Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1boq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLN 73.A OE1 no hydrogen 2.865 N/A ILE 3.A N THR 74.A O no hydrogen 2.718 N/A GLY 5.A N ARG 78.A O no hydrogen 2.686 N/A GLY 6.A N VAL 19.A O no hydrogen 2.758 N/A TYR 9.A N CYS 17.A O no hydrogen 3.179 N/A TYR 9.A OH THR 33.A OG1 no hydrogen 2.668 N/A SER 10.A N ARG 45.A O no hydrogen 2.958 N/A ILE 11.A N SER 15.A O no hydrogen 2.859 N/A ASN 12.A N THR 43.A O no hydrogen 2.842 N/A ALA 14.A N ILE 11.A O no hydrogen 2.964 N/A CYS 17.A N TYR 9.A O no hydrogen 3.080 N/A CYS 17.A SG LEU 16.A O no hydrogen 3.278 N/A SER 18.A N SER 143.A O no hydrogen 2.900 N/A SER 18.A OG GLY 141.A O no hydrogen 3.127 N/A VAL 19.A N ILE 7.A O no hydrogen 2.820 N/A GLY 20.A N VAL 32.A O no hydrogen 2.874 N/A PHE 21.A N VAL 32.A O no hydrogen 3.400 N/A SER 22.A OG LEU 76.A O no hydrogen 3.107 N/A VAL 23.A N GLY 30.A O no hydrogen 3.067 N/A THR 24.A N SER 194.A O no hydrogen 2.862 N/A ARG 25.A N THR 28.A O no hydrogen 2.808 N/A ARG 25.A NE TYR 191.A O no hydrogen 3.104 N/A THR 28.A N ARG 25.A O no hydrogen 3.208 N/A THR 28.A OG1 ARG 25.A O no hydrogen 3.427 N/A LYS 29.A NZ SER 71.A O no hydrogen 2.969 N/A LYS 29.A NZ GLN 73.A O no hydrogen 2.826 N/A GLY 30.A N VAL 23.A O no hydrogen 3.156 N/A PHE 31.A N VAL 67.A O no hydrogen 3.133 N/A VAL 32.A N PHE 21.A O no hydrogen 2.875 N/A THR 33.A N ALA 65.A O no hydrogen 3.080 N/A THR 33.A OG1 TYR 9.A OH no hydrogen 2.668 N/A THR 33.A OG1 SER 18.A O no hydrogen 3.263 N/A HIS 36.A N ASP 63.A OD1 no hydrogen 2.785 N/A HIS 36.A ND1 ASP 63.A OD2 no hydrogen 3.002 N/A CYS 37.A N ALA 34.A O no hydrogen 3.067 N/A ASN 41.A N PHE 54.A O no hydrogen 2.836 N/A ALA 42.A N THR 39.A O no hydrogen 3.013 N/A THR 43.A N ASN 12.A OD1 no hydrogen 2.850 N/A ALA 44.A N GLY 52.A O no hydrogen 2.991 N/A ARG 45.A N SER 10.A O no hydrogen 2.995 N/A ILE 46.A N ALA 49.A O no hydrogen 2.920 N/A VAL 51.A N ALA 44.A O no hydrogen 3.064 N/A THR 53.A N SER 68.A O no hydrogen 3.067 N/A PHE 54.A N ALA 42.A O no hydrogen 2.909 N/A ALA 55.A N TRP 66.A O no hydrogen 2.794 N/A ARG 57.A NE GLY 35.A O no hydrogen 2.955 N/A ARG 57.A NE GLY 38.A O no hydrogen 2.974 N/A ARG 57.A NH2 GLY 35.A O no hydrogen 3.093 N/A VAL 58.A N ARG 64.A O no hydrogen 2.975 N/A GLY 61.A N ALA 127.A O no hydrogen 2.808 N/A ASP 63.A N GLU 182.A OE2 no hydrogen 2.951 N/A ARG 64.A N VAL 58.A O no hydrogen 3.104 N/A ARG 64.A NE GLU 182.A OE2 no hydrogen 2.836 N/A ARG 64.A NH1 GLN 190.A OE1 no hydrogen 2.886 N/A ARG 64.A NH2 GLU 182.A OE2 no hydrogen 2.978 N/A ALA 65.A N THR 33.A O no hydrogen 3.140 N/A TRP 66.A N ALA 56.A O no hydrogen 3.164 N/A VAL 67.A N PHE 31.A O no hydrogen 3.160 N/A SER 68.A N THR 53.A O no hydrogen 2.929 N/A SER 68.A OG THR 53.A O no hydrogen 3.404 N/A LEU 69.A N LYS 29.A O no hydrogen 2.823 N/A THR 70.A N VAL 51.A O no hydrogen 2.760 N/A GLN 73.A N THR 70.A O no hydrogen 3.105 N/A GLN 73.A NE2 THR 70.A OG1 no hydrogen 2.982 N/A THR 74.A N ALA 1.A O no hydrogen 3.086 N/A LEU 76.A N ILE 3.A O no hydrogen 3.139 N/A VAL 79.A N VAL 86.A O no hydrogen 2.811 N/A ALA 80.A N GLY 5.A O no hydrogen 2.933 N/A ASN 81.A N SER 84.A O no hydrogen 3.130 N/A SER 84.A N ASN 81.A O no hydrogen 3.025 N/A VAL 86.A N VAL 79.A O no hydrogen 2.838 N/A VAL 88.A N PRO 77.A O no hydrogen 2.903 N/A ARG 89.A N GLY 152.A O no hydrogen 2.827 N/A THR 92.A N GLN 153.A OE1 no hydrogen 3.020 N/A THR 92.A OG1 GLN 153.A OE1 no hydrogen 3.208 N/A ALA 94.A N GLN 155.A OE1 no hydrogen 2.797 N/A GLY 97.A N ILE 114.A O no hydrogen 2.883 N/A ALA 98.A N ALA 95.A O no hydrogen 2.957 N/A VAL 100.A N GLY 112.A O no hydrogen 2.805 N/A CYS 101.A N ILE 148.A O no hydrogen 2.883 N/A CYS 101.A SG TYR 109.A OH no hydrogen 3.274 N/A ARG 102.A N GLN 110.A O no hydrogen 2.797 N/A ARG 102.A NH1 THR 107.A OG1 no hydrogen 2.895 N/A ARG 102.A NH1 GLY 108.A O no hydrogen 3.558 N/A ARG 102.A NH1 CYS 137.A O no hydrogen 2.862 N/A ARG 102.A NH2 GLY 108.A O no hydrogen 3.178 N/A SER 103.A N SER 146.A O no hydrogen 2.869 N/A SER 103.A OG ALA 80.A O no hydrogen 2.830 N/A ARG 105.A N SER 18.A OG no hydrogen 3.007 N/A ARG 105.A NE GLU 8.A OE1 no hydrogen 2.837 N/A ARG 105.A NH1 THR 106.A OG1 no hydrogen 2.606 N/A ARG 105.A NH2 GLU 8.A OE1 no hydrogen 2.916 N/A THR 106.A N ASP 142.A OD1 no hydrogen 2.951 N/A THR 106.A OG1 ARG 140.A O no hydrogen 2.743 N/A THR 107.A N ASP 142.A OD1 no hydrogen 3.133 N/A THR 107.A N ASP 142.A OD2 no hydrogen 3.372 N/A THR 107.A OG1 ASP 142.A OD2 no hydrogen 2.820 N/A GLY 108.A N GLY 104.A O no hydrogen 2.952 N/A GLN 110.A N ARG 102.A O no hydrogen 2.996 N/A GLN 110.A NE2 THR 107.A O no hydrogen 2.844 N/A GLY 112.A N VAL 100.A O no hydrogen 2.840 N/A THR 113.A N ASN 135.A OD1 no hydrogen 2.928 N/A ILE 114.A N ALA 98.A O no hydrogen 2.918 N/A THR 115.A N GLN 133.A O no hydrogen 2.785 N/A THR 115.A OG1 GLN 133.A O no hydrogen 3.338 N/A ALA 116.A N GLN 133.A O no hydrogen 3.439 N/A LYS 117.A NZ ALA 94.A O no hydrogen 2.723 N/A ILE 119.A N LEU 131.A O no hydrogen 2.817 N/A ALA 121.A N VAL 128.A O no hydrogen 2.929 N/A TYR 123.A N GLY 126.A O no hydrogen 3.087 N/A TYR 123.A OH SER 159.A OG no hydrogen 2.797 N/A GLU 125.A N GLU 125.A OE1 no hydrogen 2.782 N/A GLY 126.A N TYR 123.A O no hydrogen 2.897 N/A VAL 128.A N ALA 121.A O no hydrogen 2.903 N/A ARG 129.A N GLY 61.A O no hydrogen 2.811 N/A LEU 131.A N ILE 119.A O no hydrogen 2.870 N/A THR 132.A N PHE 181.A O no hydrogen 2.938 N/A GLN 133.A N ALA 116.A O no hydrogen 2.811 N/A GLN 133.A NE2 THR 115.A OG1 no hydrogen 2.945 N/A GLY 134.A N SER 179.A O no hydrogen 3.048 N/A ASN 135.A N THR 113.A O no hydrogen 2.993 N/A MET 138.A N ASN 169.A OD1 no hydrogen 2.872 N/A GLY 139.A N ASP 142.A OD2 no hydrogen 2.769 N/A ARG 140.A N GLY 167.A O no hydrogen 2.876 N/A ASP 142.A N GLY 139.A O no hydrogen 3.115 N/A SER 143.A OG HIS 36.A NE2 no hydrogen 2.899 N/A SER 143.A OG SER 159.A O no hydrogen 3.525 N/A GLY 144.A N MET 158.A O no hydrogen 2.741 N/A GLY 145.A N ASP 142.A O no hydrogen 2.985 N/A SER 146.A OG GLY 20.A O no hydrogen 2.753 N/A TRP 147.A N GLY 156.A O no hydrogen 2.869 N/A ILE 148.A N CYS 101.A O no hydrogen 2.870 N/A THR 149.A N GLN 153.A O no hydrogen 2.989 N/A GLY 152.A N THR 149.A O no hydrogen 2.992 N/A GLN 153.A N THR 149.A OG1 no hydrogen 3.107 N/A ALA 154.A N GLY 90.A O no hydrogen 2.926 N/A GLN 155.A N TRP 147.A O no hydrogen 2.808 N/A GLN 155.A NE2 THR 92.A O no hydrogen 2.869 N/A GLN 155.A NE2 GLN 153.A O no hydrogen 2.929 N/A GLY 156.A N TRP 147.A O no hydrogen 3.394 N/A VAL 157.A N GLU 182.A O no hydrogen 2.895 N/A MET 158.A N GLY 145.A O no hydrogen 2.835 N/A SER 159.A N LEU 180.A O no hydrogen 2.890 N/A SER 159.A OG ASP 63.A OD2 no hydrogen 2.713 N/A SER 159.A OG TYR 123.A OH no hydrogen 2.797 N/A GLY 160.A N LEU 180.A O no hydrogen 3.263 N/A ASN 162.A N SER 178.A O no hydrogen 2.916 N/A ASN 162.A ND2 GLN 176.A O no hydrogen 2.978 N/A VAL 163.A N GLY 161.A O no hydrogen 2.814 N/A GLN 164.A N ASN 168.A O no hydrogen 2.840 N/A GLN 164.A NE2 ASN 162.A O no hydrogen 2.819 N/A ASN 166.A ND2 ASN 168.A OD1 no hydrogen 3.311 N/A GLY 167.A N GLN 164.A O no hydrogen 3.020 N/A ASN 168.A N ASN 166.A OD1 no hydrogen 3.201 N/A ASN 169.A N MET 138.A O no hydrogen 2.947 N/A ASN 169.A ND2 ASN 162.A OD1 no hydrogen 3.168 N/A ASN 169.A ND2 SER 179.A OG no hydrogen 3.223 N/A CYS 170.A N ASN 168.A OD1 no hydrogen 2.772 N/A GLN 176.A N PRO 173.A O no hydrogen 2.739 N/A ARG 177.A N ALA 174.A O no hydrogen 3.091 N/A ARG 177.A NE ASN 169.A O no hydrogen 3.149 N/A ARG 177.A NE ILE 172.A O no hydrogen 3.168 N/A ARG 177.A NH1 ASN 135.A O no hydrogen 2.992 N/A ARG 177.A NH2 ILE 172.A O no hydrogen 3.285 N/A SER 178.A N ASN 162.A OD1 no hydrogen 2.831 N/A SER 178.A OG GLN 133.A OE1 no hydrogen 2.864 N/A SER 179.A N GLY 134.A O no hydrogen 3.246 N/A SER 179.A OG ALA 136.A O no hydrogen 2.698 N/A LEU 180.A N GLY 160.A O no hydrogen 2.719 N/A PHE 181.A N THR 132.A O no hydrogen 3.007 N/A GLU 182.A N VAL 157.A O no hydrogen 2.908 N/A ARG 183.A NE GLU 93.A OE1 no hydrogen 3.101 N/A ARG 183.A NE GLU 93.A OE2 no hydrogen 3.458 N/A ARG 183.A NH2 GLU 93.A OE1 no hydrogen 3.125 N/A ARG 183.A NH2 GLN 185.A OE1 no hydrogen 3.528 N/A LEU 184.A N GLN 155.A O no hydrogen 2.927 N/A GLN 185.A NE2 SER 91.A O no hydrogen 2.924 N/A LEU 188.A N LEU 184.A O no hydrogen 3.067 N/A SER 189.A N GLN 185.A O no hydrogen 3.167 N/A SER 189.A OG GLN 185.A O no hydrogen 3.361 N/A SER 189.A OG PRO 186.A O no hydrogen 3.485 N/A GLN 190.A N PRO 186.A O no hydrogen 2.984 N/A TYR 191.A N ILE 187.A O no hydrogen 3.203 N/A GLY 192.A N SER 189.A O no hydrogen 3.182 N/A LEU 193.A N LEU 188.A O no hydrogen 2.854 N/A SER 194.A N THR 24.A O no hydrogen 2.790 N/A VAL 196.A N SER 22.A O no hydrogen 2.959 N/A GLY 198.A N VAL 88.A O no hydrogen 2.888 N/A