Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vqy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N GLN 7.A OE1 no hydrogen 2.930 N/A GLN 7.A N THR 4.A OG1 no hydrogen 3.069 N/A THR 8.A N THR 4.A O no hydrogen 2.904 N/A THR 8.A OG1 THR 4.A O no hydrogen 3.248 N/A ASP 9.A N LYS 5.A O no hydrogen 2.871 N/A ARG 10.A N SER 6.A O no hydrogen 3.116 N/A ARG 10.A NE GLU 29.A OE2 no hydrogen 2.831 N/A ARG 10.A NH1 ASN 256.A O no hydrogen 2.986 N/A ARG 10.A NH2 GLU 29.A OE2 no hydrogen 3.320 N/A ARG 10.A NH2 ASN 256.A O no hydrogen 3.478 N/A LEU 11.A N GLN 7.A O no hydrogen 2.989 N/A GLU 12.A N THR 8.A O no hydrogen 2.864 N/A VAL 13.A N ASP 9.A O no hydrogen 3.059 N/A LEU 14.A N ARG 10.A O no hydrogen 3.306 N/A LEU 15.A N GLU 12.A O no hydrogen 3.101 N/A ASN 16.A N ASP 19.A OD2 no hydrogen 2.640 N/A ASP 19.A N ASN 16.A O no hydrogen 3.073 N/A LEU 28.A N PRO 24.A O no hydrogen 3.083 N/A GLU 29.A N PHE 25.A O no hydrogen 2.804 N/A SER 30.A N ARG 26.A O no hydrogen 3.048 N/A GLU 31.A N GLU 27.A O no hydrogen 2.927 N/A LEU 32.A N LEU 28.A O no hydrogen 3.036 N/A LEU 33.A N GLU 29.A O no hydrogen 2.808 N/A SER 34.A N SER 30.A O no hydrogen 3.096 N/A SER 34.A OG GLU 31.A O no hydrogen 2.911 N/A ARG 35.A N GLU 31.A O no hydrogen 3.195 N/A ARG 35.A NE GLU 31.A OE1 no hydrogen 3.305 N/A ARG 35.A NH1 ASP 19.A OD1 no hydrogen 2.838 N/A ARG 36.A N LEU 32.A O no hydrogen 2.996 N/A ARG 36.A NE LEU 14.A O no hydrogen 2.723 N/A ARG 36.A NH1 LEU 14.A O no hydrogen 3.300 N/A ARG 36.A NH1 ASP 19.A OD1 no hydrogen 2.920 N/A ARG 36.A NH2 ASP 39.A OD2 no hydrogen 2.651 N/A LYS 37.A N LEU 33.A O no hydrogen 3.106 N/A LYS 38.A N SER 34.A O no hydrogen 3.152 N/A ASP 39.A N ARG 35.A O no hydrogen 2.915 N/A LEU 40.A N ARG 36.A O no hydrogen 2.808 N/A GLN 41.A N LYS 37.A O no hydrogen 2.715 N/A GLN 42.A N LYS 38.A O no hydrogen 2.901 N/A ILE 43.A N ASP 39.A O no hydrogen 2.952 N/A TYR 44.A N LEU 40.A O no hydrogen 2.972 N/A ALA 45.A N GLN 41.A O no hydrogen 3.085 N/A ALA 45.A N GLN 42.A O no hydrogen 3.240 N/A GLU 46.A N GLN 42.A O no hydrogen 2.871 N/A ARG 48.A N ILE 43.A O no hydrogen 2.725 N/A ARG 48.A NH1 TYR 44.A O no hydrogen 2.934 N/A ARG 48.A NH1 ALA 45.A O no hydrogen 3.230 N/A TYR 51.A N ASN 251.A OD1 no hydrogen 2.818 N/A GLY 53.A N ASN 50.A OD1 no hydrogen 2.995 N/A LYS 54.A N ASN 50.A O no hydrogen 2.687 N/A LEU 55.A N TYR 51.A O no hydrogen 2.799 N/A GLU 56.A N LEU 52.A O no hydrogen 3.030 N/A ARG 57.A N GLY 53.A O no hydrogen 2.953 N/A ARG 57.A NH2 GLU 49.A OE1 no hydrogen 2.835 N/A GLU 58.A N LYS 54.A O no hydrogen 2.922 N/A ILE 59.A N LEU 55.A O no hydrogen 2.737 N/A THR 60.A N GLU 56.A O no hydrogen 2.790 N/A THR 60.A OG1 GLU 56.A O no hydrogen 2.923 N/A ARG 61.A N ARG 57.A O no hydrogen 3.022 N/A PHE 62.A N GLU 58.A O no hydrogen 3.120 N/A PHE 63.A N ILE 59.A O no hydrogen 3.125 N/A VAL 64.A N THR 60.A O no hydrogen 2.865 N/A ASP 65.A N ARG 61.A O no hydrogen 3.006 N/A ARG 66.A N PHE 62.A O no hydrogen 3.280 N/A ARG 66.A N PHE 63.A O no hydrogen 3.007 N/A ARG 66.A NE PHE 62.A O no hydrogen 2.834 N/A ARG 66.A NH2 PHE 62.A O no hydrogen 3.406 N/A GLY 67.A N VAL 64.A O no hydrogen 3.135 N/A PHE 68.A N PHE 63.A O no hydrogen 2.924 N/A LEU 69.A N LYS 130.A O no hydrogen 2.629 N/A ILE 71.A N PHE 132.A O no hydrogen 2.868 N/A LYS 72.A NZ GLU 56.A OE1 no hydrogen 2.823 N/A LYS 72.A NZ ILE 134.A O no hydrogen 3.234 N/A SER 73.A N GLU 133.A OE2 no hydrogen 2.724 N/A SER 73.A OG ASN 113.A OD1 no hydrogen 2.917 N/A SER 73.A OG GLU 133.A OE1 no hydrogen 2.570 N/A SER 73.A OG GLU 133.A OE2 no hydrogen 3.117 N/A ILE 77.A N CYS 105.A O no hydrogen 3.096 N/A LEU 79.A N ASN 103.A O no hydrogen 2.909 N/A TYR 81.A N PRO 78.A O no hydrogen 3.112 N/A ILE 82.A N LEU 79.A O no hydrogen 2.782 N/A GLU 83.A N LEU 79.A O no hydrogen 3.377 N/A ARG 84.A N GLU 80.A O no hydrogen 3.096 N/A ARG 84.A NE GLU 213.A OE1 no hydrogen 2.605 N/A ARG 84.A NH2 GLU 213.A O no hydrogen 2.938 N/A MET 85.A N ILE 82.A O no hydrogen 3.000 N/A GLY 86.A N GLU 83.A O no hydrogen 2.993 N/A ILE 87.A N ILE 82.A O no hydrogen 3.369 N/A THR 91.A N ASP 88.A O no hydrogen 3.036 N/A LEU 93.A N THR 91.A OG1 no hydrogen 3.426 N/A SER 94.A OG ASP 88.A O no hydrogen 3.244 N/A SER 94.A OG THR 91.A O no hydrogen 2.589 N/A LYS 95.A N GLU 92.A O no hydrogen 3.048 N/A GLN 96.A N LEU 93.A O no hydrogen 2.703 N/A ARG 99.A NH1 LYS 102.A O no hydrogen 3.394 N/A VAL 100.A N PHE 104.A O no hydrogen 2.745 N/A PHE 104.A N VAL 100.A O no hydrogen 3.131 N/A CYS 105.A N ILE 77.A O no hydrogen 2.964 N/A CYS 105.A SG ILE 77.A O no hydrogen 3.834 N/A CYS 105.A SG LEU 106.A O no hydrogen 3.933 N/A LEU 106.A N PHE 98.A O no hydrogen 2.930 N/A ARG 107.A N ILE 75.A O no hydrogen 2.897 N/A ARG 107.A NE PRO 74.A O no hydrogen 3.296 N/A ARG 107.A NH1 PRO 136.A O no hydrogen 2.897 N/A ARG 107.A NH2 PRO 74.A O no hydrogen 3.172 N/A ARG 107.A NH2 GLU 133.A OE2 no hydrogen 2.922 N/A LEU 114.A N LEU 110.A O no hydrogen 3.184 N/A TYR 115.A N ALA 111.A O no hydrogen 2.792 N/A TYR 115.A OH ASP 211.A OD2 no hydrogen 2.605 N/A ASN 116.A N PRO 112.A O no hydrogen 3.136 N/A TYR 117.A N ASN 113.A O no hydrogen 2.971 N/A LEU 118.A N LEU 114.A O no hydrogen 2.925 N/A ARG 119.A N TYR 115.A O no hydrogen 3.146 N/A ARG 119.A NH2 ASN 116.A OD1 no hydrogen 3.127 N/A ARG 119.A NH2 TRP 214.A O no hydrogen 3.063 N/A LYS 120.A N ASN 116.A O no hydrogen 3.019 N/A LEU 121.A N TYR 117.A O no hydrogen 2.766 N/A ASP 122.A N LEU 118.A O no hydrogen 3.130 N/A ARG 123.A N LYS 120.A O no hydrogen 3.166 N/A ALA 124.A N LEU 121.A O no hydrogen 2.902 N/A LEU 125.A N LEU 121.A O no hydrogen 2.766 N/A ILE 129.A N MET 159.A O no hydrogen 2.959 N/A LYS 130.A NZ ARG 66.A O no hydrogen 3.088 N/A ILE 131.A N CYS 157.A O no hydrogen 3.034 N/A PHE 132.A N LEU 69.A O no hydrogen 3.027 N/A GLU 133.A N ASN 155.A O no hydrogen 2.915 N/A GLY 135.A N MET 153.A O no hydrogen 2.960 N/A CYS 137.A N PHE 151.A O no hydrogen 2.735 N/A CYS 137.A SG PRO 136.A O no hydrogen 3.364 N/A TYR 138.A N ARG 107.A O no hydrogen 2.909 N/A TYR 138.A OH GLU 150.A OE2 no hydrogen 2.596 N/A ARG 139.A N GLU 149.A O no hydrogen 3.079 N/A ARG 139.A NE PRO 108.A O no hydrogen 2.949 N/A ARG 139.A NH2 PRO 108.A O no hydrogen 3.256 N/A LYS 140.A N GLN 96.A O no hydrogen 2.885 N/A LYS 140.A NZ ILE 97.A O no hydrogen 3.273 N/A GLU 141.A N GLU 149.A OE2 no hydrogen 2.961 N/A LYS 145.A N ASP 143.A OD1 no hydrogen 3.024 N/A LYS 145.A N ASP 143.A OD2 no hydrogen 3.285 N/A GLU 146.A N ASP 143.A OD2 no hydrogen 2.791 N/A HIS 147.A ND1 ASP 143.A OD2 no hydrogen 2.999 N/A PHE 151.A N CYS 137.A O no hydrogen 3.037 N/A THR 152.A N GLU 228.A OE1 no hydrogen 2.822 N/A THR 152.A OG1 GLU 228.A OE2 no hydrogen 2.855 N/A MET 153.A N GLY 135.A O no hydrogen 2.926 N/A LEU 154.A N PHE 225.A O no hydrogen 2.775 N/A ASN 155.A N GLU 133.A O no hydrogen 3.041 N/A PHE 156.A N ALA 223.A O no hydrogen 3.228 N/A CYS 157.A N ILE 131.A O no hydrogen 2.850 N/A CYS 157.A SG ILE 131.A O no hydrogen 4.039 N/A GLN 158.A N ILE 221.A O no hydrogen 2.956 N/A MET 159.A N ILE 129.A O no hydrogen 2.901 N/A GLY 160.A N PRO 219.A O no hydrogen 2.891 N/A SER 161.A N ASP 127.A OD1 no hydrogen 2.742 N/A SER 161.A OG ASP 127.A OD1 no hydrogen 2.738 N/A CYS 163.A SG GLN 158.A O no hydrogen 3.181 N/A CYS 163.A SG GLY 160.A O no hydrogen 3.451 N/A CYS 163.A SG SER 161.A O no hydrogen 3.611 N/A CYS 163.A SG PRO 219.A O no hydrogen 3.628 N/A THR 164.A N GLY 162.A O no hydrogen 2.993 N/A ARG 165.A NE GLU 169.A OE2 no hydrogen 2.680 N/A ARG 165.A NH1 ASP 189.A OD1 no hydrogen 3.346 N/A ASN 167.A N THR 164.A OG1 no hydrogen 3.246 N/A LEU 168.A N THR 164.A O no hydrogen 2.971 N/A GLU 169.A N ARG 165.A O no hydrogen 2.852 N/A SER 170.A N GLU 166.A O no hydrogen 2.963 N/A ILE 171.A N ASN 167.A O no hydrogen 2.946 N/A ILE 172.A N LEU 168.A O no hydrogen 2.985 N/A THR 173.A N GLU 169.A O no hydrogen 2.845 N/A THR 173.A OG1 GLU 169.A O no hydrogen 2.698 N/A ASP 174.A N SER 170.A O no hydrogen 2.952 N/A PHE 175.A N ILE 171.A O no hydrogen 2.924 N/A LEU 176.A N ILE 172.A O no hydrogen 3.033 N/A ASN 177.A N THR 173.A O no hydrogen 3.066 N/A HIS 178.A N ASP 174.A O no hydrogen 2.969 N/A LEU 179.A N PHE 175.A O no hydrogen 3.130 N/A GLY 180.A N ASN 177.A O no hydrogen 3.379 N/A ILE 181.A N LEU 176.A O no hydrogen 2.968 N/A LYS 184.A N MET 194.A O no hydrogen 2.877 N/A VAL 186.A N ASP 192.A O no hydrogen 2.904 N/A LEU 191.A N ALA 203.A O no hydrogen 2.747 N/A ASP 192.A N VAL 186.A O no hydrogen 2.830 N/A VAL 193.A N SER 201.A O no hydrogen 2.865 N/A MET 194.A N LYS 184.A O no hydrogen 2.856 N/A HIS 195.A N LEU 198.A O no hydrogen 2.906 N/A LEU 198.A N HIS 195.A O no hydrogen 2.869 N/A LEU 200.A N VAL 193.A O no hydrogen 2.826 N/A SER 201.A N VAL 193.A O no hydrogen 3.190 N/A SER 201.A OG GLY 224.A O no hydrogen 2.855 N/A SER 202.A N GLY 224.A O no hydrogen 3.394 N/A SER 202.A OG ASP 192.A OD2 no hydrogen 3.007 N/A SER 202.A OG GLU 199.A OE2 no hydrogen 3.443 N/A ALA 203.A N LEU 191.A O no hydrogen 2.836 N/A VAL 204.A N GLY 222.A O no hydrogen 2.899 N/A VAL 205.A N ASP 189.A O no hydrogen 2.801 N/A GLY 206.A N TRP 220.A O no hydrogen 2.619 N/A ILE 208.A N ASP 211.A OD1 no hydrogen 2.816 N/A ASP 211.A N ILE 208.A O no hydrogen 2.864 N/A ARG 212.A N PRO 209.A O no hydrogen 3.333 N/A GLU 213.A N LEU 210.A O no hydrogen 3.112 N/A TRP 214.A N ASP 211.A O no hydrogen 3.071 N/A TRP 214.A NE1 ARG 84.A O no hydrogen 3.100 N/A GLY 215.A N ARG 212.A O no hydrogen 3.184 N/A ILE 216.A N ASP 211.A O no hydrogen 3.002 N/A LYS 218.A NZ ASP 122.A OD1 no hydrogen 2.888 N/A LYS 218.A NZ ASP 127.A OD2 no hydrogen 3.170 N/A TRP 220.A NE1 ASP 211.A OD1 no hydrogen 2.783 N/A ILE 221.A N GLN 158.A O no hydrogen 2.921 N/A GLY 222.A N VAL 204.A O no hydrogen 3.187 N/A ALA 223.A N PHE 156.A O no hydrogen 3.210 N/A GLY 224.A N SER 202.A O no hydrogen 3.039 N/A PHE 225.A N LEU 154.A O no hydrogen 2.649 N/A LEU 227.A N THR 152.A O no hydrogen 2.773 N/A GLU 228.A N GLU 228.A OE1 no hydrogen 2.692 N/A ARG 229.A NE GLU 146.A O no hydrogen 2.928 N/A ARG 229.A NH1 GLU 199.A O no hydrogen 2.678 N/A ARG 229.A NH2 GLU 146.A O no hydrogen 2.799 N/A LEU 230.A N GLY 226.A O no hydrogen 3.182 N/A LEU 231.A N LEU 227.A O no hydrogen 2.926 N/A LYS 232.A N GLU 228.A O no hydrogen 2.801 N/A VAL 233.A N ARG 229.A O no hydrogen 3.075 N/A LYS 234.A N LEU 230.A O no hydrogen 2.924 N/A HIS 235.A N LEU 231.A O no hydrogen 2.881 N/A ASP 236.A N VAL 233.A O no hydrogen 3.214 N/A ARG 242.A N ASN 239.A O no hydrogen 3.177 N/A ARG 242.A NH1 LEU 15.A O no hydrogen 2.665 N/A ARG 242.A NH1 ASN 16.A OD1 no hydrogen 3.558 N/A ARG 242.A NH2 LEU 15.A O no hydrogen 2.626 N/A ALA 243.A N ILE 240.A O no hydrogen 3.049 N/A ALA 244.A N LYS 241.A O no hydrogen 3.377 N/A SER 248.A N SER 246.A OG no hydrogen 2.711 N/A TYR 250.A N ILE 253.A O no hydrogen 2.793 N/A ASN 251.A ND2 GLU 49.A O no hydrogen 2.962 N/A ILE 253.A N TYR 250.A O no hydrogen 2.806 N/A THR 255.A N SER 248.A O no hydrogen 3.084 N/A THR 255.A OG1 GLY 247.A O no hydrogen 2.752 N/A ASN 256.A N SER 254.A OG no hydrogen 3.189 N/A