Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2boo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N ALA 5.A O no hydrogen 3.119 N/A TRP 11.A NE1 THR 54.A O no hydrogen 2.840 N/A GLN 12.A N PRO 8.A O no hydrogen 3.311 N/A GLU 13.A N GLU 9.A O no hydrogen 3.043 N/A ALA 14.A N ASP 10.A O no hydrogen 3.057 N/A LEU 15.A N TRP 11.A O no hydrogen 2.786 N/A LEU 16.A N GLN 12.A O no hydrogen 2.953 N/A GLU 18.A N LEU 15.A O no hydrogen 2.813 N/A PHE 19.A N LEU 15.A O no hydrogen 2.901 N/A SER 20.A N LEU 16.A O no hydrogen 3.118 N/A SER 20.A OG LEU 16.A O no hydrogen 2.755 N/A ALA 21.A N GLU 18.A O no hydrogen 3.156 N/A TYR 23.A OH GLU 18.A OE1 no hydrogen 2.685 N/A PHE 24.A N ALA 21.A O no hydrogen 3.162 N/A HIS 25.A N ALA 21.A O no hydrogen 3.310 N/A HIS 25.A ND1 ALA 21.A O no hydrogen 3.181 N/A GLU 26.A N PRO 22.A O no hydrogen 3.103 N/A LEU 27.A N TYR 23.A O no hydrogen 2.957 N/A THR 28.A N PHE 24.A O no hydrogen 2.959 N/A THR 28.A OG1 HIS 25.A O no hydrogen 3.333 N/A ASP 29.A N HIS 25.A O no hydrogen 3.079 N/A PHE 30.A N GLU 26.A O no hydrogen 2.925 N/A LEU 31.A N LEU 27.A O no hydrogen 2.987 N/A ARG 32.A N THR 28.A O no hydrogen 2.972 N/A GLN 33.A N ASP 29.A O no hydrogen 3.099 N/A GLN 33.A NE2 GLU 37.A OE2 no hydrogen 2.905 N/A GLU 34.A N PHE 30.A O no hydrogen 2.752 N/A ARG 35.A N LEU 31.A O no hydrogen 2.832 N/A ARG 35.A NH1 ILE 40.A O no hydrogen 3.344 N/A ARG 35.A NH1 PRO 42.A O no hydrogen 3.487 N/A ARG 35.A NH2 PRO 42.A O no hydrogen 2.867 N/A LYS 36.A N GLN 33.A O no hydrogen 3.336 N/A GLU 37.A N GLU 34.A O no hydrogen 3.288 N/A TYR 38.A N GLU 34.A O no hydrogen 2.875 N/A TYR 41.A N VAL 131.A O no hydrogen 2.748 N/A ASP 46.A N PRO 43.A O no hydrogen 3.005 N/A VAL 47.A N ALA 44.A O no hydrogen 3.463 N/A ASN 49.A N ASP 46.A O no hydrogen 2.963 N/A ASN 49.A ND2 ASP 46.A OD1 no hydrogen 3.080 N/A ASN 49.A ND2 HIS 76.A O no hydrogen 2.824 N/A LEU 51.A N PHE 48.A O no hydrogen 3.039 N/A ARG 52.A N PHE 48.A O no hydrogen 3.229 N/A ARG 52.A NE ASN 6.A O no hydrogen 3.059 N/A ARG 52.A NH1 ASN 49.A OD1 no hydrogen 3.358 N/A TYR 53.A N ASN 49.A O no hydrogen 3.071 N/A THR 54.A OG1 ALA 118.A O no hydrogen 2.790 N/A THR 54.A OG1 VAL 122.A O no hydrogen 3.329 N/A LEU 56.A N ASP 10.A OD1 no hydrogen 3.174 N/A GLY 57.A N ASP 10.A OD2 no hydrogen 2.762 N/A GLU 58.A N PRO 55.A O no hydrogen 2.737 N/A VAL 59.A N LEU 56.A O no hydrogen 3.305 N/A LYS 60.A N GLY 121.A O no hydrogen 2.844 N/A LYS 60.A NZ GLY 218.A O no hydrogen 2.553 N/A VAL 61.A N GLY 121.A O no hydrogen 3.246 N/A LEU 62.A N VAL 163.A O no hydrogen 2.796 N/A ILE 63.A N LEU 123.A O no hydrogen 2.930 N/A GLY 65.A N LEU 125.A O no hydrogen 2.809 N/A TYR 69.A OH PHE 80.A O no hydrogen 2.770 N/A GLY 71.A N GLN 74.A OE1 no hydrogen 2.866 N/A HIS 76.A NE2 SER 81.A OG no hydrogen 2.717 N/A SER 79.A N LEU 124.A O no hydrogen 2.781 N/A SER 79.A OG ILE 63.A O no hydrogen 2.904 N/A SER 81.A OG HIS 76.A NE2 no hydrogen 2.717 N/A SER 81.A OG GLY 112.A O no hydrogen 3.357 N/A VAL 82.A N GLY 112.A O no hydrogen 2.975 N/A ARG 83.A N GLN 74.A O no hydrogen 3.211 N/A ARG 83.A NH1 GLU 230.A OE2 no hydrogen 3.281 N/A ARG 83.A NH2 ASP 46.A OD2 no hydrogen 2.939 N/A VAL 86.A N ARG 83.A O no hydrogen 3.224 N/A ARG 93.A N PRO 89.A O no hydrogen 3.095 N/A ARG 93.A NH1 VAL 88.A O no hydrogen 2.922 N/A ASN 94.A N PRO 90.A O no hydrogen 3.192 N/A ASN 94.A ND2 PRO 191.A O no hydrogen 2.981 N/A ASN 94.A ND2 GLU 196.A OE2 no hydrogen 2.866 N/A ILE 95.A N SER 91.A O no hydrogen 3.130 N/A TYR 96.A N LEU 92.A O no hydrogen 2.833 N/A TYR 96.A OH HIS 111.A O no hydrogen 2.616 N/A LYS 97.A N ARG 93.A O no hydrogen 3.154 N/A LYS 97.A NZ ASN 94.A OD1 no hydrogen 2.775 N/A GLU 98.A N ASN 94.A O no hydrogen 2.803 N/A LEU 99.A N ILE 95.A O no hydrogen 2.751 N/A THR 100.A N TYR 96.A O no hydrogen 3.019 N/A THR 100.A OG1 LYS 97.A O no hydrogen 2.735 N/A GLU 101.A N LYS 97.A O no hydrogen 3.299 N/A GLU 101.A N GLU 98.A O no hydrogen 3.036 N/A ASP 102.A N GLU 98.A O no hydrogen 2.708 N/A ASP 102.A N LEU 99.A O no hydrogen 3.059 N/A ILE 103.A N LEU 99.A O no hydrogen 2.790 N/A PHE 106.A N ILE 103.A O no hydrogen 2.855 N/A HIS 111.A NE2 PRO 225.A O no hydrogen 2.817 N/A TYR 113.A N HIS 111.A ND1 no hydrogen 3.075 N/A LEU 114.A N SER 81.A OG no hydrogen 2.707 N/A ARG 115.A NE GLU 119.A OE2 no hydrogen 2.978 N/A TRP 117.A N LEU 114.A O no hydrogen 2.992 N/A TRP 117.A NE1 TRP 222.A O no hydrogen 2.700 N/A ALA 118.A N LEU 114.A O no hydrogen 3.259 N/A GLU 119.A N ARG 115.A O no hydrogen 2.761 N/A GLN 120.A N TRP 117.A O no hydrogen 3.197 N/A GLN 120.A NE2 SER 116.A O no hydrogen 3.097 N/A GLN 120.A NE2 GLU 221.A O no hydrogen 2.800 N/A GLY 121.A N ALA 118.A O no hydrogen 3.236 N/A VAL 122.A N TRP 117.A O no hydrogen 3.204 N/A LEU 123.A N VAL 61.A O no hydrogen 2.613 N/A LEU 125.A N ILE 63.A O no hydrogen 3.254 N/A ALA 127.A N GLY 65.A O no hydrogen 2.874 N/A VAL 128.A N GLN 66.A O no hydrogen 2.909 N/A THR 130.A OG1 HIS 139.A ND1 no hydrogen 2.839 N/A VAL 131.A N TYR 41.A O no hydrogen 2.938 N/A ARG 132.A N SER 138.A OG no hydrogen 3.063 N/A ARG 132.A NE GLU 34.A OE1 no hydrogen 2.929 N/A ARG 132.A NH1 GLN 135.A OE1 no hydrogen 3.238 N/A ARG 132.A NH2 GLU 34.A OE2 no hydrogen 3.325 N/A ALA 133.A N THR 39.A O no hydrogen 2.980 N/A GLY 134.A N HIS 70.A O no hydrogen 2.986 N/A GLN 135.A N ARG 132.A O no hydrogen 3.025 N/A ASN 137.A N ASP 67.A OD2 no hydrogen 2.983 N/A SER 138.A N GLN 135.A O no hydrogen 3.200 N/A SER 138.A OG GLN 135.A O no hydrogen 2.626 N/A HIS 139.A ND1 THR 130.A OG1 no hydrogen 2.839 N/A HIS 139.A NE2 GLU 34.A OE1 no hydrogen 2.752 N/A GLN 140.A N ASN 137.A O no hydrogen 3.202 N/A GLN 140.A NE2 TYR 170.A OH no hydrogen 3.136 N/A GLY 141.A N GLU 145.A OE1 no hydrogen 3.114 N/A GLY 141.A N GLU 145.A OE2 no hydrogen 2.714 N/A TRP 144.A NE1 THR 130.A OG1 no hydrogen 2.676 N/A GLU 145.A N GLU 145.A OE1 no hydrogen 2.783 N/A PHE 147.A N GLY 143.A O no hydrogen 3.437 N/A THR 148.A N TRP 144.A O no hydrogen 2.890 N/A THR 148.A OG1 ALA 127.A O no hydrogen 2.699 N/A THR 148.A OG1 TRP 144.A O no hydrogen 2.977 N/A ASP 149.A N GLU 145.A O no hydrogen 2.940 N/A ALA 150.A N HIS 146.A O no hydrogen 3.133 N/A VAL 151.A N PHE 147.A O no hydrogen 2.851 N/A ILE 152.A N THR 148.A O no hydrogen 2.859 N/A LYS 153.A N ASP 149.A O no hydrogen 2.787 N/A ALA 154.A N ALA 150.A O no hydrogen 3.090 N/A VAL 155.A N VAL 151.A O no hydrogen 3.154 N/A VAL 155.A N ILE 152.A O no hydrogen 3.135 N/A ASN 156.A N ILE 152.A O no hydrogen 2.973 N/A ASN 156.A ND2 THR 179.A OG1 no hydrogen 2.971 N/A ALA 157.A N LYS 153.A O no hydrogen 2.910 N/A LYS 158.A N VAL 155.A O no hydrogen 3.199 N/A LYS 158.A NZ LEU 56.A O no hydrogen 2.112 N/A LYS 158.A NZ GLU 160.A OE2 no hydrogen 3.108 N/A ARG 161.A NE ALA 211.A O no hydrogen 3.038 N/A ARG 161.A NH1 ASN 182.A O no hydrogen 2.837 N/A ARG 161.A NH2 ALA 211.A O no hydrogen 3.225 N/A VAL 162.A N HIS 183.A ND1 no hydrogen 3.040 N/A VAL 163.A N LYS 60.A O no hydrogen 2.893 N/A PHE 164.A N VAL 184.A O no hydrogen 2.785 N/A ILE 165.A N LEU 62.A O no hydrogen 2.783 N/A LEU 166.A N ILE 186.A O no hydrogen 2.827 N/A GLY 168.A N SER 188.A O no hydrogen 2.835 N/A ARG 172.A N GLY 168.A O no hydrogen 3.067 N/A ARG 172.A NE GLU 187.A OE1 no hydrogen 3.198 N/A ARG 172.A NH2 GLU 187.A OE1 no hydrogen 3.286 N/A LYS 173.A N TYR 170.A O no hydrogen 3.205 N/A LYS 173.A NZ SER 169.A O no hydrogen 3.491 N/A LYS 174.A N ALA 171.A O no hydrogen 3.041 N/A LYS 174.A NZ ASP 149.A OD1 no hydrogen 2.768 N/A LYS 175.A N ARG 172.A O no hydrogen 3.155 N/A LYS 175.A NZ GLU 187.A OE2 no hydrogen 2.925 N/A LEU 177.A N LYS 174.A O no hydrogen 2.999 N/A ILE 178.A N LYS 175.A O no hydrogen 3.032 N/A THR 179.A N ASN 156.A OD1 no hydrogen 2.831 N/A GLY 180.A N ASN 156.A OD1 no hydrogen 2.966 N/A LYS 181.A NZ ASN 182.A OD1 no hydrogen 3.048 N/A ASN 182.A ND2 GLU 159.A O no hydrogen 2.581 N/A HIS 183.A N GLY 180.A O no hydrogen 3.255 N/A HIS 183.A NE2 ASN 156.A O no hydrogen 3.027 N/A VAL 184.A N VAL 162.A O no hydrogen 2.981 N/A ILE 186.A N PHE 164.A O no hydrogen 2.796 N/A SER 188.A N LEU 166.A O no hydrogen 3.146 N/A SER 188.A OG GLY 189.A O no hydrogen 2.696 N/A GLY 189.A N TYR 198.A O no hydrogen 2.928 N/A SER 192.A N HIS 190.A ND1 no hydrogen 3.041 N/A LEU 194.A N SER 192.A OG no hydrogen 3.156 N/A SER 195.A N SER 192.A O no hydrogen 2.823 N/A SER 195.A OG HIS 190.A O no hydrogen 2.802 N/A SER 195.A OG SER 192.A O no hydrogen 3.378 N/A TYR 198.A N SER 195.A O no hydrogen 3.022 N/A PHE 199.A N GLU 196.A O no hydrogen 3.025 N/A PHE 200.A N GLU 196.A O no hydrogen 2.956 N/A GLY 201.A N GLU 98.A OE1 no hydrogen 2.921 N/A THR 202.A N PHE 199.A O no hydrogen 3.246 N/A THR 202.A OG1 PHE 199.A O no hydrogen 2.603 N/A ARG 203.A N GLU 98.A OE2 no hydrogen 2.923 N/A ARG 203.A NE ASP 102.A OD1 no hydrogen 2.641 N/A ARG 203.A NH2 ASP 102.A O no hydrogen 3.010 N/A ARG 203.A NH2 ASP 102.A OD1 no hydrogen 3.099 N/A PHE 205.A N ASP 102.A OD2 no hydrogen 3.115 N/A SER 206.A N ASP 102.A OD2 no hydrogen 2.871 N/A SER 206.A OG ASP 102.A OD1 no hydrogen 2.577 N/A SER 206.A OG ASP 102.A OD2 no hydrogen 3.465 N/A SER 206.A OG ARG 203.A O no hydrogen 3.443 N/A LYS 207.A N ARG 203.A O no hydrogen 3.172 N/A LYS 207.A NZ THR 202.A O no hydrogen 3.255 N/A THR 208.A N PRO 204.A O no hydrogen 2.932 N/A THR 208.A OG1 PRO 204.A O no hydrogen 2.696 N/A ASN 209.A N PHE 205.A O no hydrogen 3.231 N/A ASN 209.A ND2 VAL 220.A O no hydrogen 2.912 N/A GLU 210.A N SER 206.A O no hydrogen 2.902 N/A ALA 211.A N LYS 207.A O no hydrogen 2.978 N/A LEU 212.A N THR 208.A O no hydrogen 2.964 N/A GLU 213.A N ASN 209.A O no hydrogen 3.013 N/A LYS 214.A N GLU 210.A O no hydrogen 3.113 N/A LYS 214.A NZ GLU 210.A OE2 no hydrogen 3.457 N/A ALA 215.A N ALA 211.A O no hydrogen 3.306 N/A ALA 215.A N LEU 212.A O no hydrogen 2.922 N/A GLY 216.A N GLU 213.A O no hydrogen 3.126 N/A ARG 217.A N LEU 212.A O no hydrogen 2.960 N/A ARG 217.A NE ARG 161.A O no hydrogen 2.699 N/A ARG 217.A NH2 ARG 161.A O no hydrogen 3.157 N/A VAL 220.A N ASN 209.A OD1 no hydrogen 2.766 N/A GLU 221.A N GLN 120.A OE1 no hydrogen 3.051 N/A GLN 223.A N GLU 221.A OE2 no hydrogen 3.123 N/A