Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xq1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N GLN 2.A O no hydrogen 3.365 N/A LYS 7.A N SER 5.A OG no hydrogen 3.175 N/A ALA 8.A N GLY 32.A O no hydrogen 2.796 N/A LYS 9.A N LEU 6.A O no hydrogen 3.029 N/A THR 10.A N ASP 88.A OD2 no hydrogen 3.022 N/A THR 10.A OG1 ASP 88.A OD2 no hydrogen 3.385 N/A VAL 11.A N VAL 34.A O no hydrogen 2.743 N/A LEU 12.A N ILE 89.A O no hydrogen 2.979 N/A VAL 13.A N HIS 36.A O no hydrogen 2.971 N/A THR 14.A N ILE 91.A O no hydrogen 3.388 N/A THR 14.A OG1 ILE 91.A O no hydrogen 3.471 N/A THR 14.A OG1 ASN 93.A O no hydrogen 3.160 N/A HIS 22.A N LYS 18.A O no hydrogen 3.166 N/A ALA 23.A N GLY 19.A O no hydrogen 3.088 N/A ILE 24.A N ILE 20.A O no hydrogen 2.644 N/A VAL 25.A N GLY 21.A O no hydrogen 2.969 N/A GLU 26.A N HIS 22.A O no hydrogen 3.179 N/A GLU 27.A N ALA 23.A O no hydrogen 2.921 N/A PHE 28.A N ILE 24.A O no hydrogen 3.035 N/A ALA 29.A N VAL 25.A O no hydrogen 2.870 N/A GLY 30.A N GLU 26.A O no hydrogen 2.848 N/A GLY 30.A N GLU 27.A O no hydrogen 3.157 N/A PHE 31.A N PHE 28.A O no hydrogen 2.943 N/A GLY 32.A N ALA 29.A O no hydrogen 3.043 N/A ALA 33.A N PHE 28.A O no hydrogen 3.212 N/A VAL 34.A N LYS 9.A O no hydrogen 2.824 N/A ILE 35.A N GLN 58.A O no hydrogen 2.983 N/A HIS 36.A N VAL 11.A O no hydrogen 2.739 N/A HIS 36.A ND1 THR 60.A OG1 no hydrogen 2.744 N/A HIS 36.A NE2 SER 62.A OG no hydrogen 2.918 N/A THR 37.A N THR 60.A O no hydrogen 2.971 N/A THR 37.A OG1 VAL 13.A O no hydrogen 2.630 N/A GLU 44.A N ASN 41.A OD1 no hydrogen 2.933 N/A LEU 45.A N ASN 41.A O no hydrogen 3.148 N/A ASN 46.A N GLU 42.A O no hydrogen 2.886 N/A GLU 47.A N TYR 43.A O no hydrogen 2.895 N/A CYS 48.A N GLU 44.A O no hydrogen 2.953 N/A CYS 48.A SG THR 17.A O no hydrogen 3.658 N/A CYS 48.A SG HIS 22.A ND1 no hydrogen 3.795 N/A CYS 48.A SG GLU 44.A O no hydrogen 3.477 N/A LEU 49.A N LEU 45.A O no hydrogen 2.854 N/A SER 50.A N ASN 46.A O no hydrogen 2.949 N/A LYS 51.A N GLU 47.A O no hydrogen 3.146 N/A LYS 51.A NZ GLU 47.A OE2 no hydrogen 3.451 N/A TRP 52.A N CYS 48.A O no hydrogen 2.862 N/A TRP 52.A NE1 GLU 26.A OE1 no hydrogen 3.002 N/A GLN 53.A N LEU 49.A O no hydrogen 3.012 N/A LYS 54.A N SER 50.A O no hydrogen 3.408 N/A GLY 56.A N GLN 53.A O no hydrogen 3.132 N/A PHE 57.A N TRP 52.A O no hydrogen 3.031 N/A THR 60.A N ILE 35.A O no hydrogen 2.881 N/A THR 60.A OG1 ILE 35.A O no hydrogen 3.533 N/A THR 60.A OG1 HIS 36.A ND1 no hydrogen 2.744 N/A SER 62.A N THR 37.A O no hydrogen 3.148 N/A SER 62.A OG HIS 36.A NE2 no hydrogen 2.918 N/A CYS 64.A N ALA 39.A O no hydrogen 2.819 N/A CYS 64.A SG GLU 71.A O no hydrogen 3.469 N/A ASP 65.A N GLU 71.A OE1 no hydrogen 3.235 N/A SER 67.A N ASP 65.A OD2 no hydrogen 3.090 N/A SER 67.A OG ASP 65.A OD1 no hydrogen 3.338 N/A SER 67.A OG ASP 65.A OD2 no hydrogen 2.589 N/A LEU 68.A N ASP 65.A O no hydrogen 2.848 N/A ARG 72.A N LEU 68.A O no hydrogen 3.024 N/A ARG 72.A NE HIS 117.A ND1 no hydrogen 2.816 N/A ARG 72.A NH1 HIS 117.A ND1 no hydrogen 3.298 N/A ARG 72.A NH2 ALA 66.A O no hydrogen 2.847 N/A GLU 73.A N ARG 69.A O no hydrogen 3.104 N/A LYS 74.A N PRO 70.A O no hydrogen 3.128 N/A LEU 75.A N GLU 71.A O no hydrogen 3.005 N/A MET 76.A N ARG 72.A O no hydrogen 3.127 N/A GLN 77.A N GLU 73.A O no hydrogen 3.072 N/A THR 78.A N LYS 74.A O no hydrogen 2.943 N/A THR 78.A OG1 LYS 74.A O no hydrogen 3.102 N/A VAL 79.A N LEU 75.A O no hydrogen 2.978 N/A SER 80.A N MET 76.A O no hydrogen 2.909 N/A SER 81.A N GLN 77.A O no hydrogen 3.138 N/A SER 81.A OG THR 78.A O no hydrogen 3.026 N/A MET 82.A N THR 78.A O no hydrogen 3.182 N/A PHE 83.A N VAL 79.A O no hydrogen 3.003 N/A GLY 85.A N SER 80.A O no hydrogen 2.638 N/A LEU 87.A N LEU 125.A O no hydrogen 3.222 N/A ASP 88.A N THR 10.A OG1 no hydrogen 3.078 N/A ILE 89.A N THR 10.A O no hydrogen 2.944 N/A LEU 90.A N ASN 133.A O no hydrogen 2.830 N/A ILE 91.A N LEU 12.A O no hydrogen 2.839 N/A ASN 92.A N ILE 135.A O no hydrogen 2.728 N/A ASN 92.A ND2 SER 119.A OG no hydrogen 3.269 N/A ASN 93.A N THR 14.A OG1 no hydrogen 2.957 N/A ASN 93.A ND2 THR 14.A O no hydrogen 3.115 N/A ASN 93.A ND2 GLY 15.A O no hydrogen 3.320 N/A LEU 94.A N MET 137.A O no hydrogen 3.281 N/A THR 100.A N ASP 103.A OD1 no hydrogen 3.247 N/A GLU 102.A N GLU 102.A OE2 no hydrogen 2.779 N/A ASP 103.A N THR 100.A OG1 no hydrogen 3.222 N/A PHE 104.A N THR 100.A O no hydrogen 2.902 N/A SER 105.A N ALA 101.A O no hydrogen 2.758 N/A PHE 106.A N GLU 102.A O no hydrogen 2.774 N/A HIS 107.A N ASP 103.A O no hydrogen 2.937 N/A HIS 107.A ND1 ASP 103.A O no hydrogen 2.822 N/A ILE 108.A N PHE 104.A O no hydrogen 3.141 N/A SER 109.A N SER 105.A O no hydrogen 3.005 N/A SER 109.A OG SER 105.A O no hydrogen 3.324 N/A SER 109.A OG PHE 106.A O no hydrogen 3.329 N/A THR 110.A N PHE 106.A O no hydrogen 2.815 N/A ASN 111.A N HIS 107.A O no hydrogen 3.127 N/A LEU 112.A N ILE 108.A O no hydrogen 3.012 N/A GLU 113.A N SER 109.A O no hydrogen 2.892 N/A SER 114.A N THR 110.A O no hydrogen 3.037 N/A SER 114.A OG THR 110.A O no hydrogen 2.964 N/A SER 114.A OG ASN 111.A O no hydrogen 2.812 N/A ALA 115.A N ASN 111.A O no hydrogen 3.102 N/A TYR 116.A N LEU 112.A O no hydrogen 3.090 N/A HIS 117.A N GLU 113.A O no hydrogen 2.851 N/A LEU 118.A N SER 114.A O no hydrogen 2.877 N/A SER 119.A N ALA 115.A O no hydrogen 3.138 N/A SER 119.A OG ALA 115.A O no hydrogen 2.732 N/A GLN 120.A N TYR 116.A O no hydrogen 3.061 N/A LEU 121.A N HIS 117.A O no hydrogen 2.844 N/A ALA 122.A N LEU 118.A O no hydrogen 3.044 N/A HIS 123.A N SER 119.A O no hydrogen 2.854 N/A LEU 126.A N ALA 122.A O no hydrogen 2.732 N/A LYS 127.A N HIS 123.A O no hydrogen 2.743 N/A ALA 128.A N PRO 124.A O no hydrogen 3.030 N/A SER 129.A N LEU 125.A O no hydrogen 3.252 N/A SER 129.A N LEU 126.A O no hydrogen 3.150 N/A SER 129.A OG LEU 126.A O no hydrogen 2.660 N/A GLY 130.A N LYS 127.A O no hydrogen 2.975 N/A CYS 131.A N SER 129.A OG no hydrogen 3.008 N/A CYS 131.A SG SER 129.A O no hydrogen 3.946 N/A ASN 133.A N ASP 88.A O no hydrogen 2.790 N/A ILE 134.A N ARG 166.A O no hydrogen 2.919 N/A ILE 135.A N LEU 90.A O no hydrogen 2.860 N/A PHE 136.A N ASN 168.A O no hydrogen 2.975 N/A MET 137.A N ASN 92.A O no hydrogen 2.867 N/A SER 138.A N VAL 170.A O no hydrogen 3.325 N/A ILE 141.A N GLY 139.A O no hydrogen 2.622 N/A ALA 144.A N SER 140.A O no hydrogen 3.178 N/A THR 145.A N ILE 141.A O no hydrogen 3.117 N/A THR 145.A OG1 ILE 141.A O no hydrogen 3.077 N/A LYS 146.A N TYR 142.A O no hydrogen 2.761 N/A GLY 147.A N SER 143.A O no hydrogen 2.870 N/A ALA 148.A N ALA 144.A O no hydrogen 3.087 N/A LEU 149.A N THR 145.A O no hydrogen 2.791 N/A ASN 150.A N LYS 146.A O no hydrogen 2.927 N/A LEU 152.A N ALA 148.A O no hydrogen 3.085 N/A ALA 153.A N LEU 149.A O no hydrogen 2.890 N/A ARG 154.A N ASN 150.A O no hydrogen 2.915 N/A ASN 155.A N GLN 151.A O no hydrogen 2.942 N/A LEU 156.A N LEU 152.A O no hydrogen 2.945 N/A ALA 157.A N ALA 153.A O no hydrogen 3.076 N/A CYS 158.A N ARG 154.A O no hydrogen 3.464 N/A CYS 158.A SG ARG 154.A O no hydrogen 3.662 N/A GLU 159.A N ASN 155.A O no hydrogen 2.765 N/A TRP 160.A N LEU 156.A O no hydrogen 2.793 N/A ASP 163.A N TRP 160.A O no hydrogen 2.915 N/A GLY 164.A N ALA 161.A O no hydrogen 2.775 N/A ILE 165.A N TRP 160.A O no hydrogen 3.225 N/A ARG 166.A N GLY 132.A O no hydrogen 3.040 N/A ALA 167.A N THR 198.A OG1 no hydrogen 3.060 N/A ASN 168.A N ILE 134.A O no hydrogen 3.041 N/A ASN 168.A ND2 ILE 197.A O no hydrogen 2.877 N/A ALA 169.A N GLN 200.A O no hydrogen 2.828 N/A VAL 170.A N PHE 136.A O no hydrogen 3.000 N/A ALA 171.A N ILE 202.A O no hydrogen 2.834 N/A VAL 174.A N ASP 205.A OD1 no hydrogen 2.646 N/A ILE 175.A N ASP 205.A OD1 no hydrogen 2.530 N/A GLU 181.A N GLU 178.A O no hydrogen 2.963 N/A VAL 182.A N PRO 179.A O no hydrogen 3.313 N/A SER 183.A N GLU 180.A O no hydrogen 3.130 N/A SER 183.A OG GLU 27.A OE1 no hydrogen 2.673 N/A SER 183.A OG GLU 180.A O no hydrogen 3.068 N/A SER 184.A N GLU 181.A O no hydrogen 3.248 N/A SER 184.A OG GLU 181.A O no hydrogen 3.305 N/A LEU 185.A N VAL 182.A O no hydrogen 2.990 N/A VAL 186.A N VAL 182.A O no hydrogen 3.189 N/A ALA 187.A N SER 183.A O no hydrogen 2.922 N/A PHE 188.A N SER 184.A O no hydrogen 2.916 N/A LEU 189.A N LEU 185.A O no hydrogen 2.951 N/A CYS 190.A N ALA 187.A O no hydrogen 2.955 N/A CYS 190.A SG VAL 186.A O no hydrogen 3.365 N/A MET 191.A N PHE 188.A O no hydrogen 2.905 N/A ALA 193.A N ARG 3.A O no hydrogen 2.748 N/A ALA 194.A N MET 191.A O no hydrogen 2.849 N/A SER 195.A N PRO 192.A O no hydrogen 2.984 N/A SER 195.A OG PRO 192.A O no hydrogen 3.051 N/A ILE 197.A N ALA 194.A O no hydrogen 2.889 N/A THR 198.A OG1 ALA 167.A O no hydrogen 3.462 N/A GLY 199.A N ALA 167.A O no hydrogen 2.696 N/A GLN 200.A N ASN 168.A OD1 no hydrogen 2.745 N/A GLN 200.A NE2 THR 198.A O no hydrogen 3.562 N/A ILE 202.A N ALA 169.A O no hydrogen 3.023 N/A CYS 203.A SG PRO 172.A O no hydrogen 3.599 N/A VAL 204.A N ALA 171.A O no hydrogen 3.249 N/A GLY 206.A N ILE 175.A O no hydrogen 2.727 N/A GLY 207.A N ASP 205.A OD2 no hydrogen 2.851 N/A LEU 208.A N TYR 215.A O no hydrogen 3.281 N/A VAL 210.A N PHE 213.A O no hydrogen 2.642 N/A PHE 213.A N VAL 210.A O no hydrogen 2.622 N/A TYR 215.A N LEU 208.A O no hydrogen 2.662 N/A