Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bqo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N GLU 1.A O no hydrogen 2.623 N/A VAL 6.A N ASP 2.A O no hydrogen 2.994 N/A ALA 7.A N ALA 3.A O no hydrogen 2.933 N/A GLU 8.A N GLY 4.A O no hydrogen 2.882 N/A ALA 9.A N LEU 5.A O no hydrogen 2.973 N/A GLU 10.A N VAL 6.A O no hydrogen 2.887 N/A ALA 11.A N ALA 7.A O no hydrogen 3.035 N/A VAL 12.A N GLU 8.A O no hydrogen 2.880 N/A ALA 13.A N ALA 9.A O no hydrogen 2.915 N/A ALA 14.A N GLU 10.A O no hydrogen 2.951 N/A GLY 15.A N ALA 11.A O no hydrogen 3.078 N/A TRP 16.A N VAL 12.A O no hydrogen 3.070 N/A MET 17.A N ALA 13.A O no hydrogen 2.905 N/A LEU 18.A N ALA 14.A O no hydrogen 2.950 N/A ASP 19.A N GLY 15.A O no hydrogen 3.254 N/A PHE 20.A N TRP 16.A O no hydrogen 3.012 N/A LEU 21.A N MET 17.A O no hydrogen 2.871 N/A CYS 22.A N LEU 18.A O no hydrogen 2.936 N/A LEU 23.A N ASP 19.A O no hydrogen 3.038 N/A SER 24.A N PHE 20.A O no hydrogen 2.990 N/A LEU 25.A N LEU 21.A O no hydrogen 2.830 N/A CYS 26.A N CYS 22.A O no hydrogen 2.876 N/A CYS 26.A SG CYS 22.A O no hydrogen 3.353 N/A ARG 27.A N LEU 23.A O no hydrogen 3.050 N/A ALA 28.A N SER 24.A O no hydrogen 3.021 N/A PHE 29.A N LEU 25.A O no hydrogen 2.995 N/A ARG 30.A N CYS 26.A O no hydrogen 2.845 N/A ARG 30.A NE ASP 31.A OD1 no hydrogen 2.882 N/A ARG 30.A NH2 ASP 31.A OD1 no hydrogen 3.314 N/A ARG 30.A NH2 ASP 31.A OD2 no hydrogen 3.501 N/A ASP 31.A N ARG 27.A O no hydrogen 2.778 N/A GLY 32.A N PHE 29.A O no hydrogen 3.252 N/A ARG 33.A N ALA 28.A O no hydrogen 2.886 N/A ARG 33.A NE ASP 31.A OD2 no hydrogen 3.300 N/A ARG 33.A NH1 ASP 36.A OD2 no hydrogen 2.840 N/A ARG 33.A NH2 ASP 31.A OD2 no hydrogen 2.777 N/A SER 34.A N GLY 32.A O no hydrogen 3.036 N/A PHE 37.A N ARG 33.A O no hydrogen 2.875 N/A ARG 38.A N SER 34.A O no hydrogen 2.969 N/A ARG 38.A NE GLU 35.A OE1 no hydrogen 3.313 N/A ARG 38.A NE GLU 35.A OE2 no hydrogen 3.380 N/A ARG 38.A NH2 GLU 35.A OE2 no hydrogen 2.977 N/A ARG 39.A N GLU 35.A O no hydrogen 2.990 N/A THR 40.A N ASP 36.A O no hydrogen 2.783 N/A THR 40.A OG1 ASP 36.A O no hydrogen 2.873 N/A ARG 41.A N PHE 37.A O no hydrogen 2.825 N/A ARG 41.A NE ASN 42.A OD1 no hydrogen 3.148 N/A ARG 41.A NH2 ASN 42.A OD1 no hydrogen 2.938 N/A ASN 42.A N ARG 38.A O no hydrogen 3.023 N/A SER 43.A N ARG 39.A O no hydrogen 3.044 N/A SER 43.A OG ARG 39.A O no hydrogen 3.298 N/A ALA 44.A N THR 40.A O no hydrogen 2.835 N/A GLU 45.A N ARG 41.A O no hydrogen 2.920 N/A ALA 46.A N ASN 42.A O no hydrogen 3.103 N/A ILE 47.A N SER 43.A O no hydrogen 2.996 N/A ILE 48.A N ALA 44.A O no hydrogen 2.937 N/A HIS 49.A N GLU 45.A O no hydrogen 2.959 N/A GLY 50.A N ALA 46.A O no hydrogen 3.033 N/A GLY 50.A N ILE 47.A O no hydrogen 3.104 N/A LEU 51.A N ILE 48.A O no hydrogen 3.106 N/A THR 55.A N GLN 58.A OE1 no hydrogen 3.083 N/A GLN 58.A N THR 55.A OG1 no hydrogen 3.197 N/A LEU 59.A N THR 55.A O no hydrogen 3.066 N/A ARG 60.A N ALA 56.A O no hydrogen 3.116 N/A THR 61.A N CYS 57.A O no hydrogen 3.099 N/A THR 61.A OG1 CYS 57.A O no hydrogen 3.225 N/A ILE 62.A N GLN 58.A O no hydrogen 2.867 N/A TYR 63.A N LEU 59.A O no hydrogen 2.946 N/A ILE 64.A N ARG 60.A O no hydrogen 2.939 N/A CYS 65.A N THR 61.A O no hydrogen 3.083 N/A CYS 65.A SG THR 61.A O no hydrogen 3.386 N/A GLN 66.A N ILE 62.A O no hydrogen 2.895 N/A PHE 67.A N TYR 63.A O no hydrogen 2.741 N/A LEU 68.A N ILE 64.A O no hydrogen 3.067 N/A THR 69.A N CYS 65.A O no hydrogen 3.101 N/A THR 69.A OG1 CYS 65.A O no hydrogen 3.431 N/A THR 69.A OG1 GLN 66.A O no hydrogen 2.676 N/A ARG 70.A N GLN 66.A O no hydrogen 3.094 N/A ARG 70.A NE SER 92.A OG no hydrogen 2.796 N/A ARG 70.A NH1 THR 69.A OG1 no hydrogen 3.121 N/A ILE 71.A N PHE 67.A O no hydrogen 3.014 N/A ALA 72.A N LEU 68.A O no hydrogen 2.788 N/A ALA 73.A N THR 69.A O no hydrogen 3.142 N/A ALA 73.A N ARG 70.A O no hydrogen 3.135 N/A GLY 74.A N ILE 71.A O no hydrogen 2.880 N/A THR 76.A N ALA 73.A O no hydrogen 2.905 N/A THR 76.A OG1 ALA 73.A O no hydrogen 3.544 N/A ALA 79.A N THR 76.A O no hydrogen 2.996 N/A GLN 80.A NE2 GLU 82.A O no hydrogen 2.809 N/A ARG 86.A N ASP 84.A OD2 no hydrogen 2.893 N/A ILE 87.A N ASP 84.A O no hydrogen 3.228 N/A THR 88.A N GLU 91.A OE2 no hydrogen 3.003 N/A THR 88.A OG1 GLU 91.A OE2 no hydrogen 2.695 N/A SER 92.A N THR 88.A O no hydrogen 2.969 N/A SER 92.A OG GLU 82.A OE2 no hydrogen 2.654 N/A ALA 93.A N PRO 89.A O no hydrogen 2.947 N/A LEU 94.A N LEU 90.A O no hydrogen 2.876 N/A MET 95.A N GLU 91.A O no hydrogen 3.074 N/A ILE 96.A N SER 92.A O no hydrogen 3.111 N/A TRP 97.A N ALA 93.A O no hydrogen 2.822 N/A TRP 97.A NE1 HIS 108.A O no hydrogen 3.063 N/A GLY 98.A N LEU 94.A O no hydrogen 3.072 N/A SER 99.A N ILE 96.A O no hydrogen 2.881 N/A SER 99.A OG MET 95.A O no hydrogen 2.964 N/A ILE 100.A N ILE 96.A O no hydrogen 3.097 N/A LYS 102.A NZ GLU 103.A O no hydrogen 3.205 N/A LYS 102.A NZ HIS 108.A ND1 no hydrogen 2.685 N/A HIS 108.A N ASP 105.A OD1 no hydrogen 2.863 N/A GLU 109.A N ASP 105.A O no hydrogen 3.085 N/A GLU 110.A N LYS 106.A O no hydrogen 2.862 N/A ILE 111.A N LEU 107.A O no hydrogen 2.943 N/A GLN 112.A N HIS 108.A O no hydrogen 2.972 N/A ASN 113.A N GLU 109.A O no hydrogen 3.031 N/A LEU 114.A N GLU 110.A O no hydrogen 2.970 N/A ILE 115.A N ILE 111.A O no hydrogen 2.900 N/A LYS 116.A N GLN 112.A O no hydrogen 3.141 N/A ILE 117.A N ASN 113.A O no hydrogen 3.027 N/A GLN 118.A N LEU 114.A O no hydrogen 2.900 N/A GLN 118.A NE2 PHE 165.A O no hydrogen 2.647 N/A ALA 119.A N ILE 115.A O no hydrogen 2.815 N/A ILE 120.A N ILE 117.A O no hydrogen 3.169 N/A ALA 121.A N ILE 117.A O no hydrogen 2.981 N/A VAL 122.A N GLN 118.A O no hydrogen 2.895 N/A CYS 123.A SG ALA 119.A O no hydrogen 3.580 N/A MET 124.A N ILE 120.A O no hydrogen 3.138 N/A GLU 125.A N ALA 121.A O no hydrogen 2.843 N/A ASN 126.A N CYS 123.A O no hydrogen 3.136 N/A ASN 126.A ND2 VAL 122.A O no hydrogen 2.883 N/A GLY 127.A N MET 124.A O no hydrogen 2.862 N/A ASN 128.A N CYS 123.A O no hydrogen 2.903 N/A LYS 130.A NZ GLU 134.A OE2 no hydrogen 2.839 N/A ALA 132.A N ASN 128.A O no hydrogen 2.983 N/A GLU 133.A N PHE 129.A O no hydrogen 3.126 N/A GLU 134.A N LYS 130.A O no hydrogen 3.047 N/A VAL 135.A N GLU 131.A O no hydrogen 2.849 N/A PHE 136.A N ALA 132.A O no hydrogen 2.956 N/A GLU 137.A N GLU 133.A O no hydrogen 2.955 N/A ARG 138.A N GLU 134.A O no hydrogen 3.124 N/A ARG 138.A NE GLU 91.A OE1 no hydrogen 2.722 N/A ARG 138.A NH2 GLU 91.A OE1 no hydrogen 3.417 N/A ARG 138.A NH2 GLU 91.A OE2 no hydrogen 2.759 N/A ILE 139.A N VAL 135.A O no hydrogen 2.893 N/A PHE 140.A N PHE 136.A O no hydrogen 2.654 N/A LYS 147.A NZ HIS 159.A NE2 no hydrogen 3.567 N/A LEU 148.A N PHE 144.A O no hydrogen 2.883 N/A LEU 149.A N LYS 145.A O no hydrogen 3.003 N/A MET 150.A N SER 146.A O no hydrogen 3.076 N/A ILE 151.A N LYS 147.A O no hydrogen 2.865 N/A ILE 152.A N LEU 148.A O no hydrogen 2.864 N/A SER 153.A N LEU 149.A O no hydrogen 2.883 N/A GLN 154.A N MET 150.A O no hydrogen 2.874 N/A LYS 155.A N ILE 152.A O no hydrogen 2.954 N/A ASP 156.A N ILE 151.A O no hydrogen 2.942 N/A THR 157.A OG1 MET 124.A O no hydrogen 3.315 N/A HIS 159.A N ASP 156.A O no hydrogen 3.146 N/A PHE 161.A N HIS 159.A ND1 no hydrogen 2.888 N/A PHE 162.A N HIS 159.A O no hydrogen 2.849 N/A HIS 164.A N SER 160.A O no hydrogen 3.255 N/A PHE 165.A N PHE 161.A O no hydrogen 2.996 N/A HIS 169.A N SER 166.A OG no hydrogen 3.143 N/A MET 170.A N SER 166.A O no hydrogen 2.975 N/A MET 171.A N TYR 167.A O no hydrogen 2.818 N/A GLU 172.A N ASN 168.A O no hydrogen 2.838 N/A LYS 173.A N HIS 169.A O no hydrogen 3.110 N/A LYS 173.A NZ GLU 110.A OE2 no hydrogen 2.924 N/A ILE 174.A N MET 170.A O no hydrogen 3.090 N/A LYS 175.A N MET 171.A O no hydrogen 2.897 N/A SER 176.A N GLU 172.A O no hydrogen 3.072 N/A SER 176.A OG GLU 172.A O no hydrogen 3.103 N/A TYR 177.A N LYS 173.A O no hydrogen 3.164 N/A VAL 178.A N ILE 174.A O no hydrogen 2.852 N/A ASN 179.A N LYS 175.A O no hydrogen 2.995 N/A TYR 180.A N SER 176.A O no hydrogen 3.382 N/A VAL 181.A N TYR 177.A O no hydrogen 3.083 N/A LEU 182.A N VAL 178.A O no hydrogen 2.808 N/A SER 183.A N ASN 179.A O no hydrogen 3.078 N/A SER 183.A OG TYR 180.A O no hydrogen 3.035 N/A GLU 184.A N TYR 180.A O no hydrogen 3.025 N/A LYS 185.A N VAL 181.A O no hydrogen 3.089 N/A LYS 185.A NZ ASP 19.A OD1 no hydrogen 3.567 N/A SER 186.A OG SER 183.A O no hydrogen 3.362 N/A THR 188.A N LYS 185.A O no hydrogen 3.208 N/A THR 188.A OG1 LYS 185.A O no hydrogen 2.719 N/A LYS 192.A N THR 188.A O no hydrogen 3.124 N/A ALA 193.A N PHE 189.A O no hydrogen 2.814 N/A ALA 194.A N LEU 190.A O no hydrogen 3.012 N/A ALA 195.A N MET 191.A O no hydrogen 2.916 N/A LYS 196.A N LYS 192.A O no hydrogen 3.052 N/A VAL 197.A N ALA 193.A O no hydrogen 3.083 N/A VAL 198.A N ALA 194.A O no hydrogen 3.003 N/A GLU 199.A N ALA 195.A O no hydrogen 2.948 N/A SER 200.A N LYS 196.A O no hydrogen 2.788 N/A LYS 201.A N VAL 198.A O no hydrogen 3.318 N/A ARG 202.A N GLU 199.A O no hydrogen 2.953 N/A