A N GLU 119.A OE2 no hydrogen 2.833 N/A VAL 249.A N GLY 245.A O no hydrogen 3.201 N/A GLU 250.A N PHE 246.A O no hydrogen 2.729 N/A LEU 251.A N ALA 247.A O no hydrogen 2.912 N/A ARG 252.A N ALA 248.A O no hydrogen 3.333 N/A LEU 253.A N VAL 249.A O no hydrogen 3.084 N/A ARG 254.A N GLU 250.A O no hydrogen 3.020 N/A ASN 255.A N LEU 251.A O no hydrogen 2.881 N/A TYR 256.A N ARG 252.A O no hydrogen 2.821 N/A TYR 257.A N LEU 253.A O no hydrogen 2.981 N/A TYR 257.A N ARG 254.A O no hydrogen 3.132 N/A TYR 258.A N ARG 254.A O no hydrogen 3.257 N/A