Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ag5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 SER 79.A OG no hydrogen 3.090 N/A THR 2.A OG1 ALA 83.A O no hydrogen 2.627 N/A LYS 3.A N ASP 84.A O no hydrogen 3.034 N/A ILE 5.A N VAL 86.A O no hydrogen 3.061 N/A VAL 8.A N ASP 93.A OD2 no hydrogen 2.877 N/A GLU 10.A N THR 7.A OG1 no hydrogen 3.423 N/A MET 11.A N THR 7.A O no hydrogen 3.053 N/A GLN 12.A N VAL 8.A O no hydrogen 2.847 N/A GLN 12.A NE2 ASN 133.A O no hydrogen 2.889 N/A HIS 13.A N LYS 9.A O no hydrogen 3.068 N/A ILE 14.A N GLU 10.A O no hydrogen 3.059 N/A VAL 15.A N MET 11.A O no hydrogen 3.112 N/A LYS 16.A N GLN 12.A O no hydrogen 2.859 N/A ALA 17.A N HIS 13.A O no hydrogen 3.040 N/A ALA 18.A N ILE 14.A O no hydrogen 3.089 N/A LYS 19.A N VAL 15.A O no hydrogen 2.890 N/A LYS 19.A NZ ASP 138.A OD1 no hydrogen 3.042 N/A ARG 20.A N LYS 16.A O no hydrogen 3.308 N/A SER 21.A N ALA 18.A O no hydrogen 3.225 N/A SER 21.A OG ALA 17.A O no hydrogen 3.539 N/A SER 21.A OG ALA 18.A O no hydrogen 2.974 N/A GLY 22.A N LYS 19.A O no hydrogen 3.003 N/A THR 23.A N ALA 18.A O no hydrogen 3.264 N/A THR 23.A OG1 ALA 18.A O no hydrogen 3.412 N/A THR 24.A N ASP 50.A OD1 no hydrogen 3.081 N/A ILE 25.A N ASP 138.A OD1 no hydrogen 2.805 N/A GLY 26.A N ILE 51.A O no hydrogen 2.876 N/A PHE 27.A N TYR 139.A O no hydrogen 2.782 N/A ILE 28.A N ILE 53.A O no hydrogen 2.891 N/A THR 30.A N SER 55.A O no hydrogen 2.980 N/A THR 30.A OG1 SER 55.A O no hydrogen 2.879 N/A GLY 32.A N THR 30.A OG1 no hydrogen 3.160 N/A ALA 33.A N ASP 74.A OD2 no hydrogen 3.117 N/A LEU 34.A N ASP 74.A OD1 no hydrogen 3.048 N/A HIS 35.A N HIS 38.A ND1 no hydrogen 3.251 N/A LEU 39.A N HIS 35.A O no hydrogen 3.296 N/A THR 40.A N ASP 36.A O no hydrogen 2.956 N/A THR 40.A N GLY 37.A O no hydrogen 3.237 N/A THR 40.A OG1 ASP 36.A O no hydrogen 2.747 N/A VAL 42.A N HIS 38.A O no hydrogen 2.928 N/A ARG 43.A N LEU 39.A O no hydrogen 2.904 N/A GLU 44.A N THR 40.A O no hydrogen 3.144 N/A SER 45.A N MET 41.A O no hydrogen 3.017 N/A SER 45.A OG THR 52.A OG1 no hydrogen 2.555 N/A VAL 46.A N VAL 42.A O no hydrogen 2.864 N/A SER 47.A N ARG 43.A O no hydrogen 3.041 N/A SER 47.A N GLU 44.A O no hydrogen 3.160 N/A SER 47.A OG ARG 43.A O no hydrogen 3.471 N/A SER 47.A OG GLU 44.A O no hydrogen 2.746 N/A THR 48.A N GLU 44.A O no hydrogen 3.329 N/A THR 48.A N SER 45.A O no hydrogen 3.290 N/A THR 48.A OG1 GLU 44.A O no hydrogen 3.443 N/A ASN 49.A N SER 45.A O no hydrogen 2.878 N/A ASN 49.A ND2 SER 45.A O no hydrogen 3.020 N/A ASN 49.A ND2 SER 45.A OG no hydrogen 3.409 N/A ASN 49.A ND2 TYR 141.A OH no hydrogen 3.032 N/A ASP 50.A N THR 24.A OG1 no hydrogen 2.876 N/A ILE 51.A N THR 24.A O no hydrogen 3.046 N/A THR 52.A N ASP 84.A OD2 no hydrogen 2.755 N/A THR 52.A OG1 SER 45.A OG no hydrogen 2.555 N/A ILE 53.A N GLY 26.A O no hydrogen 2.695 N/A VAL 54.A N ILE 85.A O no hydrogen 2.846 N/A SER 55.A N ILE 28.A O no hydrogen 3.000 N/A VAL 56.A N PHE 87.A O no hydrogen 2.927 N/A PHE 57.A N THR 30.A O no hydrogen 3.076 N/A ASN 59.A ND2 GLN 62.A OE1 no hydrogen 2.718 N/A ASN 59.A ND2 GLY 123.A O no hydrogen 3.007 N/A LEU 61.A N ASN 59.A OD1 no hydrogen 3.392 N/A GLN 62.A N ASN 59.A O no hydrogen 3.161 N/A ARG 69.A NH2 ASP 65.A O no hydrogen 3.135 N/A LYS 73.A N GLN 70.A O no hydrogen 3.166 N/A ASP 74.A N GLN 70.A O no hydrogen 2.942 N/A LEU 75.A N ILE 71.A O no hydrogen 2.714 N/A GLU 76.A N ASP 72.A O no hydrogen 3.369 N/A LEU 77.A N LYS 73.A O no hydrogen 3.049 N/A VAL 78.A N ASP 74.A O no hydrogen 3.175 N/A SER 79.A N LEU 75.A O no hydrogen 3.120 N/A SER 79.A N GLU 76.A O no hydrogen 3.206 N/A SER 79.A OG THR 2.A OG1 no hydrogen 3.090 N/A SER 79.A OG LEU 75.A O no hydrogen 2.648 N/A GLU 80.A N GLU 76.A O no hydrogen 3.295 N/A VAL 81.A N VAL 78.A O no hydrogen 3.266 N/A GLY 82.A N SER 79.A O no hydrogen 2.785 N/A ALA 83.A N VAL 78.A O no hydrogen 3.162 N/A ASP 84.A N THR 52.A O no hydrogen 2.966 N/A ILE 85.A N THR 52.A O no hydrogen 3.332 N/A VAL 86.A N LYS 3.A O no hydrogen 2.912 N/A PHE 87.A N VAL 54.A O no hydrogen 2.762 N/A HIS 88.A N ILE 5.A O no hydrogen 2.843 N/A HIS 88.A ND1 VAL 56.A O no hydrogen 2.976 N/A GLU 92.A N GLU 92.A OE1 no hydrogen 2.736 N/A ASP 93.A N ALA 90.A O no hydrogen 2.999 N/A MET 94.A N ALA 90.A O no hydrogen 3.147 N/A TYR 95.A N VAL 91.A O no hydrogen 2.804 N/A TYR 95.A OH ASN 59.A OD1 no hydrogen 2.754 N/A VAL 105.A N ASP 122.A OD1 no hydrogen 2.854 N/A ALA 109.A N GLY 106.A O no hydrogen 2.894 N/A ASP 110.A N PRO 107.A O no hydrogen 2.652 N/A VAL 111.A N PRO 107.A O no hydrogen 3.426 N/A LYS 116.A N GLU 113.A O no hydrogen 2.762 N/A ARG 117.A N GLY 114.A O no hydrogen 2.628 N/A HIS 120.A N ARG 117.A O no hydrogen 3.196 N/A VAL 124.A N HIS 120.A O no hydrogen 3.346 N/A VAL 125.A N PHE 121.A O no hydrogen 2.960 N/A THR 126.A N ASP 122.A O no hydrogen 3.094 N/A THR 126.A OG1 ASP 122.A O no hydrogen 2.770 N/A VAL 127.A N GLY 123.A O no hydrogen 3.236 N/A VAL 128.A N VAL 124.A O no hydrogen 2.946 N/A ASN 129.A N VAL 125.A O no hydrogen 2.761 N/A LYS 130.A N THR 126.A O no hydrogen 3.188 N/A LYS 130.A NZ MET 94.A O no hydrogen 2.824 N/A LEU 131.A N VAL 127.A O no hydrogen 2.894 N/A PHE 132.A N VAL 128.A O no hydrogen 2.899 N/A ASN 133.A N ASN 129.A O no hydrogen 3.297 N/A ILE 134.A N LYS 130.A O no hydrogen 2.898 N/A ILE 134.A N LEU 131.A O no hydrogen 3.081 N/A VAL 135.A N LEU 131.A O no hydrogen 2.704 N/A MET 136.A N PHE 132.A O no hydrogen 2.900 N/A ASP 138.A N ILE 25.A O no hydrogen 2.928 N/A TYR 139.A N ILE 25.A O no hydrogen 3.192 N/A ALA 140.A N GLU 165.A O no hydrogen 3.099 N/A TYR 141.A N PHE 27.A O no hydrogen 2.896 N/A PHE 142.A N ILE 167.A O no hydrogen 3.071 N/A LYS 144.A N ILE 169.A O no hydrogen 2.946 N/A LYS 144.A NZ ASP 170.A OD1 no hydrogen 3.270 N/A GLN 148.A NE2 LEU 108.A O no hydrogen 2.918 N/A GLN 149.A N ASP 146.A OD1 no hydrogen 3.172 N/A LEU 150.A N ASP 146.A O no hydrogen 3.142 N/A ALA 151.A N ALA 147.A O no hydrogen 2.904 N/A ILE 152.A N GLN 148.A O no hydrogen 2.999 N/A VAL 153.A N GLN 149.A O no hydrogen 2.840 N/A GLU 154.A N LEU 150.A O no hydrogen 2.860 N/A GLN 155.A N ALA 151.A O no hydrogen 2.874 N/A GLN 155.A NE2 ASP 159.A OD1 no hydrogen 3.138 N/A GLN 155.A NE2 ASP 159.A OD2 no hydrogen 2.906 N/A MET 156.A N ILE 152.A O no hydrogen 2.829 N/A VAL 157.A N VAL 153.A O no hydrogen 2.822 N/A LYS 158.A N GLU 154.A O no hydrogen 2.974 N/A ASP 159.A N GLN 155.A O no hydrogen 2.843 N/A PHE 160.A N MET 156.A O no hydrogen 2.935 N/A ASN 161.A N LYS 158.A O no hydrogen 3.219 N/A HIS 162.A N VAL 157.A O no hydrogen 3.018 N/A HIS 162.A NE2 ASN 129.A OD1 no hydrogen 2.860 N/A GLU 165.A N ASP 138.A O no hydrogen 2.898 N/A ILE 167.A N ALA 140.A O no hydrogen 2.869 N/A ILE 169.A N PHE 142.A O no hydrogen 2.708 N/A ARG 173.A NH1 GLY 177.A O no hydrogen 2.983 N/A ARG 173.A NH1 ASP 271.A OD1 no hydrogen 3.366 N/A ARG 173.A NH1 ASP 271.A OD2 no hydrogen 2.850 N/A ARG 173.A NH2 ASP 271.A OD1 no hydrogen 2.954 N/A GLU 174.A N LEU 178.A O no hydrogen 2.705 N/A GLY 177.A N GLU 174.A O no hydrogen 2.763 N/A LEU 178.A N ASP 176.A OD1 no hydrogen 3.332 N/A LYS 180.A N VAL 172.A O no hydrogen 3.035 N/A LYS 180.A NZ ARG 173.A O no hydrogen 3.486 N/A ARG 183.A N SER 181.A OG no hydrogen 3.117 N/A ASN 184.A N SER 181.A O no hydrogen 3.156 N/A ASN 184.A ND2 ALA 179.A O no hydrogen 3.001 N/A TYR 186.A N ARG 183.A O no hydrogen 3.060 N/A LEU 187.A N ASN 184.A O no hydrogen 3.210 N/A THR 188.A N GLU 191.A OE1 no hydrogen 2.876 N/A GLU 191.A N THR 188.A OG1 no hydrogen 3.122 N/A ARG 192.A N THR 188.A O no hydrogen 2.864 N/A ARG 192.A NH1 ASP 176.A OD2 no hydrogen 3.209 N/A ARG 192.A NH2 ASP 176.A OD2 no hydrogen 2.481 N/A GLN 193.A N GLN 190.A O no hydrogen 2.965 N/A GLU 194.A N GLU 191.A O no hydrogen 3.246 N/A ALA 195.A N GLU 191.A O no hydrogen 2.824 N/A HIS 197.A N GLU 194.A O no hydrogen 2.848 N/A HIS 197.A ND1 TYR 226.A OH no hydrogen 2.786 N/A LEU 198.A N ALA 195.A O no hydrogen 2.930 N/A SER 199.A OG GLY 177.A O no hydrogen 3.322 N/A SER 199.A OG VAL 196.A O no hydrogen 2.948 N/A LYS 200.A N VAL 196.A O no hydrogen 3.384 N/A SER 201.A N HIS 197.A O no hydrogen 2.793 N/A SER 201.A OG LEU 198.A O no hydrogen 2.785 N/A LEU 202.A N LEU 198.A O no hydrogen 3.307 N/A LEU 202.A N SER 199.A O no hydrogen 3.247 N/A LEU 203.A N SER 199.A O no hydrogen 3.149 N/A LEU 204.A N LYS 200.A O no hydrogen 3.139 N/A ALA 205.A N SER 201.A O no hydrogen 3.067 N/A GLN 206.A N LEU 202.A O no hydrogen 2.985 N/A ALA 207.A N LEU 203.A O no hydrogen 2.969 N/A LEU 208.A N LEU 204.A O no hydrogen 2.872 N/A TYR 209.A N ALA 205.A O no hydrogen 3.073 N/A TYR 209.A OH GLY 254.A O no hydrogen 2.800 N/A GLN 210.A N GLN 206.A O no hydrogen 2.826 N/A ASP 211.A N ALA 207.A O no hydrogen 2.978 N/A ASP 211.A N LEU 208.A O no hydrogen 2.690 N/A GLY 212.A N TYR 209.A O no hydrogen 2.846 N/A GLU 213.A N LEU 208.A O no hydrogen 3.328 N/A ARG 214.A NE GLU 213.A O no hydrogen 3.121 N/A ARG 214.A NH2 TYR 209.A O no hydrogen 3.285 N/A SER 216.A OG GLN 249.A O no hydrogen 2.866 N/A VAL 218.A N GLN 215.A O no hydrogen 2.622 N/A ILE 219.A N GLN 215.A O no hydrogen 3.482 N/A ILE 220.A N SER 216.A O no hydrogen 3.015 N/A ASP 221.A N LYS 217.A O no hydrogen 3.161 N/A ARG 222.A N VAL 218.A O no hydrogen 2.884 N/A VAL 223.A N ILE 219.A O no hydrogen 2.958 N/A THR 224.A N ILE 220.A O no hydrogen 2.683 N/A THR 224.A OG1 ILE 220.A O no hydrogen 2.492 N/A GLU 225.A N ASP 221.A O no hydrogen 2.595 N/A TYR 226.A N ARG 222.A O no hydrogen 3.148 N/A TYR 226.A OH HIS 197.A ND1 no hydrogen 2.786 N/A LEU 227.A N VAL 223.A O no hydrogen 2.951 N/A GLU 228.A N THR 224.A O no hydrogen 2.941 N/A SER 229.A N GLU 225.A O no hydrogen 3.295 N/A SER 229.A N TYR 226.A O no hydrogen 3.130 N/A SER 229.A OG GLU 225.A O no hydrogen 3.291 N/A SER 229.A OG TYR 226.A O no hydrogen 2.933 N/A SER 229.A OG HIS 230.A ND1 no hydrogen 3.156 N/A HIS 230.A N TYR 226.A O no hydrogen 3.203 N/A HIS 230.A N LEU 227.A O no hydrogen 3.233 N/A HIS 230.A ND1 TYR 226.A O no hydrogen 2.956 N/A ILE 231.A N LEU 227.A O no hydrogen 2.808 N/A SER 232.A N GLU 194.A OE2 no hydrogen 2.952 N/A SER 232.A OG GLU 194.A OE1 no hydrogen 3.179 N/A SER 232.A OG GLU 194.A OE2 no hydrogen 2.920 N/A ALA 239.A N SER 259.A O no hydrogen 3.189 N/A TYR 241.A N PHE 257.A O no hydrogen 3.025 N/A SER 242.A N VAL 247.A O no hydrogen 2.888 N/A SER 242.A OG VAL 247.A O no hydrogen 3.100 N/A TYR 243.A N ARG 255.A O no hydrogen 2.908 N/A TYR 243.A OH GLU 154.A OE2 no hydrogen 2.979 N/A VAL 247.A N SER 242.A OG no hydrogen 3.283 N/A GLN 249.A N VAL 247.A O no hydrogen 2.818 N/A THR 253.A OG1 GLN 249.A OE1 no hydrogen 3.195 N/A ILE 256.A N ILE 275.A O no hydrogen 2.991 N/A PHE 257.A N TYR 241.A O no hydrogen 2.815 N/A ILE 258.A N ILE 273.A O no hydrogen 2.938 N/A SER 259.A N ALA 239.A O no hydrogen 3.243 N/A SER 259.A OG GLU 237.A OE1 no hydrogen 3.149 N/A LEU 260.A N ASP 271.A O no hydrogen 3.034 N/A ALA 261.A N GLU 237.A O no hydrogen 3.215 N/A VAL 262.A N LEU 269.A O no hydrogen 2.955 N/A LYS 263.A N ARG 234.A O no hydrogen 3.373 N/A LYS 263.A NZ PHE 264.A O no hydrogen 2.976 N/A PHE 264.A N ALA 267.A O no hydrogen 2.746 N/A SER 265.A N GLU 191.A OE2 no hydrogen 3.275 N/A ALA 267.A N PHE 264.A O no hydrogen 3.027 N/A ARG 268.A NE GLU 236.A OE2 no hydrogen 2.733 N/A LEU 269.A N VAL 262.A O no hydrogen 2.947 N/A ASN 272.A N ASP 271.A OD1 no hydrogen 2.900 N/A ASN 272.A ND2 LYS 145.A O no hydrogen 3.219 N/A ILE 273.A N ILE 258.A O no hydrogen 3.171 N/A ILE 275.A N ILE 256.A O no hydrogen 3.103 N/A