Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3b0q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A N SER 6.A OG no hydrogen 3.411 N/A SER 6.A N ASN 3.A OD1 no hydrogen 3.090 N/A SER 6.A OG ASN 3.A O no hydrogen 3.324 N/A ALA 7.A N ASN 3.A O no hydrogen 2.833 N/A ASP 8.A N PRO 4.A O no hydrogen 3.059 N/A LEU 9.A N GLU 5.A O no hydrogen 3.182 N/A ARG 10.A N SER 6.A O no hydrogen 2.938 N/A ARG 10.A NH1 GLN 206.A OE1 no hydrogen 3.509 N/A ARG 10.A NH2 GLN 206.A OE1 no hydrogen 2.597 N/A ALA 11.A N ALA 7.A O no hydrogen 3.104 N/A LEU 12.A N ASP 8.A O no hydrogen 3.000 N/A ALA 13.A N LEU 9.A O no hydrogen 2.997 N/A LYS 14.A N ARG 10.A O no hydrogen 2.913 N/A HIS 15.A N ALA 11.A O no hydrogen 2.879 N/A HIS 15.A NE2 SER 88.A O no hydrogen 2.755 N/A LEU 16.A N LEU 12.A O no hydrogen 2.917 N/A TYR 17.A N ALA 13.A O no hydrogen 2.960 N/A ASP 18.A N LYS 14.A O no hydrogen 3.000 N/A SER 19.A N HIS 15.A O no hydrogen 3.046 N/A SER 19.A OG HIS 15.A O no hydrogen 2.886 N/A TYR 20.A N LEU 16.A O no hydrogen 2.924 N/A TYR 20.A OH ASP 167.A OD1 no hydrogen 2.682 N/A ILE 21.A N TYR 17.A O no hydrogen 2.954 N/A LYS 22.A N ASP 18.A O no hydrogen 3.088 N/A LYS 22.A NZ ASP 18.A OD1 no hydrogen 3.255 N/A LYS 22.A NZ ASP 18.A OD2 no hydrogen 2.654 N/A SER 23.A N SER 19.A O no hydrogen 2.853 N/A SER 23.A N TYR 20.A O no hydrogen 3.065 N/A SER 23.A OG SER 19.A O no hydrogen 2.799 N/A PHE 24.A N TYR 20.A O no hydrogen 2.966 N/A LYS 28.A N ASP 167.A OD1 no hydrogen 2.806 N/A LYS 28.A NZ LEU 165.A O no hydrogen 2.737 N/A ALA 29.A N ASP 167.A OD2 no hydrogen 2.958 N/A LYS 30.A N THR 27.A OG1 no hydrogen 3.128 N/A ALA 31.A N THR 27.A O no hydrogen 2.962 N/A ARG 32.A N LYS 28.A O no hydrogen 2.806 N/A ALA 33.A N ALA 29.A O no hydrogen 3.083 N/A ILE 34.A N LYS 30.A O no hydrogen 2.993 N/A LEU 35.A N ALA 31.A O no hydrogen 2.905 N/A THR 36.A N ARG 32.A O no hydrogen 2.862 N/A THR 36.A OG1 ARG 32.A O no hydrogen 2.675 N/A GLY 37.A N ILE 34.A O no hydrogen 3.482 N/A LYS 38.A N ALA 33.A O no hydrogen 3.070 N/A LYS 38.A NZ THR 36.A OG1 no hydrogen 3.232 N/A THR 39.A OG1 SER 43.A OG no hydrogen 2.701 N/A SER 43.A OG THR 39.A OG1 no hydrogen 2.701 N/A PHE 45.A N GLN 131.A O no hydrogen 2.959 N/A ILE 47.A N PHE 133.A O no hydrogen 2.801 N/A TYR 48.A N SER 52.A OG no hydrogen 2.924 N/A ASP 49.A N SER 52.A OG no hydrogen 2.961 N/A SER 52.A N ASP 49.A OD1 no hydrogen 2.680 N/A SER 52.A OG ASP 49.A O no hydrogen 3.077 N/A SER 52.A OG ASP 49.A OD1 no hydrogen 2.634 N/A LEU 53.A N ASP 49.A O no hydrogen 2.881 N/A MET 54.A N MET 50.A O no hydrogen 2.774 N/A MET 55.A N ASN 51.A O no hydrogen 2.784 N/A GLY 56.A N SER 52.A O no hydrogen 2.778 N/A GLU 57.A N MET 54.A O no hydrogen 3.183 N/A ASP 58.A N MET 55.A O no hydrogen 3.204 N/A LYS 59.A N GLY 56.A O no hydrogen 2.971 N/A ARG 66.A N GLU 62.A O no hydrogen 2.932 N/A ARG 66.A NH1 GLU 57.A OE2 no hydrogen 2.575 N/A ARG 66.A NH2 GLU 57.A OE2 no hydrogen 3.021 N/A ILE 67.A N VAL 63.A O no hydrogen 2.912 N/A PHE 68.A N ALA 64.A O no hydrogen 2.871 N/A GLN 69.A N ILE 65.A O no hydrogen 2.856 N/A GLY 70.A N ARG 66.A O no hydrogen 3.051 N/A CYS 71.A N ILE 67.A O no hydrogen 3.139 N/A CYS 71.A SG ILE 67.A O no hydrogen 3.506 N/A GLN 72.A N PHE 68.A O no hydrogen 3.154 N/A GLN 72.A NE2 SER 250.A O no hydrogen 2.933 N/A PHE 73.A N GLN 69.A O no hydrogen 2.962 N/A ARG 74.A N GLY 70.A O no hydrogen 2.999 N/A ARG 74.A NH1 ARG 74.A O no hydrogen 3.010 N/A SER 75.A N CYS 71.A O no hydrogen 2.874 N/A VAL 76.A N GLN 72.A O no hydrogen 2.820 N/A GLU 77.A N PHE 73.A O no hydrogen 2.957 N/A ALA 78.A N ARG 74.A O no hydrogen 2.948 N/A VAL 79.A N SER 75.A O no hydrogen 2.940 N/A GLN 80.A N VAL 76.A O no hydrogen 3.327 N/A GLU 81.A N GLU 77.A O no hydrogen 3.092 N/A ILE 82.A N ALA 78.A O no hydrogen 2.757 N/A THR 83.A N VAL 79.A O no hydrogen 2.818 N/A THR 83.A OG1 VAL 79.A O no hydrogen 2.804 N/A GLU 84.A N GLN 80.A O no hydrogen 3.049 N/A TYR 85.A N GLU 81.A O no hydrogen 2.961 N/A TYR 85.A OH ALA 171.A O no hydrogen 2.404 N/A ALA 86.A N ILE 82.A O no hydrogen 2.765 N/A LYS 87.A N THR 83.A O no hydrogen 3.187 N/A SER 88.A N TYR 85.A O no hydrogen 2.902 N/A SER 88.A OG TYR 85.A O no hydrogen 2.609 N/A ILE 89.A N ALA 86.A O no hydrogen 2.936 N/A PHE 92.A N ILE 89.A O no hydrogen 2.925 N/A ASN 94.A N GLY 91.A O no hydrogen 3.257 N/A LEU 95.A N PHE 92.A O no hydrogen 3.142 N/A ASN 98.A N ASP 96.A OD2 no hydrogen 2.827 N/A GLN 100.A N ASP 96.A O no hydrogen 2.962 N/A VAL 101.A N LEU 97.A O no hydrogen 3.033 N/A THR 102.A N ASN 98.A O no hydrogen 2.968 N/A THR 102.A OG1 ASN 98.A O no hydrogen 3.117 N/A LEU 103.A N ASP 99.A O no hydrogen 2.901 N/A LEU 104.A N GLN 100.A O no hydrogen 3.127 N/A LYS 105.A N VAL 101.A O no hydrogen 2.788 N/A LYS 105.A NZ ILE 258.A O no hydrogen 2.707 N/A LYS 105.A NZ LYS 260.A O no hydrogen 2.733 N/A TYR 106.A N THR 102.A O no hydrogen 2.945 N/A TYR 106.A OH LEU 262.A O no hydrogen 2.950 N/A GLY 107.A N LEU 104.A O no hydrogen 3.142 N/A VAL 108.A N LEU 104.A O no hydrogen 2.971 N/A ILE 111.A N GLY 107.A O no hydrogen 3.059 N/A ILE 112.A N VAL 108.A O no hydrogen 2.797 N/A TYR 113.A N HIS 109.A O no hydrogen 3.055 N/A THR 114.A N GLU 110.A O no hydrogen 3.137 N/A THR 114.A OG1 GLU 110.A O no hydrogen 2.822 N/A MET 115.A N ILE 111.A O no hydrogen 2.905 N/A LEU 116.A N ILE 112.A O no hydrogen 2.795 N/A ALA 117.A N TYR 113.A O no hydrogen 3.292 N/A SER 118.A N MET 115.A O no hydrogen 3.127 N/A LEU 119.A N LEU 116.A O no hydrogen 2.878 N/A MET 120.A N ALA 117.A O no hydrogen 3.059 N/A ASN 121.A N GLY 124.A O no hydrogen 3.087 N/A LYS 122.A NZ ASP 123.A OD1 no hydrogen 3.484 N/A ASP 123.A N ASN 121.A OD1 no hydrogen 2.859 N/A VAL 125.A N MET 134.A O no hydrogen 2.934 N/A LEU 126.A N LEU 119.A O no hydrogen 2.904 N/A ILE 127.A N GLY 132.A O no hydrogen 2.798 N/A GLY 130.A N ILE 127.A O no hydrogen 3.063 N/A GLN 131.A N SER 128.A O no hydrogen 3.019 N/A GLN 131.A NE2 SER 128.A O no hydrogen 3.201 N/A GLY 132.A N ILE 127.A O no hydrogen 3.050 N/A PHE 133.A N PHE 45.A O no hydrogen 2.915 N/A MET 134.A N VAL 125.A O no hydrogen 2.907 N/A THR 135.A N ILE 47.A O no hydrogen 2.972 N/A ARG 136.A N ASP 123.A O no hydrogen 2.741 N/A ARG 136.A NE GLU 151.A OE2 no hydrogen 2.972 N/A ARG 136.A NH1 LYS 122.A O no hydrogen 3.145 N/A ARG 136.A NH2 GLU 151.A OE1 no hydrogen 3.183 N/A PHE 138.A N THR 135.A OG1 no hydrogen 3.129 N/A LEU 139.A N THR 135.A O no hydrogen 3.141 N/A LYS 140.A N ARG 136.A O no hydrogen 2.924 N/A SER 141.A N PHE 138.A O no hydrogen 3.101 N/A SER 141.A OG PHE 138.A O no hydrogen 2.721 N/A LEU 142.A N LEU 139.A O no hydrogen 3.352 N/A ARG 143.A NE GLU 62.A OE1 no hydrogen 2.644 N/A ARG 143.A NH1 LYS 144.A O no hydrogen 2.581 N/A ARG 143.A NH1 GLU 246.A OE2 no hydrogen 3.511 N/A ARG 143.A NH2 GLU 62.A OE1 no hydrogen 3.203 N/A ARG 143.A NH2 GLU 62.A OE2 no hydrogen 3.524 N/A ARG 143.A NH2 GLU 246.A OE2 no hydrogen 2.896 N/A PHE 146.A N ARG 143.A O no hydrogen 2.792 N/A GLU 151.A N ASP 148.A O no hydrogen 3.226 N/A LYS 153.A NZ PHE 149.A O no hydrogen 2.865 N/A LYS 153.A NZ HIS 235.A ND1 no hydrogen 2.984 N/A PHE 154.A N MET 150.A O no hydrogen 3.054 N/A GLU 155.A N GLU 151.A O no hydrogen 2.917 N/A PHE 156.A N PRO 152.A O no hydrogen 3.179 N/A ALA 157.A N LYS 153.A O no hydrogen 2.897 N/A VAL 158.A N PHE 154.A O no hydrogen 3.045 N/A LYS 159.A N GLU 155.A O no hydrogen 3.515 N/A PHE 160.A N PHE 156.A O no hydrogen 2.701 N/A ASN 161.A N ALA 157.A O no hydrogen 2.592 N/A ASN 161.A ND2 ALA 117.A O no hydrogen 3.024 N/A LEU 163.A N PHE 160.A O no hydrogen 2.983 N/A GLU 164.A N ASN 161.A O no hydrogen 3.038 N/A ASP 166.A N ASP 169.A OD2 no hydrogen 2.808 N/A SER 168.A OG ASP 166.A OD1 no hydrogen 2.408 N/A ASP 169.A N ASP 166.A OD1 no hydrogen 3.036 N/A LEU 170.A N ASP 166.A O no hydrogen 2.907 N/A ALA 171.A N ASP 167.A O no hydrogen 2.857 N/A ILE 172.A N ASP 169.A O no hydrogen 3.139 N/A PHE 173.A N ASP 169.A O no hydrogen 3.135 N/A ILE 174.A N LEU 170.A O no hydrogen 2.910 N/A VAL 176.A N ILE 172.A O no hydrogen 2.969 N/A ILE 177.A N PHE 173.A O no hydrogen 3.019 N/A ILE 178.A N ILE 174.A O no hydrogen 3.094 N/A LEU 179.A N ALA 175.A O no hydrogen 3.033 N/A SER 180.A OG ILE 177.A O no hydrogen 2.521 N/A ARG 183.A NH1 GLU 110.A OE2 no hydrogen 3.119 N/A ARG 183.A NH2 GLU 110.A OE1 no hydrogen 2.887 N/A ARG 183.A NH2 ILE 177.A O no hydrogen 3.143 N/A LEU 187.A N ASP 99.A OD1 no hydrogen 2.801 N/A ASN 188.A N ASP 99.A OD2 no hydrogen 2.890 N/A LYS 190.A NZ GLU 193.A OE1 no hydrogen 2.522 N/A GLU 193.A N VAL 189.A O no hydrogen 2.924 N/A ASP 194.A N LYS 190.A O no hydrogen 2.918 N/A ILE 195.A N PRO 191.A O no hydrogen 3.170 N/A GLN 196.A N ILE 192.A O no hydrogen 2.899 N/A ASP 197.A N GLU 193.A O no hydrogen 2.808 N/A ASN 198.A N ASP 194.A O no hydrogen 3.384 N/A LEU 199.A N ILE 195.A O no hydrogen 2.993 N/A LEU 200.A N GLN 196.A O no hydrogen 2.723 N/A GLN 201.A N ASP 197.A O no hydrogen 3.007 N/A ALA 202.A N ASN 198.A O no hydrogen 3.040 N/A LEU 203.A N LEU 199.A O no hydrogen 2.845 N/A GLU 204.A N LEU 200.A O no hydrogen 2.882 N/A LEU 205.A N GLN 201.A O no hydrogen 3.144 N/A GLN 206.A N ALA 202.A O no hydrogen 2.998 N/A GLN 206.A NE2 ASP 169.A OD1 no hydrogen 3.144 N/A LEU 207.A N LEU 203.A O no hydrogen 2.943 N/A LYS 208.A N GLU 204.A O no hydrogen 3.051 N/A LEU 209.A N LEU 205.A O no hydrogen 2.866 N/A ASN 210.A N GLN 206.A O no hydrogen 2.762 N/A HIS 211.A N LEU 207.A O no hydrogen 2.810 N/A HIS 211.A NE2 ASP 169.A OD2 no hydrogen 2.655 N/A SER 214.A N HIS 211.A O no hydrogen 3.110 N/A LYS 220.A N GLN 216.A O no hydrogen 3.008 N/A LYS 220.A NZ SER 215.A O no hydrogen 2.724 N/A LEU 221.A N LEU 217.A O no hydrogen 2.750 N/A LEU 222.A N PHE 218.A O no hydrogen 2.917 N/A GLN 223.A N ALA 219.A O no hydrogen 2.861 N/A LYS 224.A N LEU 221.A O no hydrogen 2.864 N/A LYS 224.A NZ LYS 220.A O no hydrogen 3.014 N/A MET 225.A N LEU 222.A O no hydrogen 3.126 N/A THR 226.A N GLN 223.A O no hydrogen 3.227 N/A THR 226.A OG1 GLN 223.A O no hydrogen 3.234 N/A THR 226.A OG1 ASP 227.A OD2 no hydrogen 3.417 N/A LEU 228.A N LYS 224.A O no hydrogen 3.105 N/A ARG 229.A N MET 225.A O no hydrogen 3.131 N/A ARG 229.A NE GLU 110.A OE2 no hydrogen 2.714 N/A GLN 230.A N THR 226.A O no hydrogen 3.164 N/A ILE 231.A N ASP 227.A O no hydrogen 2.983 N/A VAL 232.A N LEU 228.A O no hydrogen 3.024 N/A THR 233.A N ARG 229.A O no hydrogen 2.927 N/A THR 233.A OG1 ARG 229.A O no hydrogen 3.398 N/A GLU 234.A N GLN 230.A O no hydrogen 2.987 N/A HIS 235.A N ILE 231.A O no hydrogen 2.916 N/A VAL 236.A N VAL 232.A O no hydrogen 3.011 N/A GLN 237.A N THR 233.A O no hydrogen 3.159 N/A LEU 238.A N GLU 234.A O no hydrogen 2.970 N/A LEU 239.A N HIS 235.A O no hydrogen 2.842 N/A GLN 240.A N VAL 236.A O no hydrogen 3.004 N/A VAL 241.A N GLN 237.A O no hydrogen 3.301 N/A ILE 242.A N LEU 238.A O no hydrogen 2.862 N/A LYS 243.A N LEU 239.A O no hydrogen 2.919 N/A LYS 244.A N GLN 240.A O no hydrogen 3.287 N/A LYS 244.A N VAL 241.A O no hydrogen 3.100 N/A THR 245.A N VAL 241.A O no hydrogen 3.065 N/A THR 245.A OG1 VAL 241.A O no hydrogen 3.502 N/A THR 245.A OG1 ILE 242.A O no hydrogen 3.161 N/A THR 245.A OG1 GLU 246.A OE1 no hydrogen 2.828 N/A GLU 246.A N ILE 242.A O no hydrogen 2.746 N/A ASP 248.A N ASP 248.A OD2 no hydrogen 2.686 N/A MET 249.A N GLU 246.A O no hydrogen 3.117 N/A SER 250.A OG GLN 69.A OE1 no hydrogen 3.056 N/A HIS 252.A N GLN 72.A OE1 no hydrogen 3.052 N/A LEU 254.A N HIS 252.A ND1 no hydrogen 3.126 N/A GLN 256.A N HIS 252.A O no hydrogen 2.953 N/A GLU 257.A N PRO 253.A O no hydrogen 2.863 N/A ILE 258.A N LEU 254.A O no hydrogen 3.009 N/A TYR 259.A N LEU 255.A O no hydrogen 2.892 N/A LYS 260.A N GLU 257.A O no hydrogen 3.353 N/A LEU 262.A N TYR 259.A O no hydrogen 3.288 N/A