Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i54_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N LEU 1.A O no hydrogen 3.404 N/A MET 7.A N PHE 3.A O no hydrogen 2.774 N/A ASP 8.A N GLN 4.A O no hydrogen 2.863 N/A GLU 9.A N SER 5.A O no hydrogen 2.698 N/A ILE 10.A N HIS 6.A O no hydrogen 2.912 N/A LEU 11.A N MET 7.A O no hydrogen 2.932 N/A ALA 12.A N ASP 8.A O no hydrogen 2.805 N/A ARG 13.A N ILE 10.A O no hydrogen 3.344 N/A ALA 14.A N LEU 11.A O no hydrogen 2.884 N/A PHE 17.A N ALA 14.A O no hydrogen 2.850 N/A GLN 18.A N GLY 15.A O no hydrogen 3.294 N/A GLN 18.A NE2 ALA 12.A O no hydrogen 2.670 N/A GLN 18.A NE2 ALA 14.A O no hydrogen 2.573 N/A VAL 20.A N PHE 17.A O no hydrogen 2.837 N/A VAL 30.A N ALA 102.A O no hydrogen 2.783 N/A PHE 32.A N VAL 100.A O no hydrogen 2.745 N/A ARG 34.A N GLU 99.A OE1 no hydrogen 3.252 N/A GLY 35.A N THR 96.A O no hydrogen 2.891 N/A HIS 36.A N THR 96.A OG1 no hydrogen 3.048 N/A VAL 38.A N ALA 94.A O no hydrogen 2.754 N/A GLY 42.A N ARG 90.A O no hydrogen 2.861 N/A GLU 43.A N ALA 40.A O no hydrogen 3.091 N/A ARG 47.A NH1 SER 104.A OG no hydrogen 2.938 N/A LEU 48.A N MET 105.A O no hydrogen 2.879 N/A TYR 49.A N PHE 79.A O no hydrogen 2.856 N/A ILE 50.A N VAL 103.A O no hydrogen 2.834 N/A ILE 51.A N ASP 77.A O no hydrogen 2.978 N/A ILE 52.A N ARG 101.A O no hydrogen 2.812 N/A SER 53.A N ARG 101.A O no hydrogen 3.307 N/A LYS 55.A N THR 98.A OG1 no hydrogen 3.018 N/A LYS 55.A NZ THR 173.A O no hydrogen 2.954 N/A LYS 55.A NZ ASP 175.A OD2 no hydrogen 2.695 N/A VAL 56.A N MET 73.A O no hydrogen 3.056 N/A LYS 57.A N THR 95.A O no hydrogen 2.803 N/A LYS 57.A NZ GLU 180.A OE2 no hydrogen 2.737 N/A ILE 58.A N THR 71.A O no hydrogen 3.032 N/A GLY 59.A N SER 93.A O no hydrogen 3.183 N/A ARG 60.A N ASN 68.A O no hydrogen 3.004 N/A ARG 60.A NH2 THR 91.A O no hydrogen 3.368 N/A ARG 61.A N GLU 41.A OE1 no hydrogen 3.319 N/A ALA 62.A N ARG 66.A O no hydrogen 2.685 N/A GLY 65.A N ALA 62.A O no hydrogen 2.977 N/A ASN 68.A N ARG 60.A O no hydrogen 3.212 N/A LEU 69.A N GLN 183.A O no hydrogen 3.247 N/A LEU 70.A N ILE 58.A O no hydrogen 2.820 N/A MET 73.A N VAL 56.A O no hydrogen 2.829 N/A GLY 74.A N ASP 77.A OD2 no hydrogen 2.609 N/A SER 76.A N ILE 51.A O no hydrogen 2.761 N/A SER 76.A OG PRO 75.A O no hydrogen 2.672 N/A ASP 77.A N GLY 74.A O no hydrogen 3.020 N/A PHE 79.A N TYR 49.A O no hydrogen 2.989 N/A GLU 81.A N GLU 81.A OE1 no hydrogen 2.755 N/A SER 83.A OG GLY 45.A O no hydrogen 3.425 N/A PHE 85.A N GLU 81.A O no hydrogen 3.007 N/A ASP 86.A N LEU 82.A O no hydrogen 2.954 N/A ARG 90.A N GLU 43.A O no hydrogen 2.896 N/A ARG 90.A NH1 ARG 47.A O no hydrogen 2.748 N/A ARG 90.A NH2 ARG 47.A O no hydrogen 3.197 N/A ARG 90.A NH2 GLY 80.A O no hydrogen 2.920 N/A SER 93.A N GLY 59.A O no hydrogen 2.929 N/A SER 93.A OG GLY 59.A O no hydrogen 3.133 N/A ALA 94.A N PHE 39.A O no hydrogen 2.908 N/A THR 95.A N LYS 57.A O no hydrogen 2.954 N/A THR 96.A N HIS 36.A O no hydrogen 2.899 N/A THR 96.A OG1 PRO 33.A O no hydrogen 2.599 N/A THR 96.A OG1 THR 98.A O no hydrogen 3.459 N/A ILE 97.A N LYS 55.A O no hydrogen 2.841 N/A THR 98.A OG1 GLU 99.A O no hydrogen 2.883 N/A VAL 100.A N PHE 32.A O no hydrogen 2.765 N/A ARG 101.A N SER 53.A O no hydrogen 2.982 N/A ALA 102.A N VAL 30.A O no hydrogen 2.924 N/A VAL 103.A N ILE 50.A O no hydrogen 3.103 N/A SER 104.A N GLN 28.A O no hydrogen 3.108 N/A MET 105.A N LEU 48.A O no hydrogen 2.848 N/A ARG 107.A NH1 ASP 108.A OD1 no hydrogen 3.399 N/A ALA 109.A N ASP 106.A OD1 no hydrogen 2.945 N/A LEU 110.A N ASP 106.A O no hydrogen 3.049 N/A ARG 111.A N ARG 107.A O no hydrogen 3.122 N/A SER 112.A N ASP 108.A O no hydrogen 3.234 N/A SER 112.A OG ASP 108.A O no hydrogen 3.403 N/A TRP 113.A N ALA 109.A O no hydrogen 3.228 N/A ILE 114.A N LEU 110.A O no hydrogen 3.025 N/A ALA 115.A N ARG 111.A O no hydrogen 3.111 N/A ASP 116.A N SER 112.A O no hydrogen 2.886 N/A ARG 117.A N TRP 113.A O no hydrogen 2.703 N/A GLU 119.A N GLU 119.A OE2 no hydrogen 2.988 N/A ILE 120.A N ARG 117.A O no hydrogen 3.011 N/A GLU 122.A N PRO 118.A O no hydrogen 3.383 N/A GLN 123.A N GLU 119.A O no hydrogen 3.308 N/A LEU 124.A N ILE 120.A O no hydrogen 2.874 N/A LEU 125.A N SER 121.A O no hydrogen 2.895 N/A ARG 126.A N GLU 122.A O no hydrogen 3.123 N/A ARG 126.A NE GLN 123.A OE1 no hydrogen 2.820 N/A ARG 126.A NH2 GLY 15.A O no hydrogen 3.500 N/A ARG 126.A NH2 GLN 123.A OE1 no hydrogen 3.125 N/A VAL 127.A N GLN 123.A O no hydrogen 2.964 N/A LEU 128.A N LEU 124.A O no hydrogen 3.092 N/A ALA 129.A N LEU 125.A O no hydrogen 2.869 N/A ARG 130.A N ARG 126.A O no hydrogen 3.007 N/A ARG 131.A N VAL 127.A O no hydrogen 2.930 N/A ARG 131.A NH1 MET 78.A O no hydrogen 3.020 N/A ARG 131.A NH1 GLU 81.A OE1 no hydrogen 3.328 N/A ARG 131.A NH2 MET 78.A O no hydrogen 2.602 N/A LEU 132.A N LEU 128.A O no hydrogen 2.950 N/A ARG 133.A N ALA 129.A O no hydrogen 2.973 N/A ARG 134.A N ARG 130.A O no hydrogen 3.033 N/A THR 135.A N ARG 131.A O no hydrogen 2.893 N/A THR 135.A OG1 ARG 131.A O no hydrogen 2.630 N/A ASN 136.A N LEU 132.A O no hydrogen 2.963 N/A ASN 137.A N ARG 133.A O no hydrogen 2.979 N/A ASN 138.A N ARG 134.A O no hydrogen 2.825 N/A LEU 139.A N THR 135.A O no hydrogen 2.967 N/A ALA 140.A N ASN 136.A O no hydrogen 2.944 N/A ASP 141.A N ASN 137.A O no hydrogen 2.783 N/A LEU 142.A N ASN 138.A O no hydrogen 2.969 N/A ILE 143.A N LEU 139.A O no hydrogen 3.371 N/A ILE 143.A N ALA 140.A O no hydrogen 3.125 N/A PHE 144.A N ALA 140.A O no hydrogen 2.895 N/A THR 145.A N ASP 141.A O no hydrogen 2.882 N/A THR 145.A OG1 ASP 141.A OD1 no hydrogen 3.136 N/A GLY 149.A N ASP 146.A OD1 no hydrogen 2.902 N/A ARG 150.A N ASP 146.A O no hydrogen 2.971 N/A ARG 150.A NE VAL 185.A O no hydrogen 3.171 N/A ARG 150.A NH1 VAL 185.A O no hydrogen 3.401 N/A ARG 150.A NH1 GLY 186.A O no hydrogen 3.180 N/A ARG 150.A NH2 THR 145.A O no hydrogen 2.867 N/A VAL 151.A N VAL 147.A O no hydrogen 2.830 N/A ALA 152.A N PRO 148.A O no hydrogen 2.971 N/A LYS 153.A N GLY 149.A O no hydrogen 3.044 N/A GLN 154.A N ARG 150.A O no hydrogen 2.887 N/A LEU 155.A N VAL 151.A O no hydrogen 2.798 N/A LEU 156.A N ALA 152.A O no hydrogen 3.110 N/A GLN 157.A N LYS 153.A O no hydrogen 2.886 N/A LEU 158.A N GLN 154.A O no hydrogen 3.075 N/A ALA 159.A N LEU 155.A O no hydrogen 2.883 N/A GLN 160.A N LEU 156.A O no hydrogen 3.054 N/A ARG 161.A N GLN 157.A O no hydrogen 3.367 N/A ARG 161.A NH1 ILE 72.A O no hydrogen 2.774 N/A ARG 161.A NH2 ILE 72.A O no hydrogen 2.519 N/A PHE 162.A N LEU 158.A O no hydrogen 2.668 N/A THR 164.A N ARG 171.A O no hydrogen 2.849 N/A GLU 166.A N ALA 169.A O no hydrogen 2.769 N/A ALA 169.A N GLU 166.A O no hydrogen 2.731 N/A LEU 170.A N ILE 214.A O no hydrogen 3.033 N/A ARG 171.A N THR 164.A O no hydrogen 2.791 N/A ARG 171.A NE GLU 166.A OE1 no hydrogen 2.769 N/A ARG 171.A NH1 GLU 208.A OE2 no hydrogen 2.531 N/A ARG 171.A NH1 SER 211.A OG no hydrogen 2.875 N/A ARG 171.A NH2 GLU 166.A OE1 no hydrogen 3.426 N/A ARG 171.A NH2 GLU 166.A OE2 no hydrogen 3.036 N/A ARG 171.A NH2 GLU 208.A OE2 no hydrogen 3.019 N/A VAL 172.A N VAL 212.A O no hydrogen 2.634 N/A THR 173.A N PHE 162.A O no hydrogen 3.238 N/A ASP 175.A N LYS 210.A O no hydrogen 2.936 N/A LEU 176.A N HIS 174.A ND1 no hydrogen 2.971 N/A THR 177.A N GLU 180.A OE1 no hydrogen 2.906 N/A GLU 180.A N THR 177.A OG1 no hydrogen 2.983 N/A ILE 181.A N THR 177.A O no hydrogen 2.954 N/A ALA 182.A N GLN 178.A O no hydrogen 3.027 N/A GLN 183.A N GLU 179.A O no hydrogen 2.967 N/A LEU 184.A N GLU 180.A O no hydrogen 2.970 N/A VAL 185.A N ILE 181.A O no hydrogen 2.916 N/A GLY 186.A N ALA 182.A O no hydrogen 2.623 N/A ALA 187.A N ALA 182.A O no hydrogen 3.112 N/A THR 191.A N SER 188.A OG no hydrogen 3.253 N/A THR 191.A OG1 SER 188.A OG no hydrogen 2.316 N/A VAL 192.A N SER 188.A O no hydrogen 3.135 N/A ASN 193.A N ARG 189.A O no hydrogen 2.739 N/A LYS 194.A N GLU 190.A O no hydrogen 3.036 N/A ALA 195.A N THR 191.A O no hydrogen 3.122 N/A LEU 196.A N VAL 192.A O no hydrogen 3.004 N/A ALA 197.A N ASN 193.A O no hydrogen 2.780 N/A ASP 198.A N LYS 194.A O no hydrogen 2.964 N/A PHE 199.A N ALA 195.A O no hydrogen 3.142 N/A ALA 200.A N LEU 196.A O no hydrogen 3.068 N/A HIS 201.A N ALA 197.A O no hydrogen 2.669 N/A ARG 202.A N ASP 198.A O no hydrogen 2.828 N/A ARG 202.A NH2 ASP 198.A OD1 no hydrogen 3.492 N/A GLY 203.A N ALA 200.A O no hydrogen 3.025 N/A TRP 204.A N PHE 199.A O no hydrogen 2.958 N/A ARG 206.A N LEU 213.A O no hydrogen 2.793 N/A ARG 206.A NH2 GLU 208.A OE1 no hydrogen 3.543 N/A GLU 208.A N SER 211.A O no hydrogen 3.121 N/A SER 211.A OG GLU 208.A O no hydrogen 2.777 N/A VAL 212.A N VAL 172.A O no hydrogen 2.832 N/A LEU 213.A N ARG 206.A O no hydrogen 2.854 N/A ILE 214.A N LEU 170.A O no hydrogen 2.599 N/A SER 215.A N TRP 204.A O no hydrogen 2.837 N/A SER 215.A OG GLY 203.A O no hydrogen 2.986 N/A SER 215.A OG TRP 204.A O no hydrogen 3.129 N/A ASP 216.A N TRP 204.A O no hydrogen 3.027 N/A ARG 219.A N ASP 216.A OD1 no hydrogen 3.124 N/A ARG 219.A NH1 ASP 216.A OD2 no hydrogen 2.698 N/A LEU 220.A N ASP 216.A O no hydrogen 2.996 N/A ALA 221.A N SER 217.A O no hydrogen 2.697 N/A ARG 222.A N GLU 218.A O no hydrogen 3.028 N/A ARG 223.A N LEU 220.A O no hydrogen 3.165 N/A ARG 223.A NH1 ASP 146.A OD2 no hydrogen 3.362 N/A ALA 224.A N LEU 220.A O no hydrogen 3.219 N/A