Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5hxs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N MET 1.A O no hydrogen 3.121 N/A GLY 5.A N VAL 2.A O no hydrogen 3.192 N/A VAL 6.A N VAL 2.A O no hydrogen 3.023 N/A GLY 7.A N ILE 3.A O no hydrogen 3.239 N/A TYR 8.A N LEU 4.A O no hydrogen 2.990 N/A PHE 9.A N GLY 5.A O no hydrogen 3.004 N/A LEU 10.A N VAL 6.A O no hydrogen 3.105 N/A LEU 11.A N GLY 7.A O no hydrogen 2.953 N/A GLY 12.A N TYR 8.A O no hydrogen 3.071 N/A LEU 13.A N PHE 9.A O no hydrogen 3.190 N/A ILE 14.A N LEU 10.A O no hydrogen 3.050 N/A LEU 15.A N LEU 11.A O no hydrogen 2.842 N/A LEU 16.A N GLY 12.A O no hydrogen 2.744 N/A TYR 17.A N LEU 13.A O no hydrogen 2.830 N/A TYR 18.A N ILE 14.A O no hydrogen 3.154 N/A GLY 19.A N LEU 15.A O no hydrogen 2.983 N/A SER 20.A N LEU 16.A O no hydrogen 3.016 N/A SER 20.A OG LEU 16.A O no hydrogen 3.017 N/A SER 20.A OG TYR 17.A O no hydrogen 3.036 N/A SER 20.A OG MET 211.A O no hydrogen 3.554 N/A TRP 22.A N TYR 18.A O no hydrogen 3.180 N/A PHE 23.A N GLY 19.A O no hydrogen 3.030 N/A VAL 24.A N SER 20.A O no hydrogen 2.884 N/A LEU 25.A N ASP 21.A O no hydrogen 2.776 N/A GLY 26.A N TRP 22.A O no hydrogen 2.696 N/A SER 27.A N PHE 23.A O no hydrogen 3.076 N/A SER 27.A OG PHE 23.A O no hydrogen 2.717 N/A GLU 28.A N VAL 24.A O no hydrogen 2.960 N/A ARG 29.A N LEU 25.A O no hydrogen 3.147 N/A ARG 29.A NE SER 160.A OG no hydrogen 2.746 N/A ARG 29.A NH2 SER 156.A O no hydrogen 3.241 N/A ILE 30.A N GLY 26.A O no hydrogen 3.095 N/A ALA 31.A N SER 27.A O no hydrogen 3.030 N/A ARG 32.A N GLU 28.A O no hydrogen 3.438 N/A ARG 32.A NH1 GLU 28.A OE1 no hydrogen 2.947 N/A HIS 33.A N ARG 29.A O no hydrogen 3.092 N/A PHE 34.A N ILE 30.A O no hydrogen 2.774 N/A VAL 36.A N ALA 31.A O no hydrogen 2.993 N/A VAL 40.A N SER 37.A OG no hydrogen 3.411 N/A ILE 41.A N SER 37.A O no hydrogen 3.242 N/A GLY 42.A N ASN 38.A O no hydrogen 2.954 N/A ALA 43.A N PHE 39.A O no hydrogen 2.712 N/A THR 44.A N VAL 40.A O no hydrogen 2.894 N/A THR 44.A OG1 VAL 40.A O no hydrogen 2.771 N/A VAL 45.A N THR 44.A OG1 no hydrogen 2.596 N/A MET 46.A N ILE 41.A O no hydrogen 3.082 N/A ILE 48.A N THR 44.A O no hydrogen 2.992 N/A GLY 49.A N VAL 45.A O no hydrogen 2.994 N/A THR 50.A N MET 46.A O no hydrogen 2.935 N/A THR 50.A OG1 MET 46.A O no hydrogen 2.802 N/A THR 50.A OG1 ALA 47.A O no hydrogen 3.234 N/A THR 50.A OG1 GLU 209.A OE2 no hydrogen 2.874 N/A THR 50.A OG1 ASN 228.A OD1 no hydrogen 3.399 N/A SER 51.A N ILE 48.A O no hydrogen 3.171 N/A SER 51.A OG ALA 47.A O no hydrogen 2.984 N/A SER 51.A OG GLU 209.A OE2 no hydrogen 3.501 N/A GLU 54.A N GLU 54.A OE1 no hydrogen 2.804 N/A ILE 55.A N SER 51.A O no hydrogen 3.090 N/A LEU 56.A N LEU 52.A O no hydrogen 3.099 N/A THR 57.A N PRO 53.A O no hydrogen 2.802 N/A THR 57.A OG1 PRO 53.A O no hydrogen 2.626 N/A SER 58.A N GLU 54.A O no hydrogen 3.037 N/A SER 58.A OG GLU 54.A O no hydrogen 2.908 N/A SER 58.A OG ALA 240.A O no hydrogen 2.696 N/A ALA 59.A N ILE 55.A O no hydrogen 3.122 N/A TYR 60.A N LEU 56.A O no hydrogen 3.134 N/A ALA 61.A N THR 57.A O no hydrogen 2.870 N/A SER 62.A N SER 58.A O no hydrogen 2.995 N/A SER 62.A OG GLY 244.A O no hydrogen 2.452 N/A TYR 63.A N ALA 59.A O no hydrogen 3.077 N/A MET 64.A N TYR 60.A O no hydrogen 2.829 N/A ALA 66.A N ALA 61.A O no hydrogen 2.811 N/A SER 70.A N ALA 66.A O no hydrogen 3.329 N/A SER 70.A OG SER 58.A O no hydrogen 3.211 N/A ILE 71.A N PRO 67.A O no hydrogen 3.062 N/A GLY 72.A N GLY 68.A O no hydrogen 2.958 N/A ASN 73.A N ILE 69.A O no hydrogen 2.704 N/A ASN 73.A ND2 THR 205.A OG1 no hydrogen 3.186 N/A ALA 74.A N SER 70.A O no hydrogen 3.269 N/A ILE 75.A N ILE 71.A O no hydrogen 2.968 N/A GLY 76.A N GLY 72.A O no hydrogen 2.822 N/A SER 77.A N ASN 73.A O no hydrogen 3.137 N/A SER 77.A OG GLU 54.A OE2 no hydrogen 2.988 N/A SER 77.A OG ASN 73.A O no hydrogen 2.565 N/A CYS 78.A N ALA 74.A O no hydrogen 3.374 N/A CYS 78.A SG ALA 74.A O no hydrogen 3.304 N/A CYS 78.A SG ASN 233.A O no hydrogen 3.347 N/A CYS 78.A SG ASP 236.A OD2 no hydrogen 3.833 N/A ILE 79.A N ILE 75.A O no hydrogen 3.170 N/A CYS 80.A N GLY 76.A O no hydrogen 3.062 N/A ASN 81.A N SER 77.A O no hydrogen 2.844 N/A ILE 82.A N CYS 78.A O no hydrogen 3.449 N/A GLY 83.A N ILE 79.A O no hydrogen 2.848 N/A LEU 84.A N CYS 80.A O no hydrogen 2.864 N/A VAL 85.A N CYS 80.A O no hydrogen 2.980 N/A LEU 86.A N ASN 81.A O no hydrogen 2.691 N/A LEU 88.A N LEU 84.A O no hydrogen 2.944 N/A SER 89.A N VAL 85.A O no hydrogen 3.259 N/A SER 89.A OG VAL 85.A O no hydrogen 2.995 N/A ALA 90.A N LEU 86.A O no hydrogen 3.015 N/A ILE 92.A N LEU 88.A O no hydrogen 2.997 N/A SER 93.A N SER 89.A O no hydrogen 2.690 N/A SER 93.A OG ASN 220.A OD1 no hydrogen 3.350 N/A ILE 95.A N ILE 276.A O no hydrogen 2.855 N/A ASN 100.A N ASP 98.A OD2 no hydrogen 3.138 N/A LEU 101.A N ASP 98.A O no hydrogen 2.947 N/A GLN 102.A N ASP 98.A O no hydrogen 3.091 N/A GLN 102.A NE2 VAL 97.A O no hydrogen 2.956 N/A LYS 103.A N LYS 99.A O no hydrogen 3.484 N/A ASN 104.A ND2 THR 142.A OG1 no hydrogen 3.188 N/A ILE 105.A N LEU 101.A O no hydrogen 2.947 N/A LEU 106.A N GLN 102.A O no hydrogen 2.903 N/A VAL 107.A N LYS 103.A O no hydrogen 3.173 N/A TYR 108.A N ASN 104.A O no hydrogen 3.124 N/A TYR 108.A OH SER 264.A OG no hydrogen 2.834 N/A LEU 109.A N ILE 105.A O no hydrogen 2.970 N/A LEU 110.A N LEU 106.A O no hydrogen 2.999 N/A PHE 111.A N VAL 107.A O no hydrogen 2.872 N/A VAL 112.A N TYR 108.A O no hydrogen 2.998 N/A ILE 113.A N LEU 109.A O no hydrogen 2.990 N/A PHE 114.A N LEU 110.A O no hydrogen 2.966 N/A ALA 115.A N PHE 111.A O no hydrogen 2.935 N/A ALA 116.A N VAL 112.A O no hydrogen 2.790 N/A VAL 117.A N ILE 113.A O no hydrogen 3.051 N/A ILE 118.A N PHE 114.A O no hydrogen 3.194 N/A ILE 120.A N VAL 117.A O no hydrogen 3.345 N/A GLY 122.A N GLY 119.A O no hydrogen 2.798 N/A PHE 123.A N LEU 250.A O no hydrogen 2.923 N/A SER 124.A N ASP 127.A OD2 no hydrogen 3.222 N/A ASP 127.A N SER 124.A OG no hydrogen 3.340 N/A GLY 128.A N SER 124.A O no hydrogen 3.212 N/A VAL 129.A N TRP 125.A O no hydrogen 3.080 N/A VAL 130.A N ILE 126.A O no hydrogen 2.966 N/A LEU 131.A N ASP 127.A O no hydrogen 2.801 N/A LEU 132.A N GLY 128.A O no hydrogen 2.814 N/A ILE 133.A N VAL 129.A O no hydrogen 3.230 N/A LEU 134.A N VAL 130.A O no hydrogen 3.212 N/A PHE 135.A N LEU 131.A O no hydrogen 3.027 N/A ILE 136.A N LEU 132.A O no hydrogen 3.104 N/A ILE 137.A N ILE 133.A O no hydrogen 2.864 N/A TYR 138.A N LEU 134.A O no hydrogen 2.786 N/A TYR 138.A OH ASN 104.A OD1 no hydrogen 2.820 N/A LEU 139.A N PHE 135.A O no hydrogen 3.123 N/A ARG 140.A N ILE 136.A O no hydrogen 3.138 N/A TRP 141.A N ILE 137.A O no hydrogen 2.786 N/A THR 142.A N TYR 138.A O no hydrogen 2.681 N/A THR 142.A OG1 TYR 138.A O no hydrogen 2.749 N/A VAL 143.A N LEU 139.A O no hydrogen 3.007 N/A LYS 144.A N ARG 140.A O no hydrogen 3.101 N/A ASN 145.A N TRP 141.A O no hydrogen 3.306 N/A GLY 146.A N THR 142.A O no hydrogen 3.216 N/A SER 147.A OG LYS 144.A O no hydrogen 2.474 N/A ALA 148.A N ASN 35.A O no hydrogen 3.357 N/A PHE 159.A N PRO 155.A O no hydrogen 3.431 N/A SER 160.A OG SER 156.A O no hydrogen 2.713 N/A LEU 161.A N VAL 157.A O no hydrogen 2.836 N/A VAL 162.A N VAL 158.A O no hydrogen 2.921 N/A LEU 163.A N PHE 159.A O no hydrogen 2.959 N/A LEU 164.A N SER 160.A O no hydrogen 2.859 N/A ILE 165.A N LEU 161.A O no hydrogen 2.898 N/A ILE 166.A N VAL 162.A O no hydrogen 2.942 N/A GLY 167.A N LEU 163.A O no hydrogen 3.010 N/A LEU 168.A N LEU 164.A O no hydrogen 2.806 N/A ILE 169.A N ILE 165.A O no hydrogen 2.805 N/A GLY 170.A N ILE 166.A O no hydrogen 2.711 N/A VAL 171.A N GLY 167.A O no hydrogen 3.138 N/A LEU 172.A N LEU 168.A O no hydrogen 2.984 N/A VAL 173.A N ILE 169.A O no hydrogen 2.995 N/A GLY 174.A N GLY 170.A O no hydrogen 2.844 N/A ALA 175.A N VAL 171.A O no hydrogen 2.859 N/A GLU 176.A N LEU 172.A O no hydrogen 3.266 N/A LEU 177.A N VAL 173.A O no hydrogen 2.851 N/A PHE 178.A N GLY 174.A O no hydrogen 3.127 N/A VAL 179.A N ALA 175.A O no hydrogen 3.188 N/A ASP 180.A N GLU 176.A O no hydrogen 2.799 N/A GLY 181.A N LEU 177.A O no hydrogen 2.732 N/A ALA 182.A N PHE 178.A O no hydrogen 2.990 N/A LYS 183.A N VAL 179.A O no hydrogen 2.869 N/A LYS 184.A N ASP 180.A O no hydrogen 2.983 N/A ILE 185.A N GLY 181.A O no hydrogen 3.145 N/A ALA 186.A N ALA 182.A O no hydrogen 2.987 N/A ALA 186.A N LYS 183.A O no hydrogen 3.078 N/A LEU 187.A N LYS 183.A O no hydrogen 3.055 N/A ALA 188.A N LYS 184.A O no hydrogen 3.285 N/A LEU 189.A N ILE 185.A O no hydrogen 3.352 N/A ASP 190.A N LEU 187.A O no hydrogen 3.160 N/A ILE 191.A N ALA 186.A O no hydrogen 2.775 N/A GLY 197.A N ASP 193.A O no hydrogen 2.771 N/A PHE 198.A N VAL 195.A O no hydrogen 3.316 N/A THR 199.A N VAL 195.A O no hydrogen 3.184 N/A THR 199.A OG1 VAL 195.A O no hydrogen 2.657 N/A LEU 200.A N ILE 196.A O no hydrogen 3.108 N/A ALA 202.A N PHE 198.A O no hydrogen 2.790 N/A PHE 203.A N THR 199.A O no hydrogen 2.958 N/A THR 205.A N VAL 201.A O no hydrogen 3.157 N/A THR 205.A OG1 GLU 54.A OE2 no hydrogen 3.158 N/A THR 205.A OG1 ALA 202.A O no hydrogen 3.259 N/A SER 206.A N PHE 203.A O no hydrogen 3.209 N/A LEU 207.A N GLY 204.A O no hydrogen 3.337 N/A GLU 209.A N GLU 209.A OE1 no hydrogen 2.990 N/A LEU 210.A N SER 206.A O no hydrogen 2.891 N/A MET 211.A N LEU 207.A O no hydrogen 2.906 N/A VAL 212.A N PRO 208.A O no hydrogen 2.855 N/A SER 213.A N GLU 209.A O no hydrogen 2.955 N/A SER 213.A OG GLU 209.A O no hydrogen 2.857 N/A LEU 214.A N LEU 210.A O no hydrogen 3.015 N/A ALA 215.A N MET 211.A O no hydrogen 3.059 N/A ALA 216.A N VAL 212.A O no hydrogen 3.075 N/A ALA 217.A N SER 213.A O no hydrogen 2.836 N/A LYS 218.A N LEU 214.A O no hydrogen 3.199 N/A ARG 219.A N ALA 216.A O no hydrogen 3.194 N/A ARG 219.A NE ASP 21.A OD1 no hydrogen 2.961 N/A ARG 219.A NH2 ASP 21.A OD1 no hydrogen 3.279 N/A ARG 219.A NH2 ASP 21.A OD2 no hydrogen 2.894 N/A ASN 220.A N ALA 217.A O no hydrogen 2.942 N/A LEU 221.A N ALA 216.A O no hydrogen 2.702 N/A MET 224.A N LEU 221.A O no hydrogen 3.005 N/A VAL 225.A N LEU 221.A O no hydrogen 3.155 N/A LEU 226.A N GLY 222.A O no hydrogen 2.739 N/A GLY 227.A N GLY 223.A O no hydrogen 3.074 N/A ASN 228.A N MET 224.A O no hydrogen 2.939 N/A ASN 228.A ND2 SER 213.A OG no hydrogen 3.217 N/A VAL 229.A N VAL 225.A O no hydrogen 2.863 N/A ILE 230.A N LEU 226.A O no hydrogen 2.967 N/A GLY 231.A N GLY 227.A O no hydrogen 2.774 N/A SER 232.A N ASN 228.A O no hydrogen 2.956 N/A SER 232.A OG GLU 209.A OE2 no hydrogen 3.163 N/A SER 232.A OG ASN 228.A O no hydrogen 2.740 N/A ASN 233.A N VAL 229.A O no hydrogen 3.156 N/A ILE 234.A N ILE 230.A O no hydrogen 3.324 N/A ALA 235.A N GLY 231.A O no hydrogen 2.866 N/A ASP 236.A N SER 232.A O no hydrogen 2.717 N/A ILE 237.A N ASN 233.A O no hydrogen 2.964 N/A GLY 238.A N ILE 234.A O no hydrogen 2.503 N/A ALA 240.A N ALA 235.A O no hydrogen 2.937 N/A LEU 241.A N ASP 236.A O no hydrogen 2.623 N/A ALA 242.A N ILE 237.A O no hydrogen 3.233 N/A VAL 243.A N GLY 239.A O no hydrogen 2.946 N/A GLY 244.A N ALA 240.A O no hydrogen 3.265 N/A SER 245.A N LEU 241.A O no hydrogen 3.169 N/A SER 245.A N ALA 242.A O no hydrogen 3.021 N/A SER 245.A OG ALA 242.A O no hydrogen 2.337 N/A LEU 246.A N VAL 243.A O no hydrogen 3.157 N/A MET 248.A N GLY 244.A O no hydrogen 3.401 N/A LEU 250.A N PHE 123.A O no hydrogen 3.044 N/A ASN 254.A ND2 ILE 120.A O no hydrogen 3.494 N/A MET 257.A N GLU 253.A O no hydrogen 3.289 N/A ALA 258.A N ASN 254.A O no hydrogen 2.890 N/A VAL 259.A N VAL 255.A O no hydrogen 3.088 N/A LEU 260.A N GLN 256.A O no hydrogen 2.826 N/A VAL 261.A N MET 257.A O no hydrogen 2.686 N/A ILE 262.A N ALA 258.A O no hydrogen 3.047 N/A MET 263.A N VAL 259.A O no hydrogen 2.950 N/A SER 264.A N LEU 260.A O no hydrogen 2.727 N/A SER 264.A OG TYR 108.A OH no hydrogen 2.834 N/A SER 264.A OG LEU 260.A O no hydrogen 2.574 N/A LEU 265.A N VAL 261.A O no hydrogen 2.660 N/A LEU 266.A N ILE 262.A O no hydrogen 2.806 N/A LEU 267.A N MET 263.A O no hydrogen 2.975 N/A TYR 268.A N SER 264.A O no hydrogen 3.049 N/A LEU 269.A N LEU 265.A O no hydrogen 2.982 N/A PHE 270.A N LEU 266.A O no hydrogen 2.961 N/A ALA 271.A N LEU 267.A O no hydrogen 3.133 N/A LYS 272.A N TYR 268.A O no hydrogen 2.789 N/A TYR 273.A N LEU 269.A O no hydrogen 2.982 N/A SER 274.A N PHE 270.A O no hydrogen 3.127 N/A ILE 276.A N ILE 95.A O no hydrogen 2.922 N/A GLY 277.A N GLN 280.A OE1 no hydrogen 2.813 N/A GLY 281.A N GLY 277.A O no hydrogen 2.783 N/A ILE 282.A N ARG 278.A O no hydrogen 2.566 N/A LEU 283.A N TRP 279.A O no hydrogen 3.122 N/A PHE 284.A N GLN 280.A O no hydrogen 2.948 N/A LEU 285.A N GLY 281.A O no hydrogen 2.964 N/A ALA 286.A N ILE 282.A O no hydrogen 2.888 N/A LEU 287.A N LEU 283.A O no hydrogen 2.874 N/A TYR 288.A N PHE 284.A O no hydrogen 2.884 N/A ILE 289.A N LEU 285.A O no hydrogen 2.763 N/A ILE 290.A N ALA 286.A O no hydrogen 2.985 N/A ALA 291.A N LEU 287.A O no hydrogen 2.886 N/A ILE 292.A N TYR 288.A O no hydrogen 3.033 N/A ALA 293.A N ILE 290.A O no hydrogen 3.168 N/A SER 294.A N ALA 291.A O no hydrogen 3.352 N/A SER 294.A OG ILE 290.A O no hydrogen 2.703 N/A LEU 295.A N ALA 291.A O no hydrogen 2.946 N/A