Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cnl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N LYS 2.A O no hydrogen 3.171 N/A LYS 8.A N LYS 4.A O no hydrogen 3.136 N/A LYS 8.A NZ ASP 35.A O no hydrogen 3.056 N/A ASP 9.A N ARG 5.A O no hydrogen 3.166 N/A LEU 10.A N GLN 6.A O no hydrogen 2.820 N/A LEU 11.A N ILE 7.A O no hydrogen 2.773 N/A ARG 12.A N LYS 8.A O no hydrogen 3.325 N/A LEU 13.A N LEU 10.A O no hydrogen 3.187 N/A VAL 14.A N LEU 11.A O no hydrogen 3.119 N/A ASN 15.A N ARG 93.A O no hydrogen 3.058 N/A ASN 15.A ND2 LEU 91.A O no hydrogen 2.870 N/A THR 16.A N ARG 93.A O no hydrogen 3.081 N/A THR 16.A OG1 ASN 15.A OD1 no hydrogen 2.740 N/A VAL 17.A N GLU 40.A O no hydrogen 2.783 N/A VAL 18.A N LEU 95.A O no hydrogen 2.902 N/A GLU 19.A N ILE 42.A O no hydrogen 2.866 N/A VAL 20.A N VAL 97.A O no hydrogen 2.793 N/A ARG 21.A N LEU 44.A O no hydrogen 2.951 N/A ARG 21.A NH1 PRO 26.A O no hydrogen 3.027 N/A ARG 21.A NH2 GLU 19.A OE1 no hydrogen 3.293 N/A ARG 21.A NH2 GLU 19.A OE2 no hydrogen 2.775 N/A ASP 22.A N THR 29.A OG1 no hydrogen 2.981 N/A ALA 23.A N ASN 46.A O no hydrogen 2.990 N/A ARG 24.A N ASP 22.A OD1 no hydrogen 2.841 N/A ARG 24.A NE ASP 22.A OD1 no hydrogen 3.017 N/A ARG 24.A NE ASP 22.A OD2 no hydrogen 3.298 N/A ARG 24.A NH1 VAL 217.A O no hydrogen 2.892 N/A ARG 24.A NH1 ALA 218.A O no hydrogen 3.417 N/A ARG 24.A NH2 ASP 22.A OD2 no hydrogen 2.808 N/A ARG 24.A NH2 ALA 218.A O no hydrogen 2.797 N/A ALA 25.A N ASP 22.A O no hydrogen 3.140 N/A PHE 27.A N GLU 228.A OE1 no hydrogen 2.876 N/A ALA 28.A N GLU 228.A OE1 no hydrogen 3.022 N/A THR 29.A N ALA 25.A O no hydrogen 3.066 N/A THR 29.A OG1 ASP 22.A O no hydrogen 3.434 N/A THR 29.A OG1 ALA 25.A O no hydrogen 2.725 N/A SER 30.A N PHE 27.A O no hydrogen 3.048 N/A SER 30.A OG PHE 27.A O no hydrogen 3.006 N/A ALA 31.A N GLU 19.A OE1 no hydrogen 2.597 N/A SER 37.A N ASP 35.A OD1 no hydrogen 2.934 N/A SER 37.A OG ASP 35.A OD1 no hydrogen 2.457 N/A SER 37.A OG ASP 35.A OD2 no hydrogen 3.471 N/A LYS 39.A N PHE 36.A O no hydrogen 3.178 N/A LYS 39.A NZ LEU 11.A O no hydrogen 2.649 N/A LYS 39.A NZ VAL 14.A O no hydrogen 2.819 N/A GLU 40.A N ASN 15.A O no hydrogen 3.003 N/A THR 41.A OG1 PHE 36.A O no hydrogen 3.392 N/A ILE 42.A N VAL 17.A O no hydrogen 2.784 N/A ILE 43.A N ARG 69.A O no hydrogen 2.762 N/A LEU 44.A N GLU 19.A O no hydrogen 2.857 N/A LEU 45.A N ILE 71.A O no hydrogen 2.836 N/A ASN 46.A N ARG 21.A O no hydrogen 2.784 N/A ASN 46.A ND2 THR 102.A O no hydrogen 2.776 N/A LYS 47.A NZ ASN 101.A O no hydrogen 2.713 N/A VAL 48.A N THR 73.A O no hydrogen 3.304 N/A ILE 50.A N LYS 47.A O no hydrogen 3.074 N/A ALA 51.A N VAL 48.A O no hydrogen 3.278 N/A ASP 52.A N SER 226.A OG no hydrogen 2.974 N/A LYS 54.A NZ ASP 52.A OD1 no hydrogen 2.803 N/A THR 55.A N ASP 52.A OD1 no hydrogen 3.031 N/A THR 55.A OG1 ASP 52.A OD1 no hydrogen 2.479 N/A THR 56.A N ASP 52.A O no hydrogen 2.942 N/A THR 56.A OG1 ASP 52.A O no hydrogen 3.319 N/A LYS 57.A N GLU 53.A O no hydrogen 3.065 N/A LYS 58.A N LYS 54.A O no hydrogen 3.251 N/A TRP 59.A N THR 55.A O no hydrogen 2.992 N/A TRP 59.A NE1 GLU 228.A O no hydrogen 2.843 N/A VAL 60.A N THR 56.A O no hydrogen 2.966 N/A GLU 61.A N LYS 57.A O no hydrogen 3.063 N/A PHE 62.A N LYS 58.A O no hydrogen 2.978 N/A PHE 63.A N TRP 59.A O no hydrogen 2.980 N/A LYS 64.A N VAL 60.A O no hydrogen 2.882 N/A LYS 65.A N GLU 61.A O no hydrogen 2.872 N/A GLN 66.A N PHE 62.A O no hydrogen 3.158 N/A GLY 67.A N LYS 64.A O no hydrogen 2.932 N/A LYS 68.A N PHE 63.A O no hydrogen 2.901 N/A ARG 69.A NH1 GLU 40.A OE2 no hydrogen 3.022 N/A ARG 69.A NH2 LEU 86.A O no hydrogen 2.509 N/A ILE 71.A N ILE 43.A O no hydrogen 2.879 N/A THR 73.A N LEU 45.A O no hydrogen 3.107 N/A THR 73.A OG1 HIS 74.A O no hydrogen 3.546 N/A THR 73.A OG1 GLU 77.A OE2 no hydrogen 2.605 N/A GLU 77.A N HIS 74.A O no hydrogen 3.077 N/A ARG 79.A NE LYS 110.A O no hydrogen 3.208 N/A ARG 79.A NE LEU 111.A O no hydrogen 3.091 N/A ARG 79.A NH2 LEU 111.A O no hydrogen 2.955 N/A VAL 81.A N PRO 78.A O no hydrogen 3.034 N/A LEU 82.A N PRO 78.A O no hydrogen 3.121 N/A LEU 83.A N ARG 79.A O no hydrogen 3.023 N/A LYS 84.A N LYS 80.A O no hydrogen 3.180 N/A LYS 85.A N VAL 81.A O no hydrogen 2.956 N/A LYS 85.A NZ THR 72.A O no hydrogen 2.817 N/A LYS 85.A NZ GLU 77.A OE1 no hydrogen 2.736 N/A LYS 85.A NZ GLU 77.A OE2 no hydrogen 3.484 N/A LEU 86.A N LEU 82.A O no hydrogen 2.834 N/A SER 87.A N LEU 83.A O no hydrogen 2.809 N/A SER 87.A OG LYS 84.A O no hydrogen 2.679 N/A LEU 91.A N ASP 89.A OD2 no hydrogen 2.939 N/A ALA 92.A N ASP 89.A O no hydrogen 3.042 N/A ARG 93.A N ASN 15.A OD1 no hydrogen 2.892 N/A VAL 94.A N LYS 129.A O no hydrogen 2.821 N/A LEU 95.A N THR 16.A O no hydrogen 2.917 N/A VAL 97.A N VAL 18.A O no hydrogen 2.867 N/A GLY 98.A N GLY 135.A O no hydrogen 3.181 N/A ASN 101.A ND2 VAL 153.A O no hydrogen 2.820 N/A THR 102.A OG1 VAL 20.A O no hydrogen 2.941 N/A THR 102.A OG1 VAL 99.A O no hydrogen 3.439 N/A LYS 104.A NZ VAL 99.A O no hydrogen 2.918 N/A ILE 107.A N GLY 103.A O no hydrogen 2.988 N/A ILE 108.A N LYS 104.A O no hydrogen 3.039 N/A ASN 109.A N SER 105.A O no hydrogen 2.928 N/A LYS 110.A N THR 106.A O no hydrogen 3.109 N/A LYS 110.A NZ HIS 74.A O no hydrogen 3.010 N/A LYS 110.A NZ LYS 75.A O no hydrogen 3.192 N/A LYS 110.A NZ GLU 77.A O no hydrogen 2.512 N/A LEU 111.A N ILE 107.A O no hydrogen 2.920 N/A LYS 112.A N ILE 108.A O no hydrogen 2.728 N/A GLY 113.A N ASN 109.A O no hydrogen 2.946 N/A GLN 120.A N ASP 132.A OD1 no hydrogen 3.212 N/A PHE 122.A N ILE 130.A O no hydrogen 2.928 N/A LEU 124.A N VAL 128.A O no hydrogen 2.755 N/A GLY 127.A N LEU 124.A O no hydrogen 3.282 N/A LYS 129.A N ALA 92.A O no hydrogen 3.183 N/A ILE 130.A N PHE 122.A O no hydrogen 2.792 N/A LEU 131.A N VAL 94.A O no hydrogen 3.047 N/A ASP 132.A N GLN 120.A O no hydrogen 2.762 N/A GLY 135.A N ILE 96.A O no hydrogen 2.905 N/A LEU 137.A N GLY 98.A O no hydrogen 2.781 N/A LYS 139.A NZ ALA 28.A O no hydrogen 2.696 N/A LYS 139.A NZ SER 30.A O no hydrogen 2.706 N/A LEU 146.A N SER 143.A OG no hydrogen 3.106 N/A ALA 147.A N SER 143.A O no hydrogen 3.312 N/A ALA 148.A N GLU 144.A O no hydrogen 2.915 N/A LYS 149.A N ASP 145.A O no hydrogen 3.004 N/A LYS 149.A NZ ASP 145.A OD1 no hydrogen 3.430 N/A LYS 149.A NZ ASP 145.A OD2 no hydrogen 2.667 N/A LYS 149.A NZ GLU 228.A OE2 no hydrogen 3.295 N/A LEU 150.A N LEU 146.A O no hydrogen 2.971 N/A LEU 151.A N ALA 147.A O no hydrogen 2.835 N/A LEU 152.A N ALA 148.A O no hydrogen 3.015 N/A VAL 153.A N LYS 149.A O no hydrogen 3.150 N/A GLY 154.A N LEU 151.A O no hydrogen 3.062 N/A SER 155.A N LEU 150.A O no hydrogen 2.902 N/A SER 155.A OG PRO 100.A O no hydrogen 3.047 N/A LEU 156.A N LEU 150.A O no hydrogen 3.074 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.390 N/A ARG 160.A N PRO 157.A O no hydrogen 2.976 N/A ILE 161.A N VAL 158.A O no hydrogen 3.017 N/A ARG 165.A N ASP 163.A OD1 no hydrogen 2.912 N/A ARG 165.A NE ASP 163.A OD1 no hydrogen 2.984 N/A ARG 165.A NE ASP 163.A OD2 no hydrogen 3.162 N/A ARG 165.A NH2 ASP 163.A OD2 no hydrogen 2.639 N/A ILE 166.A N ASP 163.A O no hydrogen 3.072 N/A GLU 168.A N GLN 164.A O no hydrogen 3.002 N/A ARG 169.A N ARG 165.A O no hydrogen 2.880 N/A ARG 169.A NE GLU 172.A OE2 no hydrogen 3.325 N/A ARG 169.A NH1 GLU 172.A OE2 no hydrogen 2.739 N/A ARG 169.A NH2 ASP 145.A OD1 no hydrogen 2.488 N/A ALA 170.A N ILE 166.A O no hydrogen 3.002 N/A PHE 171.A N PHE 167.A O no hydrogen 2.946 N/A GLU 172.A N GLU 168.A O no hydrogen 2.812 N/A ILE 173.A N ARG 169.A O no hydrogen 2.920 N/A PHE 174.A N ALA 170.A O no hydrogen 2.939 N/A ALA 175.A N PHE 171.A O no hydrogen 2.650 N/A ARG 176.A N GLU 172.A O no hydrogen 2.876 N/A SER 177.A N ILE 173.A O no hydrogen 2.973 N/A SER 177.A OG ILE 173.A O no hydrogen 2.888 N/A SER 177.A OG SER 226.A O no hydrogen 2.813 N/A ILE 178.A N PHE 174.A O no hydrogen 3.019 N/A ILE 178.A N ALA 175.A O no hydrogen 3.412 N/A GLY 179.A N ALA 175.A O no hydrogen 2.797 N/A GLU 186.A N SER 183.A OG no hydrogen 3.120 N/A PHE 187.A N SER 183.A O no hydrogen 2.938 N/A PHE 188.A N PHE 184.A O no hydrogen 3.124 N/A GLU 189.A N SER 185.A O no hydrogen 3.136 N/A ASP 190.A N GLU 186.A O no hydrogen 3.079 N/A PHE 191.A N PHE 187.A O no hydrogen 2.896 N/A ALA 192.A N PHE 188.A O no hydrogen 3.150 N/A ARG 193.A N GLU 189.A O no hydrogen 3.103 N/A ARG 193.A NE GLU 189.A OE1 no hydrogen 3.015 N/A ARG 193.A NE GLU 189.A OE2 no hydrogen 3.497 N/A ARG 193.A NH2 GLU 189.A OE1 no hydrogen 3.002 N/A LYS 194.A N ASP 190.A O no hydrogen 2.830 N/A LYS 194.A NZ ASP 190.A OD1 no hydrogen 3.423 N/A ARG 195.A NH1 GLU 216.A OE1 no hydrogen 2.628 N/A ARG 195.A NH1 GLU 216.A OE2 no hydrogen 3.341 N/A ARG 195.A NH2 GLU 216.A OE1 no hydrogen 3.446 N/A ARG 195.A NH2 GLU 216.A OE2 no hydrogen 2.914 N/A GLY 196.A N ARG 193.A O no hydrogen 3.036 N/A LEU 197.A N ALA 192.A O no hydrogen 2.662 N/A LYS 199.A N VAL 203.A O no hydrogen 2.581 N/A GLY 202.A N LYS 199.A O no hydrogen 3.093 N/A ASP 205.A N LEU 197.A O no hydrogen 2.927 N/A ARG 208.A N ASP 205.A OD1 no hydrogen 3.420 N/A ALA 209.A N ASP 205.A O no hydrogen 3.037 N/A LEU 210.A N ILE 206.A O no hydrogen 2.884 N/A MET 211.A N GLU 207.A O no hydrogen 3.137 N/A LEU 212.A N ARG 208.A O no hydrogen 3.013 N/A PHE 213.A N ALA 209.A O no hydrogen 2.696 N/A PHE 214.A N LEU 210.A O no hydrogen 3.023 N/A THR 215.A N MET 211.A O no hydrogen 3.055 N/A THR 215.A OG1 MET 211.A O no hydrogen 2.721 N/A GLU 216.A N LEU 212.A O no hydrogen 2.895 N/A VAL 217.A N PHE 213.A O no hydrogen 2.783 N/A ALA 218.A N PHE 214.A O no hydrogen 2.971 N/A GLN 219.A N THR 215.A O no hydrogen 3.169 N/A GLY 220.A N VAL 217.A O no hydrogen 2.974 N/A LYS 221.A N GLU 216.A O no hydrogen 2.918 N/A ARG 224.A NH1 ALA 51.A O no hydrogen 3.285 N/A VAL 225.A N ILE 50.A O no hydrogen 3.300 N/A PHE 227.A N ARG 24.A O no hydrogen 2.685 N/A ARG 229.A N ILE 233.A O no hydrogen 3.032 N/A ARG 229.A NH2 GLU 231.A O no hydrogen 3.396 N/A GLU 231.A N ASP 232.A OD1 no hydrogen 2.531 N/A