Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pqx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ASN 217.A OD1 no hydrogen 2.678 N/A LYS 6.A N PHE 137.A O no hydrogen 2.691 N/A ARG 13.A NE ASP 12.A OD2 no hydrogen 3.143 N/A TYR 14.A N ILE 211.A O no hydrogen 2.853 N/A VAL 15.A N TRP 58.A O no hydrogen 2.790 N/A LEU 16.A N ILE 209.A O no hydrogen 2.809 N/A ALA 17.A N GLY 56.A O no hydrogen 2.805 N/A LEU 18.A N ILE 207.A O no hydrogen 2.778 N/A SER 19.A N THR 53.A O no hydrogen 2.798 N/A SER 19.A OG.A THR 205.A O no hydrogen 3.393 N/A TRP 20.A N THR 205.A O no hydrogen 2.900 N/A TRP 20.A NE1 ASP 241.A O no hydrogen 2.949 N/A GLN 21.A N PHE 51.A O no hydrogen 2.780 N/A THR 22.A OG1 ASP 241.A O no hydrogen 2.684 N/A PHE 24.A N TRP 20.A O no hydrogen 2.901 N/A CYS 25.A N GLN 21.A O no hydrogen 2.957 N/A CYS 25.A SG GLN 21.A O no hydrogen 3.344 N/A CYS 25.A SG GLN 42.A OE1 no hydrogen 3.540 N/A GLN 26.A N THR 22.A O no hydrogen 2.876 N/A GLN 26.A NE2 ASP 30.A OD1 no hydrogen 3.022 N/A GLN 26.A NE2 TYR 245.A O no hydrogen 3.523 N/A SER 27.A N GLY 23.A O no hydrogen 2.820 N/A SER 27.A OG.A GLN 198.A OE1 no hydrogen 3.041 N/A SER 27.A OG.B GLY 23.A O no hydrogen 3.341 N/A SER 27.A OG.B PHE 24.A O no hydrogen 2.460 N/A GLN 28.A N PHE 24.A O no hydrogen 3.018 N/A HIS 29.A N CYS 25.A O no hydrogen 3.101 N/A ASP 30.A N GLN 26.A O no hydrogen 2.787 N/A ARG 31.A N SER 27.A O no hydrogen 2.935 N/A ASN 32.A N HIS 29.A O no hydrogen 3.119 N/A ARG 33.A N GLN 28.A O no hydrogen 2.896 N/A CYS 39.A N ARG 36.A O no hydrogen 2.812 N/A ARG 40.A N ARG 36.A O no hydrogen 3.403 N/A LEU 41.A N ASP 37.A O no hydrogen 2.699 N/A GLN 42.A N CYS 39.A O no hydrogen 3.193 N/A THR 45.A OG1 ASN 47.A O no hydrogen 3.252 N/A LYS 48.A NZ GLU 44.A OE1 no hydrogen 2.700 N/A LYS 48.A NZ THR 45.A O no hydrogen 2.829 N/A ASP 50.A N ASN 47.A O no hydrogen 2.862 N/A PHE 51.A N LYS 48.A O no hydrogen 3.054 N/A LEU 52.A N ALA 49.A O no hydrogen 2.950 N/A THR 53.A N SER 19.A O no hydrogen 2.820 N/A THR 53.A OG1 SER 19.A O no hydrogen 3.517 N/A VAL 54.A N VAL 115.A O no hydrogen 2.767 N/A HIS 55.A N ALA 17.A O no hydrogen 2.813 N/A HIS 55.A ND1 GLU 206.A OE2 no hydrogen 2.414 N/A GLY 56.A N ALA 17.A O no hydrogen 3.074 N/A TRP 58.A N VAL 15.A O no hydrogen 2.755 N/A TRP 58.A NE1 GLU 129.A OE2 no hydrogen 2.832 N/A GLY 60.A N ARG 13.A O no hydrogen 2.750 N/A LYS 63.A N ASP 10.A O no hydrogen 2.931 N/A SER 64.A N ASP 10.A OD1 no hydrogen 3.339 N/A SER 64.A OG ASP 10.A OD1 no hydrogen 2.818 N/A VAL 65.A N PRO 62.A O no hydrogen 2.980 N/A ALA 66.A N PRO 62.A O no hydrogen 2.873 N/A ALA 67.A N LYS 63.A O no hydrogen 2.816 N/A ARG 68.A N VAL 65.A O no hydrogen 2.942 N/A GLY 69.A N ALA 66.A O no hydrogen 2.951 N/A ARG 74.A N ASP 71.A OD1 no hydrogen 2.782 N/A TRP 75.A N ASP 71.A O no hydrogen 3.013 N/A TRP 75.A NE1 PRO 59.A O no hydrogen 2.893 N/A MET 76.A N GLU 72.A O no hydrogen 2.963 N/A ARG 77.A N ARG 73.A O no hydrogen 2.966 N/A PHE 78.A N ARG 74.A O no hydrogen 2.979 N/A GLY 79.A N TRP 75.A O no hydrogen 2.732 N/A CYS 80.A N LYS 132.A O no hydrogen 2.828 N/A CYS 80.A SG LYS 132.A O no hydrogen 3.360 N/A ALA 81.A N PHE 78.A O no hydrogen 2.959 N/A THR 82.A N GLY 79.A O no hydrogen 2.969 N/A THR 82.A OG1 GLY 79.A O no hydrogen 3.225 N/A THR 82.A OG1 ILE 85.A O no hydrogen 2.793 N/A ASN 87.A N THR 82.A O no hydrogen 2.779 N/A LEU 88.A N CYS 80.A O no hydrogen 2.949 N/A ARG 92.A NE.B GLU 90.A OE2 no hydrogen 3.180 N/A ARG 95.A N ARG 92.A O no hydrogen 2.960 N/A SER 98.A N ARG 95.A O no hydrogen 2.927 N/A SER 99.A N MET 96.A O no hydrogen 3.231 N/A LEU 104.A N THR 102.A OG1 no hydrogen 3.268 N/A SER 105.A N ASP 142.A OD2 no hydrogen 2.784 N/A SER 105.A OG THR 108.A OG1 no hydrogen 2.913 N/A SER 105.A OG ASP 142.A OD2 no hydrogen 3.147 N/A THR 108.A N SER 105.A OG no hydrogen 3.053 N/A THR 108.A OG1 SER 105.A OG no hydrogen 2.913 N/A THR 108.A OG1 ASP 142.A OD2 no hydrogen 2.944 N/A ALA 109.A N SER 105.A O no hydrogen 2.845 N/A ALA 110.A N LEU 106.A O no hydrogen 2.887 N/A LYS 111.A N GLU 107.A O no hydrogen 3.089 N/A LEU 112.A N THR 108.A O no hydrogen 2.725 N/A SER 113.A N ALA 109.A O no hydrogen 2.842 N/A GLU 114.A N ALA 110.A O no hydrogen 3.339 N/A VAL 115.A N LEU 112.A O no hydrogen 3.054 N/A ALA 119.A N MET 116.A O no hydrogen 2.886 N/A GLY 120.A N GLU 126.A OE1 no hydrogen 2.817 N/A SER 123.A N GLY 120.A O no hydrogen 3.036 N/A SER 123.A OG.A GLU 38.A OE1 no hydrogen 2.671 N/A SER 123.A OG.B GLU 38.A OE1 no hydrogen 3.291 N/A SER 123.A OG.B GLY 118.A O no hydrogen 2.894 N/A CYS 124.A N GLY 120.A O no hydrogen 2.916 N/A LEU 125.A N GLY 118.A O no hydrogen 2.950 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 2.681 N/A ARG 127.A N CYS 124.A O no hydrogen 2.950 N/A TYR 128.A N CYS 124.A O no hydrogen 3.354 N/A GLU 129.A N LEU 125.A O no hydrogen 2.875 N/A TYR 130.A N GLU 126.A O no hydrogen 2.940 N/A TYR 130.A OH PHE 139.A O no hydrogen 2.628 N/A ALA 131.A N ARG 127.A O no hydrogen 2.914 N/A LYS 132.A N TYR 128.A O no hydrogen 2.948 N/A LYS 132.A NZ MET 76.A O no hydrogen 3.554 N/A LYS 132.A NZ ARG 77.A O no hydrogen 3.117 N/A LYS 132.A NZ TYR 128.A OH no hydrogen 3.463 N/A HIS 133.A N GLU 129.A O no hydrogen 2.893 N/A GLY 134.A N TYR 130.A O no hydrogen 2.799 N/A ALA 135.A N TYR 130.A O no hydrogen 2.723 N/A PHE 137.A N GLY 134.A O no hydrogen 2.981 N/A GLY 138.A N ALA 135.A O no hydrogen 2.991 N/A PHE 139.A N GLY 134.A O no hydrogen 3.465 N/A ASP 142.A N ASP 140.A OD1 no hydrogen 3.029 N/A ALA 143.A N ASP 140.A OD2 no hydrogen 3.228 N/A TYR 144.A N ASP 140.A O no hydrogen 2.859 N/A TYR 144.A OH LEU 57.A O no hydrogen 2.640 N/A PHE 145.A N PRO 141.A O no hydrogen 2.855 N/A GLY 146.A N ASP 142.A O no hydrogen 2.830 N/A THR 147.A N ALA 143.A O no hydrogen 2.895 N/A THR 147.A OG1 ALA 143.A O no hydrogen 2.612 N/A MET 148.A N TYR 144.A O no hydrogen 3.214 N/A VAL 149.A N PHE 145.A O no hydrogen 3.024 N/A ARG 150.A N GLY 146.A O no hydrogen 3.065 N/A ARG 150.A NH1 GLU 154.A OE1 no hydrogen 2.777 N/A ARG 150.A NH1 ALA 218.A O no hydrogen 3.210 N/A ARG 150.A NH2 ILE 216.A O no hydrogen 2.841 N/A LEU 151.A N THR 147.A O no hydrogen 2.906 N/A ASN 152.A N MET 148.A O no hydrogen 2.899 N/A ASN 152.A ND2 LEU 52.A O no hydrogen 3.320 N/A GLN 153.A N VAL 149.A O no hydrogen 3.030 N/A GLU 154.A N ARG 150.A O no hydrogen 2.911 N/A ILE 155.A N LEU 151.A O no hydrogen 2.968 N/A LYS 156.A N ASN 152.A O no hydrogen 2.883 N/A LYS 156.A NZ ASP 50.A OD1 no hydrogen 2.948 N/A GLU 157.A N GLN 153.A O no hydrogen 2.938 N/A SER 158.A N ILE 155.A O no hydrogen 3.097 N/A SER 158.A OG ILE 155.A O no hydrogen 2.638 N/A GLU 159.A N SER 184.A OG no hydrogen 2.848 N/A ALA 160.A N SER 158.A OG no hydrogen 3.164 N/A LYS 162.A N SER 158.A O no hydrogen 3.029 N/A PHE 163.A N GLU 159.A O no hydrogen 2.805 N/A LEU 164.A N ALA 160.A O no hydrogen 3.132 N/A ALA 165.A N GLY 161.A O no hydrogen 3.046 N/A ASP 166.A N LYS 162.A O no hydrogen 2.787 N/A ASN 167.A N PHE 163.A O no hydrogen 3.038 N/A ASN 167.A ND2 PHE 163.A O no hydrogen 2.911 N/A TYR 168.A N ALA 165.A O no hydrogen 3.216 N/A TYR 168.A OH GLU 44.A OE1 no hydrogen 3.033 N/A TYR 168.A OH GLU 44.A OE2 no hydrogen 2.673 N/A GLY 169.A N ILE 240.A O no hydrogen 2.692 N/A LYS 170.A N ASN 167.A O no hydrogen 2.816 N/A VAL 172.A N PHE 238.A O no hydrogen 2.781 N/A ARG 174.A N LYS 236.A O no hydrogen 2.732 N/A ARG 174.A NE ASP 178.A OD2 no hydrogen 2.768 N/A ARG 174.A NH1 PRO 231.A O no hydrogen 2.960 N/A ARG 174.A NH2 VAL 193.A O no hydrogen 3.054 N/A ARG 175.A NE ASP 176.A OD1 no hydrogen 3.228 N/A ARG 175.A NH1 ASP 176.A OD2 no hydrogen 3.255 N/A ASP 176.A N SER 173.A OG no hydrogen 3.021 N/A PHE 177.A N SER 173.A O no hydrogen 3.022 N/A ASP 178.A N ARG 174.A O no hydrogen 2.792 N/A ALA 179.A N ARG 175.A O no hydrogen 2.944 N/A ALA 180.A N ASP 176.A O no hydrogen 3.019 N/A PHE 181.A N PHE 177.A O no hydrogen 2.920 N/A ALA 182.A N ASP 178.A O no hydrogen 2.723 N/A LYS 183.A N ALA 179.A O no hydrogen 2.822 N/A LYS 183.A NZ GLU 159.A OE1 no hydrogen 3.275 N/A SER 184.A N ALA 180.A O no hydrogen 3.398 N/A SER 184.A N PHE 181.A O no hydrogen 3.202 N/A TRP 185.A N PHE 181.A O no hydrogen 2.853 N/A GLY 186.A N ALA 182.A O no hydrogen 2.731 N/A ASN 189.A N GLY 186.A O no hydrogen 3.060 N/A ASN 189.A ND2 TRP 185.A O no hydrogen 2.752 N/A ASN 189.A ND2 ALA 222.A O no hydrogen 2.884 N/A VAL 190.A N LYS 187.A O no hydrogen 3.226 N/A ALA 192.A N ASN 189.A O no hydrogen 2.986 N/A VAL 193.A N VAL 190.A O no hydrogen 3.258 N/A LYS 194.A N GLN 208.A O no hydrogen 2.827 N/A LEU 195.A N PRO 231.A O no hydrogen 2.927 N/A THR 196.A N GLU 206.A O no hydrogen 2.846 N/A CYS 197.A N ASN 233.A OD1 no hydrogen 2.752 N/A GLN 198.A N TYR 203.A O no hydrogen 2.981 N/A TYR 203.A N GLN 198.A O no hydrogen 2.900 N/A TYR 203.A OH ASP 30.A OD2 no hydrogen 2.726 N/A LEU 204.A N VAL 239.A O no hydrogen 2.890 N/A THR 205.A N THR 196.A O no hydrogen 2.842 N/A THR 205.A OG1 THR 196.A O no hydrogen 3.059 N/A GLU 206.A N THR 196.A O no hydrogen 3.182 N/A ILE 207.A N LEU 18.A O no hydrogen 2.705 N/A GLN 208.A N LYS 194.A O no hydrogen 2.827 N/A GLN 208.A NE2 GLU 206.A OE1 no hydrogen 2.925 N/A ILE 209.A N LEU 16.A O no hydrogen 2.830 N/A SER 210.A N ALA 192.A O no hydrogen 2.862 N/A ILE 211.A N TYR 14.A O no hydrogen 2.820 N/A LYS 212.A N SER 224.A O no hydrogen 2.768 N/A LYS 212.A NZ ASN 223.A O no hydrogen 2.941 N/A ALA 213.A N ASP 12.A O no hydrogen 2.896 N/A ALA 215.A N LYS 212.A O no hydrogen 3.003 N/A ILE 216.A N ALA 213.A O no hydrogen 3.305 N/A ASN 217.A ND2 LEU 3.A O no hydrogen 3.014 N/A ALA 218.A N ALA 215.A O no hydrogen 3.170 N/A LEU 220.A N GLU 154.A OE2 no hydrogen 2.680 N/A SER 221.A N SER 224.A OG no hydrogen 2.870 N/A SER 221.A OG SER 224.A OG no hydrogen 3.376 N/A ASN 223.A N SER 221.A OG no hydrogen 3.316 N/A SER 224.A N SER 221.A O no hydrogen 2.952 N/A SER 224.A OG SER 221.A O no hydrogen 3.302 N/A SER 224.A OG SER 221.A OG no hydrogen 3.376 N/A LEU 226.A N SER 210.A O no hydrogen 3.087 N/A GLN 228.A N LYS 191.A O no hydrogen 2.982 N/A GLN 228.A NE2 LYS 191.A O no hydrogen 3.060 N/A GLN 228.A NE2 HIS 230.A O no hydrogen 2.812 N/A HIS 230.A N GLN 228.A OE1 no hydrogen 2.807 N/A ASN 233.A N LEU 195.A O no hydrogen 3.306 N/A ASN 233.A ND2 CYS 197.A O no hydrogen 3.076 N/A PHE 238.A N VAL 172.A O no hydrogen 2.906 N/A VAL 239.A N ALA 202.A O no hydrogen 2.765 N/A ILE 240.A N LYS 170.A O no hydrogen 2.893 N/A ALA 243.A N TYR 168.A OH no hydrogen 2.740 N/A TYR 245.A OH GLU 35.A OE1 no hydrogen 2.618 N/A