Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qfo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N PHE 206.A O no hydrogen 2.801 N/A LYS 3.A N ASP 30.A OD2 no hydrogen 2.679 N/A LYS 3.A NZ LEU 27.A O no hydrogen 2.815 N/A ILE 4.A N LEU 204.A O no hydrogen 2.709 N/A ALA 5.A N GLU 31.A O no hydrogen 3.011 N/A LEU 6.A N MET 202.A O no hydrogen 2.840 N/A LEU 7.A N TRP 33.A O no hydrogen 2.729 N/A SER 8.A OG ASP 9.A OD1 no hydrogen 2.711 N/A ASP 9.A N GLY 36.A O no hydrogen 2.813 N/A HIS 11.A N ASP 37.A O no hydrogen 2.972 N/A HIS 11.A ND1 MET 40.A O no hydrogen 2.861 N/A HIS 11.A NE2 HIS 164.A NE2 no hydrogen 3.086 N/A GLY 12.A N ILE 38.A O no hydrogen 2.795 N/A ASN 13.A N ILE 10.A O no hydrogen 2.995 N/A ASN 13.A ND2 GLY 184.A O no hydrogen 3.116 N/A ASN 13.A ND2 TYR 221.A OH no hydrogen 3.184 N/A THR 14.A OG1 GLY 12.A O no hydrogen 3.539 N/A THR 14.A OG1 THR 43.A OG1 no hydrogen 2.840 N/A THR 15.A N GLU 226.A OE1 no hydrogen 3.025 N/A THR 15.A OG1 GLU 226.A OE1 no hydrogen 2.640 N/A ALA 16.A N ASN 13.A OD1 no hydrogen 3.252 N/A LEU 17.A N ASN 13.A O no hydrogen 2.955 N/A GLU 18.A N THR 14.A O no hydrogen 3.043 N/A ALA 19.A N THR 15.A O no hydrogen 3.095 N/A VAL 20.A N ALA 16.A O no hydrogen 2.929 N/A LEU 21.A N LEU 17.A O no hydrogen 2.829 N/A ALA 22.A N GLU 18.A O no hydrogen 3.062 N/A ASP 23.A N ALA 19.A O no hydrogen 2.989 N/A ALA 24.A N VAL 20.A O no hydrogen 2.937 N/A ARG 25.A N LEU 21.A O no hydrogen 3.087 N/A GLN 26.A N ALA 22.A O no hydrogen 3.118 N/A LEU 27.A N ASP 23.A O no hydrogen 3.108 N/A GLY 28.A N ARG 25.A O no hydrogen 3.077 N/A VAL 29.A N ALA 24.A O no hydrogen 3.213 N/A ASP 30.A N LYS 3.A O no hydrogen 2.876 N/A GLU 31.A N LYS 3.A O no hydrogen 3.222 N/A TYR 32.A N PRO 56.A O no hydrogen 3.041 N/A TRP 33.A N ALA 5.A O no hydrogen 2.915 N/A TRP 33.A NE1 THR 58.A OG1 no hydrogen 3.071 N/A LEU 34.A N ALA 59.A O no hydrogen 2.962 N/A LEU 35.A N LEU 7.A O no hydrogen 2.851 N/A ASP 37.A N GLU 66.A OE1 no hydrogen 2.943 N/A ILE 38.A N GLU 66.A OE2 no hydrogen 2.962 N/A GLY 42.A N HIS 11.A O no hydrogen 2.953 N/A THR 43.A OG1 GLY 12.A O no hydrogen 3.422 N/A THR 43.A OG1 THR 14.A OG1 no hydrogen 2.840 N/A THR 43.A OG1 GLU 226.A OE1 no hydrogen 3.457 N/A THR 43.A OG1 GLU 226.A OE2 no hydrogen 2.642 N/A GLY 44.A N GLY 12.A O no hydrogen 2.699 N/A ARG 45.A NH2 TYR 93.A O no hydrogen 2.791 N/A ARG 45.A NH2 GLU 96.A OE1 no hydrogen 3.207 N/A ARG 46.A N GLU 97.A OE1 no hydrogen 3.126 N/A ARG 46.A NH1 GLU 102.A OE2 no hydrogen 2.564 N/A ARG 46.A NH2 GLU 97.A O no hydrogen 3.160 N/A ARG 46.A NH2 GLU 102.A OE1 no hydrogen 2.822 N/A ARG 47.A NE GLU 18.A OE2 no hydrogen 2.714 N/A ARG 47.A NH2 GLU 18.A OE2 no hydrogen 2.964 N/A ILE 48.A N ARG 45.A O no hydrogen 3.049 N/A LEU 49.A N ARG 45.A O no hydrogen 3.382 N/A ASP 50.A N ARG 46.A O no hydrogen 2.968 N/A LEU 51.A N ARG 47.A O no hydrogen 3.104 N/A LEU 52.A N ILE 48.A O no hydrogen 3.117 N/A ASP 53.A N LEU 49.A O no hydrogen 2.874 N/A GLN 54.A N ASP 50.A O no hydrogen 3.227 N/A GLN 54.A N LEU 51.A O no hydrogen 3.332 N/A LEU 55.A N LEU 52.A O no hydrogen 2.922 N/A ILE 57.A N LEU 55.A O no hydrogen 3.030 N/A THR 58.A N TYR 32.A O no hydrogen 3.069 N/A THR 58.A OG1 GLU 31.A OE1 no hydrogen 2.672 N/A VAL 61.A N LEU 34.A O no hydrogen 3.126 N/A LEU 62.A N PRO 110.A O no hydrogen 2.955 N/A GLY 63.A N GLU 66.A OE1 no hydrogen 3.026 N/A TRP 65.A N ASP 37.A OD1 no hydrogen 2.944 N/A GLU 66.A N GLY 63.A O no hydrogen 3.207 N/A SER 68.A N ASN 64.A O no hydrogen 2.999 N/A SER 68.A OG ASN 64.A O no hydrogen 3.297 N/A LEU 69.A N TRP 65.A O no hydrogen 2.981 N/A TRP 70.A N GLU 66.A O no hydrogen 3.122 N/A TRP 70.A NE1 GLU 104.A OE2 no hydrogen 3.241 N/A HIS 71.A N ASP 67.A O no hydrogen 2.848 N/A GLY 72.A N SER 68.A O no hydrogen 2.988 N/A VAL 73.A N LEU 69.A O no hydrogen 3.074 N/A ARG 74.A N HIS 71.A O no hydrogen 3.271 N/A ARG 74.A NE GLU 76.A OE2 no hydrogen 2.777 N/A ARG 74.A NH2 GLU 76.A OE2 no hydrogen 3.277 N/A LYS 75.A N GLY 72.A O no hydrogen 3.294 N/A GLU 76.A N HIS 71.A O no hydrogen 3.281 N/A ASP 78.A N GLN 84.A OE1 no hydrogen 2.732 N/A THR 80.A N ASP 78.A OD2 no hydrogen 2.977 N/A THR 80.A OG1 ASP 78.A OD1 no hydrogen 3.103 N/A THR 80.A OG1 ASP 78.A OD2 no hydrogen 2.756 N/A ARG 81.A N ASP 78.A O no hydrogen 3.005 N/A ARG 81.A NH1 THR 80.A OG1 no hydrogen 2.602 N/A GLN 84.A N ARG 81.A O no hydrogen 2.913 N/A ARG 85.A N ARG 81.A O no hydrogen 2.949 N/A ARG 85.A NH1 SER 79.A O no hydrogen 2.801 N/A TYR 86.A N PRO 82.A O no hydrogen 3.007 N/A LEU 87.A N SER 83.A O no hydrogen 3.156 N/A LEU 88.A N GLN 84.A O no hydrogen 2.759 N/A ARG 89.A N ARG 85.A O no hydrogen 3.193 N/A GLN 90.A N TYR 86.A O no hydrogen 3.209 N/A GLN 90.A NE2 PRO 236.A O no hydrogen 3.550 N/A CYS 91.A N LEU 87.A O no hydrogen 2.907 N/A CYS 91.A SG SER 68.A O no hydrogen 3.922 N/A CYS 91.A SG LEU 87.A O no hydrogen 3.307 N/A GLN 92.A N LEU 88.A O no hydrogen 2.952 N/A TYR 93.A N ARG 89.A O no hydrogen 2.979 N/A TYR 93.A OH THR 43.A O no hydrogen 2.690 N/A VAL 94.A N GLN 90.A O no hydrogen 2.982 N/A LEU 95.A N CYS 91.A O no hydrogen 2.805 N/A GLU 96.A N TYR 93.A O no hydrogen 3.268 N/A GLU 97.A N VAL 94.A O no hydrogen 3.139 N/A ILE 98.A N VAL 94.A O no hydrogen 3.011 N/A SER 99.A N GLU 102.A OE1 no hydrogen 2.989 N/A SER 99.A OG GLU 102.A OE1 no hydrogen 2.970 N/A GLU 102.A N SER 99.A OG no hydrogen 3.164 N/A ILE 103.A N SER 99.A O no hydrogen 3.119 N/A GLU 104.A N LEU 100.A O no hydrogen 2.964 N/A VAL 105.A N GLU 101.A O no hydrogen 3.275 N/A LEU 106.A N GLU 102.A O no hydrogen 3.107 N/A HIS 107.A N ILE 103.A O no hydrogen 2.932 N/A HIS 107.A N GLU 104.A O no hydrogen 3.223 N/A ASN 108.A N GLU 104.A O no hydrogen 2.896 N/A ASN 108.A N VAL 105.A O no hydrogen 3.195 N/A GLN 109.A N HIS 107.A O no hydrogen 2.999 N/A GLN 109.A NE2 VAL 105.A O no hydrogen 3.069 N/A ILE 113.A N ILE 124.A O no hydrogen 2.977 N/A ARG 115.A N VAL 122.A O no hydrogen 2.997 N/A ARG 115.A NE THR 58.A O no hydrogen 2.906 N/A ARG 115.A NH1 HIS 114.A O no hydrogen 2.657 N/A ARG 115.A NH2 THR 58.A O no hydrogen 3.004 N/A GLN 116.A NE2 GLY 118.A O no hydrogen 3.004 N/A PHE 117.A N LEU 120.A O no hydrogen 2.779 N/A LEU 120.A N PHE 117.A O no hydrogen 2.976 N/A THR 121.A N ASP 156.A OD2 no hydrogen 2.723 N/A THR 121.A OG1 GLN 116.A OE1 no hydrogen 2.492 N/A VAL 122.A N ARG 115.A O no hydrogen 2.836 N/A GLY 123.A N ILE 157.A O no hydrogen 2.819 N/A ILE 124.A N ILE 113.A O no hydrogen 2.949 N/A SER 125.A N VAL 159.A O no hydrogen 3.280 N/A SER 125.A OG HIS 127.A O no hydrogen 2.663 N/A HIS 126.A ND1 LEU 35.A O no hydrogen 2.792 N/A HIS 127.A ND1 TRP 133.A O no hydrogen 2.836 N/A LYS 131.A N LEU 128.A O no hydrogen 3.327 N/A LYS 131.A NZ GLU 136.A OE1 no hydrogen 3.354 N/A LYS 131.A NZ GLU 136.A OE2 no hydrogen 2.459 N/A ASN 132.A ND2 LEU 62.A O no hydrogen 3.270 N/A ASN 132.A ND2 ASP 67.A OD2 no hydrogen 3.197 N/A GLU 136.A N GLU 136.A OE1 no hydrogen 2.707 N/A LEU 137.A N HIS 127.A NE2 no hydrogen 3.247 N/A ILE 138.A N ARG 135.A O no hydrogen 3.388 N/A GLY 141.A N ILE 138.A O no hydrogen 2.843 N/A GLU 145.A N LYS 142.A O no hydrogen 3.113 N/A PHE 146.A N LYS 142.A O no hydrogen 3.299 N/A ASP 147.A N GLN 143.A O no hydrogen 2.913 N/A ARG 148.A N GLU 145.A O no hydrogen 3.088 N/A ARG 148.A NE GLU 145.A OE1 no hydrogen 3.282 N/A ARG 148.A NH1 ASP 130.A OD2 no hydrogen 3.556 N/A ARG 148.A NH2 GLU 145.A OE1 no hydrogen 3.056 N/A LEU 149.A N PHE 146.A O no hydrogen 3.121 N/A VAL 150.A N ASP 147.A O no hydrogen 3.144 N/A THR 151.A N ASP 147.A O no hydrogen 3.019 N/A THR 151.A OG1 ASP 147.A O no hydrogen 2.857 N/A CYS 155.A N VAL 150.A O no hydrogen 3.064 N/A CYS 155.A SG LEU 149.A O no hydrogen 3.361 N/A CYS 155.A SG ILE 157.A O no hydrogen 3.501 N/A ASP 156.A N THR 121.A O no hydrogen 2.755 N/A ILE 157.A N THR 121.A O no hydrogen 3.159 N/A ALA 158.A N LEU 176.A O no hydrogen 2.713 N/A VAL 159.A N GLY 123.A O no hydrogen 2.813 N/A TYR 160.A N VAL 178.A O no hydrogen 2.983 N/A TYR 160.A OH LEU 137.A O no hydrogen 2.700 N/A GLY 161.A N HIS 126.A O no hydrogen 2.801 N/A HIS 162.A N ASP 9.A OD1 no hydrogen 2.914 N/A HIS 162.A ND1 HIS 126.A NE2 no hydrogen 3.172 N/A HIS 162.A NE2 GLY 134.A O no hydrogen 2.784 N/A ILE 163.A N GLY 161.A O no hydrogen 2.766 N/A HIS 164.A ND1 GLN 185.A O no hydrogen 2.811 N/A LEU 167.A N ASN 179.A O no hydrogen 2.990 N/A ARG 169.A N ILE 177.A O no hydrogen 2.801 N/A GLY 171.A N GLN 175.A O no hydrogen 2.770 N/A THR 172.A N ASP 147.A OD1 no hydrogen 2.858 N/A THR 172.A OG1 ASP 147.A OD1 no hydrogen 3.303 N/A THR 172.A OG1 ASP 147.A OD2 no hydrogen 2.494 N/A GLY 174.A N GLY 171.A O no hydrogen 2.766 N/A GLN 175.A N GLN 175.A OE1 no hydrogen 2.824 N/A LEU 176.A N ASP 156.A O no hydrogen 2.942 N/A ILE 177.A N ARG 169.A O no hydrogen 2.703 N/A VAL 178.A N ALA 158.A O no hydrogen 2.823 N/A ASN 179.A N LEU 167.A O no hydrogen 2.948 N/A ASN 179.A ND2 GLY 161.A O no hydrogen 2.861 N/A GLY 181.A N ASN 179.A OD1 no hydrogen 3.052 N/A SER 182.A N GLN 200.A OE1 no hydrogen 2.760 N/A SER 182.A OG ASP 9.A O no hydrogen 2.702 N/A ILE 183.A N SER 8.A O no hydrogen 3.100 N/A GLY 184.A N ASP 9.A O no hydrogen 3.071 N/A GLN 185.A N SER 182.A OG no hydrogen 2.960 N/A GLN 185.A NE2 GLY 184.A O no hydrogen 2.704 N/A GLN 185.A NE2 SER 244.A OG no hydrogen 3.212 N/A PHE 187.A N HIS 164.A O no hydrogen 2.986 N/A LEU 193.A N ASP 190.A OD2 no hydrogen 2.831 N/A ARG 194.A N ASP 190.A O no hydrogen 2.888 N/A ARG 194.A NE PHE 188.A O no hydrogen 3.288 N/A ARG 194.A NH2 PHE 188.A O no hydrogen 3.194 N/A LYS 195.A N GLN 192.A O no hydrogen 3.151 N/A ASP 196.A N LEU 193.A O no hydrogen 3.204 N/A ARG 198.A N ASP 196.A OD1 no hydrogen 3.433 N/A ARG 198.A NE ASP 196.A OD1 no hydrogen 2.920 N/A ARG 198.A NH2 ASP 196.A OD2 no hydrogen 2.998 N/A ALA 199.A N VAL 219.A O no hydrogen 3.104 N/A GLN 200.A N SER 182.A O no hydrogen 2.933 N/A TYR 201.A N ARG 217.A O no hydrogen 3.180 N/A TYR 201.A OH ASP 23.A OD2 no hydrogen 2.521 N/A ILE 203.A N ASP 215.A O no hydrogen 2.907 N/A LEU 204.A N ILE 4.A O no hydrogen 2.791 N/A GLU 205.A N ASP 213.A O no hydrogen 3.106 N/A PHE 206.A N THR 2.A O no hydrogen 2.889 N/A ASP 207.A N GLY 210.A O no hydrogen 2.868 N/A LYS 209.A N ASP 207.A OD2 no hydrogen 3.014 N/A GLY 210.A N ASP 207.A O no hydrogen 3.261 N/A GLY 210.A N ASP 207.A OD2 no hydrogen 3.172 N/A VAL 212.A N GLU 205.A O no hydrogen 2.824 N/A ASP 215.A N ILE 203.A O no hydrogen 2.949 N/A ARG 217.A N TYR 201.A O no hydrogen 2.840 N/A ARG 217.A NE ASP 23.A OD2 no hydrogen 2.926 N/A ARG 217.A NH1 ASP 215.A OD2 no hydrogen 2.915 N/A ARG 217.A NH2 ASP 23.A OD1 no hydrogen 2.959 N/A ARG 218.A NE ARG 198.A O no hydrogen 3.342 N/A ARG 218.A NH2 ASP 196.A O no hydrogen 2.936 N/A ARG 218.A NH2 ARG 198.A O no hydrogen 2.769 N/A VAL 219.A N ALA 199.A O no hydrogen 2.912 N/A ALA 225.A N ASP 222.A OD1 no hydrogen 3.211 N/A GLU 226.A N ASP 222.A O no hydrogen 3.141 N/A LEU 227.A N VAL 223.A O no hydrogen 2.996 N/A GLN 228.A N ALA 224.A O no hydrogen 2.950 N/A LEU 229.A N ALA 225.A O no hydrogen 2.928 N/A ALA 230.A N GLU 226.A O no hydrogen 2.901 N/A LYS 231.A N LEU 227.A O no hydrogen 3.094 N/A ASP 232.A N GLN 228.A O no hydrogen 3.012 N/A LEU 233.A N LEU 229.A O no hydrogen 3.018 N/A ARG 234.A N LYS 231.A O no hydrogen 3.068 N/A ARG 234.A NH2 ASP 232.A O no hydrogen 3.480 N/A LEU 235.A N ALA 230.A O no hydrogen 2.940 N/A TYR 241.A N TYR 237.A O no hydrogen 3.201 N/A TYR 241.A OH GLU 226.A OE2 no hydrogen 2.567 N/A TYR 242.A N PHE 238.A O no hydrogen 2.772 N/A GLU 243.A N GLU 239.A O no hydrogen 2.990 N/A SER 244.A N VAL 240.A O no hydrogen 3.162 N/A SER 244.A OG GLN 185.A OE1 no hydrogen 3.427 N/A SER 244.A OG TYR 241.A O no hydrogen 2.858 N/A LEU 245.A N TYR 241.A O no hydrogen 3.004 N/A LEU 245.A N TYR 242.A O no hydrogen 3.209 N/A VAL 246.A N TYR 242.A O no hydrogen 2.944 N/A ASN 247.A N GLU 243.A O no hydrogen 2.946 N/A ASN 247.A ND2 GLU 243.A OE2 no hydrogen 2.887 N/A ILE 249.A N GLU 243.A O no hydrogen 3.423 N/A