Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3aos_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 6.A N PHE 217.A O no hydrogen 3.144 N/A ASP 10.A N LYS 7.A O no hydrogen 3.449 N/A CYS 13.A N ASP 10.A OD1 no hydrogen 3.053 N/A CYS 13.A SG PRO 5.A O no hydrogen 3.733 N/A LEU 14.A N ASP 10.A O no hydrogen 3.048 N/A SER 15.A N MET 11.A O no hydrogen 2.973 N/A SER 15.A OG MET 11.A O no hydrogen 3.131 N/A SER 16.A N GLN 12.A O no hydrogen 3.276 N/A SER 16.A OG GLN 12.A O no hydrogen 3.425 N/A SER 16.A OG CYS 13.A O no hydrogen 3.443 N/A ALA 17.A N CYS 13.A O no hydrogen 2.899 N/A THR 18.A N LEU 14.A O no hydrogen 2.823 N/A THR 18.A OG1 LEU 14.A O no hydrogen 3.023 N/A GLU 19.A N SER 15.A O no hydrogen 3.034 N/A GLN 20.A N SER 16.A O no hydrogen 3.079 N/A GLN 20.A NE2 GLU 19.A OE1 no hydrogen 3.568 N/A PHE 21.A N ALA 17.A O no hydrogen 2.826 N/A LEU 22.A N THR 18.A O no hydrogen 3.043 N/A GLU 23.A N GLU 19.A O no hydrogen 3.224 N/A LYS 24.A N GLN 20.A O no hydrogen 3.001 N/A THR 25.A N PHE 21.A O no hydrogen 2.910 N/A THR 25.A OG1 PHE 21.A O no hydrogen 2.917 N/A THR 25.A OG1 LEU 22.A O no hydrogen 3.549 N/A SER 26.A N GLU 23.A O no hydrogen 3.226 N/A SER 26.A OG GLU 23.A O no hydrogen 2.971 N/A GLY 28.A N THR 25.A O no hydrogen 2.925 N/A ILE 29.A N ILE 34.A O no hydrogen 2.796 N/A TYR 32.A N ILE 29.A O no hydrogen 2.937 N/A ASP 33.A N PRO 30.A O no hydrogen 3.191 N/A ILE 34.A N ILE 29.A O no hydrogen 2.940 N/A TRP 35.A N ASN 204.A OD1 no hydrogen 2.842 N/A ASP 38.A N SER 26.A O no hydrogen 2.935 N/A LEU 40.A N ILE 64.A O no hydrogen 3.008 N/A VAL 42.A N LEU 62.A O no hydrogen 2.943 N/A LEU 45.A N PHE 59.A O no hydrogen 3.097 N/A VAL 47.A N ILE 57.A O no hydrogen 2.953 N/A ALA 49.A N ILE 55.A O no hydrogen 3.239 N/A ASP 52.A N ALA 49.A O no hydrogen 2.651 N/A GLY 54.A N ASP 52.A OD1 no hydrogen 3.240 N/A ILE 55.A N ASP 52.A O no hydrogen 3.261 N/A VAL 56.A N GLU 101.A O no hydrogen 3.063 N/A ILE 57.A N VAL 47.A O no hydrogen 3.019 N/A ARG 58.A N VAL 99.A O no hydrogen 2.704 N/A ARG 58.A NH1 SER 44.A OG no hydrogen 2.680 N/A ARG 58.A NH2 SER 44.A OG no hydrogen 2.779 N/A PHE 59.A N LEU 45.A O no hydrogen 2.832 N/A LYS 60.A N ASP 97.A O no hydrogen 2.751 N/A ASN 61.A N THR 43.A O no hydrogen 2.768 N/A LEU 62.A N VAL 42.A O no hydrogen 2.903 N/A ASN 63.A N VAL 95.A O no hydrogen 2.480 N/A ILE 64.A N LEU 40.A O no hydrogen 3.064 N/A THR 65.A N HIS 93.A O no hydrogen 2.843 N/A THR 65.A OG1 HIS 93.A O no hydrogen 3.536 N/A GLY 66.A N ASP 38.A OD2 no hydrogen 2.665 N/A LYS 68.A N ASP 38.A OD2 no hydrogen 3.138 N/A LYS 68.A NZ GLU 23.A OE1 no hydrogen 3.154 N/A GLN 70.A N LEU 67.A O no hydrogen 3.318 N/A GLN 70.A NE2 LEU 67.A O no hydrogen 2.850 N/A GLN 71.A N LYS 89.A O no hydrogen 2.953 N/A SER 73.A N LYS 87.A O no hydrogen 2.984 N/A ASP 74.A N LYS 87.A O no hydrogen 3.430 N/A GLN 76.A N LEU 85.A O no hydrogen 2.831 N/A GLN 76.A NE2 ASP 74.A OD2 no hydrogen 3.121 N/A ASP 78.A N THR 83.A O no hydrogen 3.116 N/A LYS 80.A N ASP 78.A OD1 no hydrogen 3.075 N/A ALA 81.A N ASP 78.A OD1 no hydrogen 3.202 N/A THR 83.A N ASP 78.A O no hydrogen 3.257 N/A VAL 84.A N TYR 125.A O no hydrogen 2.789 N/A LEU 85.A N GLN 76.A O no hydrogen 2.898 N/A LEU 86.A N VAL 123.A O no hydrogen 2.858 N/A LYS 87.A N ASP 74.A O no hydrogen 2.949 N/A LYS 87.A NZ GLU 149.A OE1 no hydrogen 3.068 N/A LYS 87.A NZ GLU 149.A OE2 no hydrogen 3.396 N/A THR 88.A N GLY 121.A O no hydrogen 2.912 N/A THR 88.A OG1 GLN 70.A OE1 no hydrogen 2.752 N/A THR 88.A OG1 TYR 198.A OH no hydrogen 2.737 N/A LYS 89.A N GLN 71.A O no hydrogen 2.820 N/A ALA 90.A N VAL 119.A O no hydrogen 2.955 N/A LEU 92.A N THR 117.A O no hydrogen 2.882 N/A HIS 93.A N THR 65.A O no hydrogen 2.940 N/A HIS 93.A ND1 ASP 116.A OD1 no hydrogen 2.407 N/A HIS 93.A ND1 ASP 116.A OD2 no hydrogen 3.302 N/A ILE 94.A N ALA 115.A O no hydrogen 2.705 N/A VAL 95.A N ASN 63.A O no hydrogen 2.874 N/A GLY 96.A N TYR 113.A O no hydrogen 3.043 N/A ASP 97.A N LYS 60.A O no hydrogen 3.014 N/A ILE 98.A N GLY 111.A O no hydrogen 3.131 N/A VAL 99.A N ARG 58.A O no hydrogen 2.578 N/A ILE 100.A N PHE 109.A O no hydrogen 2.951 N/A GLU 101.A N VAL 56.A O no hydrogen 2.876 N/A LEU 102.A N LYS 107.A O no hydrogen 3.101 N/A THR 103.A N GLY 54.A O no hydrogen 3.050 N/A THR 103.A OG1 GLY 54.A O no hydrogen 3.169 N/A GLN 105.A N LEU 102.A O no hydrogen 2.934 N/A SER 106.A N THR 103.A O no hydrogen 3.275 N/A LYS 107.A N LEU 102.A O no hydrogen 3.325 N/A LYS 107.A NZ ASP 169.A OD2 no hydrogen 3.502 N/A SER 108.A OG GLU 101.A OE1 no hydrogen 2.930 N/A PHE 109.A N ILE 100.A O no hydrogen 3.073 N/A LEU 112.A N SER 159.A OG no hydrogen 2.694 N/A TYR 113.A N GLY 96.A O no hydrogen 2.703 N/A TYR 113.A OH LEU 185.A O no hydrogen 3.197 N/A THR 114.A N THR 157.A O no hydrogen 2.665 N/A ALA 115.A N ILE 94.A O no hydrogen 2.717 N/A ASP 116.A N LYS 155.A O no hydrogen 3.031 N/A THR 117.A N LEU 92.A O no hydrogen 3.206 N/A THR 117.A OG1 ASN 118.A O no hydrogen 3.528 N/A THR 117.A OG1 ILE 151.A O no hydrogen 2.536 N/A VAL 119.A N ALA 90.A O no hydrogen 2.873 N/A ILE 120.A N SER 150.A O no hydrogen 3.043 N/A GLY 121.A N THR 88.A O no hydrogen 2.982 N/A ALA 122.A N THR 147.A O no hydrogen 2.938 N/A VAL 123.A N LEU 86.A O no hydrogen 2.738 N/A ARG 124.A N THR 145.A O no hydrogen 2.907 N/A TYR 125.A N VAL 84.A O no hydrogen 2.944 N/A TYR 127.A N LYS 82.A O no hydrogen 2.947 N/A ASN 128.A N GLU 140.A O no hydrogen 2.937 N/A LYS 130.A N HIS 138.A O no hydrogen 2.789 N/A ASP 132.A N VAL 136.A O no hydrogen 2.799 N/A GLY 135.A N ASP 132.A O no hydrogen 3.146 N/A HIS 138.A N LYS 130.A O no hydrogen 2.849 N/A HIS 138.A ND1 LEU 212.A O no hydrogen 2.940 N/A HIS 138.A NE2 ASP 132.A OD2 no hydrogen 3.203 N/A GLU 140.A N ASN 128.A O no hydrogen 2.715 N/A GLN 142.A N GLY 126.A O no hydrogen 3.010 N/A GLU 144.A N GLU 144.A OE1 no hydrogen 2.691 N/A THR 145.A N ARG 124.A O no hydrogen 2.785 N/A THR 147.A N ALA 122.A O no hydrogen 2.704 N/A CYS 148.A SG CYS 148.A O no hydrogen 2.986 N/A SER 150.A N ILE 120.A O no hydrogen 3.381 N/A GLY 152.A N SER 150.A OG no hydrogen 3.147 N/A LYS 155.A N ASP 116.A O no hydrogen 2.791 N/A THR 157.A N THR 114.A O no hydrogen 2.711 N/A SER 159.A N LEU 112.A O no hydrogen 3.063 N/A SER 159.A OG LEU 112.A O no hydrogen 3.257 N/A SER 163.A N SER 159.A O no hydrogen 3.096 N/A SER 163.A OG SER 159.A O no hydrogen 2.349 N/A SER 164.A N SER 160.A O no hydrogen 3.156 N/A SER 164.A OG SER 160.A O no hydrogen 3.227 N/A ALA 165.A N ASP 161.A O no hydrogen 2.941 N/A LEU 166.A N LEU 162.A O no hydrogen 3.170 N/A GLU 167.A N SER 163.A O no hydrogen 2.821 N/A LYS 168.A N SER 164.A O no hydrogen 2.928 N/A ASP 169.A N ALA 165.A O no hydrogen 2.906 N/A SER 170.A N LEU 166.A O no hydrogen 2.856 N/A SER 170.A OG LEU 166.A O no hydrogen 3.173 N/A GLY 171.A N GLU 167.A O no hydrogen 2.973 N/A ASN 172.A N SER 170.A OG no hydrogen 3.332 N/A MET 179.A N GLU 176.A O no hydrogen 2.995 N/A LYS 183.A N MET 179.A O no hydrogen 2.974 N/A THR 184.A N PRO 181.A O no hydrogen 3.150 N/A THR 184.A OG1 GLU 180.A OE2 no hydrogen 2.225 N/A LEU 185.A N PRO 181.A O no hydrogen 3.087 N/A ARG 186.A N LEU 182.A O no hydrogen 2.791 N/A ARG 186.A NH1 PRO 177.A O no hydrogen 3.033 N/A ARG 186.A NH2 PRO 177.A O no hydrogen 3.290 N/A GLN 187.A N THR 184.A O no hydrogen 3.112 N/A GLN 187.A NE2 LYS 183.A O no hydrogen 3.077 N/A ALA 189.A N THR 184.A O no hydrogen 2.861 N/A CYS 191.A N GLN 187.A O no hydrogen 2.788 N/A LYS 192.A N ALA 188.A O no hydrogen 2.758 N/A ILE 193.A N ALA 189.A O no hydrogen 2.733 N/A ALA 194.A N ILE 190.A O no hydrogen 2.812 N/A GLU 195.A N CYS 191.A O no hydrogen 3.024 N/A ALA 196.A N LYS 192.A O no hydrogen 2.982 N/A CYS 197.A N ILE 193.A O no hydrogen 3.026 N/A CYS 197.A SG ILE 193.A O no hydrogen 3.414 N/A TYR 198.A N ALA 194.A O no hydrogen 2.954 N/A TYR 198.A OH THR 88.A O no hydrogen 3.114 N/A TYR 198.A OH THR 88.A OG1 no hydrogen 2.737 N/A ILE 199.A N GLU 195.A O no hydrogen 2.795 N/A SER 200.A N ALA 196.A O no hydrogen 3.208 N/A SER 200.A OG ALA 196.A O no hydrogen 3.500 N/A VAL 201.A N CYS 197.A O no hydrogen 2.907 N/A VAL 202.A N TYR 198.A O no hydrogen 2.671 N/A HIS 203.A N ILE 199.A O no hydrogen 2.707 N/A ASN 204.A N SER 200.A O no hydrogen 2.945 N/A ASN 204.A ND2 TRP 35.A O no hydrogen 2.725 N/A ILE 205.A N VAL 201.A O no hydrogen 3.348 N/A ARG 206.A N VAL 202.A O no hydrogen 2.888 N/A ARG 206.A NE VAL 141.A O no hydrogen 3.011 N/A ARG 206.A NH2 GLN 142.A O no hydrogen 3.237 N/A ARG 206.A NH2 GLU 144.A OE1 no hydrogen 2.628 N/A ALA 207.A N HIS 203.A O no hydrogen 2.649 N/A SER 208.A N ASN 204.A O no hydrogen 3.045 N/A SER 208.A OG ASN 204.A O no hydrogen 3.484 N/A SER 208.A OG ILE 205.A O no hydrogen 3.175 N/A ALA 209.A N ILE 205.A O no hydrogen 2.985 N/A LYS 210.A N ARG 206.A O no hydrogen 3.196 N/A LEU 212.A N SER 208.A O no hydrogen 2.858 N/A ALA 214.A N GLN 137.A O no hydrogen 2.822 N/A SER 216.A N PRO 213.A O no hydrogen 2.979 N/A PHE 217.A N ALA 214.A O no hydrogen 2.839 N/A PHE 218.A N ALA 214.A O no hydrogen 3.351 N/A GLU 219.A N CYS 6.A O no hydrogen 3.253 N/A