Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qyu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N ASN 41.A O no hydrogen 3.051 N/A VAL 11.A N ILE 19.A O no hydrogen 2.787 N/A TYR 12.A N ILE 19.A O no hydrogen 3.414 N/A TYR 12.A OH ASP 14.A OD2 no hydrogen 2.729 N/A ASP 14.A N ILE 17.A O no hydrogen 3.027 N/A ASP 16.A N ASP 14.A OD1 no hydrogen 2.646 N/A ILE 17.A N ASP 14.A OD1 no hydrogen 2.814 N/A ILE 18.A N VAL 71.A O no hydrogen 2.914 N/A ILE 19.A N TYR 12.A O no hydrogen 2.779 N/A ASN 21.A N ASP 9.A O no hydrogen 2.926 N/A LYS 22.A N GLY 68.A O no hydrogen 2.770 N/A LYS 22.A NZ PRO 23.A O no hydrogen 2.987 N/A LYS 22.A NZ LEU 26.A O no hydrogen 2.849 N/A LYS 22.A NZ ASP 63.A O no hydrogen 3.007 N/A LYS 22.A NZ LYS 64.A O no hydrogen 3.037 N/A LYS 22.A NZ THR 66.A O no hydrogen 2.879 N/A ARG 24.A NH1 ASP 194.A OD1 no hydrogen 3.082 N/A ARG 24.A NH2 ASP 194.A OD1 no hydrogen 3.337 N/A ASP 25.A N ASP 65.A OD1 no hydrogen 3.048 N/A LEU 26.A N LYS 64.A O no hydrogen 3.103 N/A HIS 29.A ND1 PRO 30.A O no hydrogen 2.844 N/A GLY 31.A N ASN 34.A O no hydrogen 2.806 N/A ASN 34.A N GLY 31.A O no hydrogen 2.771 N/A GLY 37.A N GLN 4.A OE1 no hydrogen 2.567 N/A THR 38.A N ASN 41.A OD1 no hydrogen 2.815 N/A THR 38.A OG1 VAL 28.A O no hydrogen 3.547 N/A THR 38.A OG1 ASN 41.A OD1 no hydrogen 2.844 N/A VAL 39.A N VAL 27.A O no hydrogen 2.902 N/A LEU 40.A N VAL 28.A O no hydrogen 3.094 N/A ASN 41.A ND2 GLU 2.A O no hydrogen 2.879 N/A ALA 42.A N THR 38.A O no hydrogen 2.968 N/A LEU 43.A N VAL 39.A O no hydrogen 2.752 N/A LEU 44.A N LEU 40.A O no hydrogen 3.048 N/A HIS 45.A N ASN 41.A O no hydrogen 3.240 N/A TYR 46.A N ALA 42.A O no hydrogen 2.905 N/A TYR 46.A OH GLU 13.A OE1 no hydrogen 2.588 N/A TYR 47.A N LEU 43.A O no hydrogen 2.813 N/A ILE 50.A N TYR 47.A O no hydrogen 2.787 N/A ALA 51.A N PRO 48.A O no hydrogen 2.925 N/A ASP 52.A N PRO 49.A O no hydrogen 3.337 N/A VAL 53.A N ILE 50.A O no hydrogen 2.920 N/A ARG 55.A NE ILE 58.A O no hydrogen 3.148 N/A ARG 55.A NH2 ILE 58.A O no hydrogen 3.275 N/A ALA 56.A N VAL 53.A O no hydrogen 2.772 N/A GLY 57.A N PRO 54.A O no hydrogen 3.082 N/A ILE 58.A N ARG 55.A O no hydrogen 3.077 N/A THR 66.A N ASP 63.A O no hydrogen 3.007 N/A THR 67.A N LEU 198.A O no hydrogen 3.230 N/A THR 67.A OG1 LEU 198.A O no hydrogen 3.517 N/A THR 67.A OG1 HIS 199.A ND1 no hydrogen 2.678 N/A GLY 68.A N LYS 22.A O no hydrogen 2.967 N/A LEU 69.A N ALA 200.A O no hydrogen 3.043 N/A VAL 70.A N HIS 60.A NE2 no hydrogen 2.746 N/A VAL 71.A N ILE 18.A O no hydrogen 2.788 N/A ALA 72.A N GLY 57.A O no hydrogen 2.877 N/A LYS 73.A N ASP 16.A O no hydrogen 2.811 N/A LYS 73.A NZ GLU 13.A OE2 no hydrogen 2.672 N/A LYS 73.A NZ ASP 14.A O no hydrogen 2.892 N/A ALA 77.A N THR 74.A OG1 no hydrogen 3.226 N/A GLN 78.A N THR 74.A O no hydrogen 2.909 N/A THR 79.A N VAL 75.A O no hydrogen 2.909 N/A THR 79.A OG1 VAL 75.A O no hydrogen 2.876 N/A THR 79.A OG1 GLN 78.A OE1 no hydrogen 3.536 N/A ARG 80.A N PRO 76.A O no hydrogen 3.206 N/A ARG 80.A NH1 PRO 207.A O no hydrogen 3.230 N/A LEU 81.A N ALA 77.A O no hydrogen 2.865 N/A VAL 82.A N GLN 78.A O no hydrogen 2.920 N/A GLU 83.A N THR 79.A O no hydrogen 3.157 N/A SER 84.A N ARG 80.A O no hydrogen 2.837 N/A SER 84.A OG ARG 80.A O no hydrogen 2.869 N/A LEU 85.A N LEU 81.A O no hydrogen 2.815 N/A GLN 86.A N VAL 82.A O no hydrogen 2.977 N/A ARG 87.A N GLU 83.A O no hydrogen 2.915 N/A ARG 88.A N LEU 85.A O no hydrogen 2.954 N/A ARG 88.A NE GLU 149.A O no hydrogen 2.764 N/A ARG 88.A NH1 GLN 86.A O no hydrogen 2.800 N/A ARG 88.A NH2 GLU 149.A O no hydrogen 3.128 N/A GLU 89.A N SER 84.A O no hydrogen 2.766 N/A THR 91.A N ARG 203.A O no hydrogen 2.766 N/A ARG 92.A NH1 LEU 69.A O no hydrogen 2.960 N/A ARG 92.A NH2 ARG 61.A O no hydrogen 3.118 N/A TYR 94.A N LEU 146.A O no hydrogen 2.961 N/A GLU 95.A N HIS 199.A O no hydrogen 2.706 N/A ALA 96.A N LEU 144.A O no hydrogen 2.825 N/A VAL 97.A N ALA 197.A O no hydrogen 3.156 N/A ALA 98.A N THR 142.A O no hydrogen 2.852 N/A ILE 99.A N PRO 165.A O no hydrogen 2.867 N/A GLY 100.A N VAL 140.A O no hydrogen 2.687 N/A GLY 105.A N TYR 133.A O no hydrogen 2.902 N/A THR 106.A OG1 HIS 132.A ND1 no hydrogen 2.752 N/A VAL 107.A N THR 131.A O no hydrogen 2.777 N/A ILE 111.A N LYS 127.A O no hydrogen 2.792 N/A SER 112.A N ALA 121.A O no hydrogen 2.901 N/A HIS 114.A N HIS 120.A O no hydrogen 2.906 N/A LYS 117.A N HIS 114.A ND1 no hydrogen 3.053 N/A ARG 118.A NH2 THR 116.A O no hydrogen 3.153 N/A THR 119.A OG1 HIS 120.A ND1 no hydrogen 3.149 N/A HIS 120.A ND1 THR 119.A OG1 no hydrogen 3.149 N/A HIS 123.A N PRO 110.A O no hydrogen 3.087 N/A MET 125.A N HIS 123.A ND1 no hydrogen 2.966 N/A GLY 126.A N HIS 123.A O no hydrogen 2.938 N/A LYS 127.A N ILE 111.A O no hydrogen 2.763 N/A VAL 130.A N THR 150.A OG1 no hydrogen 3.050 N/A THR 131.A N VAL 107.A O no hydrogen 2.830 N/A THR 131.A OG1 HIS 159.A ND1 no hydrogen 2.684 N/A HIS 132.A N ARG 147.A O no hydrogen 2.836 N/A HIS 132.A ND1 THR 106.A OG1 no hydrogen 2.752 N/A HIS 132.A NE2 GLU 149.A OE2 no hydrogen 2.705 N/A TYR 133.A N GLY 105.A O no hydrogen 2.949 N/A ARG 134.A N ARG 145.A O no hydrogen 2.952 N/A ARG 134.A NH2 GLU 93.A OE2 no hydrogen 2.772 N/A PHE 138.A N HIS 141.A O no hydrogen 3.061 N/A ARG 139.A NE ASP 230.A OD1 no hydrogen 2.722 N/A ARG 139.A NH1 LYS 180.A O no hydrogen 2.826 N/A ARG 139.A NH2 LYS 180.A O no hydrogen 2.982 N/A ARG 139.A NH2 ASP 230.A OD1 no hydrogen 3.311 N/A ARG 139.A NH2 ASP 230.A OD2 no hydrogen 2.860 N/A THR 142.A N ALA 98.A O no hydrogen 2.987 N/A THR 142.A OG1 GLY 100.A O no hydrogen 3.023 N/A ARG 143.A N GLU 136.A O no hydrogen 2.882 N/A ARG 143.A NE GLU 95.A OE2 no hydrogen 2.618 N/A ARG 143.A NH1 GLU 136.A OE1 no hydrogen 3.128 N/A ARG 143.A NH2 GLU 95.A OE2 no hydrogen 2.660 N/A LEU 144.A N ALA 96.A O no hydrogen 2.695 N/A ARG 145.A N ARG 134.A O no hydrogen 3.121 N/A ARG 145.A NE GLU 95.A OE1 no hydrogen 2.625 N/A ARG 145.A NH2 GLU 95.A OE1 no hydrogen 3.025 N/A LEU 146.A N TYR 94.A O no hydrogen 2.791 N/A ARG 147.A N HIS 132.A O no hydrogen 2.982 N/A ARG 147.A NE GLU 93.A OE2 no hydrogen 2.815 N/A ARG 147.A NH2 GLU 93.A OE2 no hydrogen 3.242 N/A GLU 149.A N VAL 130.A O no hydrogen 3.123 N/A THR 150.A OG1 GLN 155.A OE1 no hydrogen 2.596 N/A ARG 152.A N GLN 155.A OE1 no hydrogen 3.076 N/A ARG 152.A NE PRO 128.A O no hydrogen 2.805 N/A ARG 152.A NH2 PRO 128.A O no hydrogen 3.515 N/A HIS 154.A ND1 TYR 172.A OH no hydrogen 2.793 N/A GLN 155.A N ARG 152.A O no hydrogen 3.125 N/A GLN 155.A NE2 VAL 130.A O no hydrogen 3.037 N/A GLN 155.A NE2 THR 131.A OG1 no hydrogen 2.921 N/A GLN 155.A NE2 THR 150.A O no hydrogen 3.029 N/A ARG 157.A NE ASP 169.A OD2 no hydrogen 2.820 N/A ARG 157.A NH1 ASP 63.A OD2 no hydrogen 2.898 N/A ARG 157.A NH2 ASP 169.A OD1 no hydrogen 2.965 N/A VAL 158.A N HIS 154.A O no hydrogen 2.741 N/A HIS 159.A N GLN 155.A O no hydrogen 2.735 N/A HIS 159.A ND1 THR 131.A OG1 no hydrogen 2.684 N/A HIS 159.A NE2 GLU 109.A O no hydrogen 2.890 N/A HIS 161.A N VAL 158.A O no hydrogen 2.981 N/A ILE 162.A N HIS 159.A O no hydrogen 3.278 N/A THR 163.A N ALA 160.A O no hydrogen 3.053 N/A THR 163.A OG1 ILE 162.A O no hydrogen 2.397 N/A HIS 164.A ND1 ILE 99.A O no hydrogen 2.847 N/A VAL 167.A N VAL 97.A O no hydrogen 2.964 N/A GLY 168.A N GLY 174.A O no hydrogen 2.777 N/A ASP 169.A N LEU 166.A O no hydrogen 3.272 N/A VAL 171.A N ASP 169.A OD1 no hydrogen 2.864 N/A TYR 172.A N ASP 169.A OD1 no hydrogen 3.000 N/A TYR 172.A OH HIS 154.A ND1 no hydrogen 2.793 N/A GLY 174.A N ASP 169.A O no hydrogen 2.845 N/A ARG 175.A NH2 LEU 190.A O no hydrogen 2.800 N/A ARG 175.A NH2 ARG 191.A O no hydrogen 2.570 N/A PHE 186.A N SER 183.A OG no hydrogen 3.177 N/A ILE 187.A N SER 183.A O no hydrogen 2.995 N/A SER 188.A N GLU 184.A O no hydrogen 2.803 N/A THR 189.A N ALA 185.A O no hydrogen 2.779 N/A THR 189.A OG1 ALA 185.A O no hydrogen 2.685 N/A LEU 190.A N PHE 186.A O no hydrogen 2.990 N/A ARG 191.A N ILE 187.A O no hydrogen 3.026 N/A ARG 191.A NH1 ARG 191.A O no hydrogen 3.245 N/A LYS 192.A N SER 188.A O no hydrogen 2.979 N/A PHE 193.A N THR 189.A O no hydrogen 3.017 N/A ARG 195.A NE ASP 221.A OD2 no hydrogen 2.742 N/A ARG 195.A NH1 ASP 65.A O no hydrogen 2.893 N/A ARG 195.A NH1 LEU 198.A O no hydrogen 3.274 N/A ARG 195.A NH2 THR 67.A OG1 no hydrogen 3.373 N/A ARG 195.A NH2 ASP 221.A OD1 no hydrogen 3.225 N/A ARG 195.A NH2 ASP 221.A OD2 no hydrogen 3.371 N/A GLN 196.A N GLN 196.A OE1 no hydrogen 2.770 N/A GLN 196.A NE2 THR 66.A OG1 no hydrogen 2.913 N/A ALA 197.A N VAL 167.A O no hydrogen 2.805 N/A LEU 198.A N GLN 196.A O no hydrogen 2.911 N/A HIS 199.A N GLU 95.A O no hydrogen 2.915 N/A HIS 199.A ND1 THR 67.A OG1 no hydrogen 2.678 N/A HIS 199.A NE2 ALA 216.A O no hydrogen 2.859 N/A ALA 200.A N THR 67.A O no hydrogen 2.719 N/A THR 201.A N GLU 93.A O no hydrogen 2.951 N/A THR 201.A OG1 ALA 216.A O no hydrogen 2.730 N/A ARG 203.A N THR 91.A O no hydrogen 2.687 N/A ARG 203.A NE GLU 213.A OE2 no hydrogen 3.318 N/A HIS 206.A N ILE 211.A O no hydrogen 2.748 N/A HIS 206.A NE2 ASP 14.A OD2 no hydrogen 2.780 N/A ILE 208.A N HIS 206.A ND1 no hydrogen 3.019 N/A SER 209.A N HIS 206.A ND1 no hydrogen 3.126 N/A GLY 210.A N HIS 206.A O no hydrogen 2.687 N/A ILE 211.A N SER 209.A OG no hydrogen 3.269 N/A TRP 214.A N LEU 202.A O no hydrogen 2.818 N/A ALA 216.A N THR 201.A O no hydrogen 2.791 N/A GLU 223.A N GLN 220.A O no hydrogen 2.991 N/A LEU 224.A N ASP 221.A O no hydrogen 3.085 N/A GLU 226.A N VAL 222.A O no hydrogen 2.883 N/A VAL 227.A N GLU 223.A O no hydrogen 3.120 N/A ARG 228.A NE GLU 136.A OE2 no hydrogen 2.834 N/A ARG 228.A NH2 GLU 136.A OE1 no hydrogen 2.824 N/A ARG 228.A NH2 GLU 136.A OE2 no hydrogen 3.448 N/A ALA 229.A N GLU 226.A O no hydrogen 2.969 N/A ASP 230.A N VAL 227.A O no hydrogen 2.889 N/A GLU 232.A N ARG 228.A O no hydrogen 3.021 N/A GLU 233.A N ALA 229.A O no hydrogen 3.013 N/A HIS 234.A N ASP 230.A O no hydrogen 2.931 N/A LYS 235.A N PHE 231.A O no hydrogen 2.889 N/A ASP 236.A N GLU 233.A O no hydrogen 3.109 N/A GLU 237.A N HIS 234.A O no hydrogen 3.244 N/A ASP 239.A N ASP 236.A O no hydrogen 3.342 N/A TRP 240.A NE1 ASP 236.A OD1 no hydrogen 2.780 N/A LEU 241.A N VAL 238.A O no hydrogen 3.237 N/A