Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a5l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ASP 3.A OD1 no hydrogen 3.236 N/A ILE 6.A N ASP 3.A O no hydrogen 3.099 N/A GLY 7.A N ASN 4.A O no hydrogen 3.127 N/A LEU 8.A N VAL 5.A O no hydrogen 2.942 N/A GLU 9.A N VAL 5.A O no hydrogen 3.002 N/A ILE 10.A N ILE 6.A O no hydrogen 3.170 N/A ILE 11.A N LEU 8.A O no hydrogen 3.165 N/A VAL 13.A N GLU 9.A O no hydrogen 3.188 N/A VAL 14.A N ILE 10.A O no hydrogen 3.100 N/A GLU 15.A N ILE 11.A O no hydrogen 3.100 N/A GLN 16.A N GLU 12.A O no hydrogen 2.980 N/A ALA 17.A N VAL 13.A O no hydrogen 3.063 N/A ALA 18.A N VAL 14.A O no hydrogen 2.940 N/A ILE 19.A N GLU 15.A O no hydrogen 2.944 N/A ALA 20.A N GLN 16.A O no hydrogen 3.102 N/A SER 21.A N ALA 17.A O no hydrogen 3.030 N/A SER 21.A OG ALA 33.A O no hydrogen 3.383 N/A ALA 22.A N ALA 18.A O no hydrogen 2.787 N/A ARG 23.A N ILE 19.A O no hydrogen 3.161 N/A ARG 23.A N ALA 20.A O no hydrogen 3.249 N/A TRP 24.A N SER 21.A O no hydrogen 2.895 N/A MET 25.A N ALA 22.A O no hydrogen 2.999 N/A GLY 26.A N CYS 106.A O no hydrogen 2.908 N/A LYS 27.A N TRP 24.A O no hydrogen 3.063 N/A GLY 28.A N ALA 107.A O no hydrogen 2.899 N/A MET 32.A N ASP 29.A OD1 no hydrogen 2.777 N/A ALA 33.A N ASP 29.A O no hydrogen 3.131 N/A ASP 34.A N LYS 30.A O no hydrogen 3.178 N/A GLN 35.A N ASN 31.A O no hydrogen 2.895 N/A ALA 36.A N MET 32.A O no hydrogen 3.081 N/A ALA 37.A N ALA 33.A O no hydrogen 3.437 N/A VAL 38.A N ASP 34.A O no hydrogen 2.844 N/A ASP 39.A N GLN 35.A O no hydrogen 2.910 N/A ALA 40.A N ALA 36.A O no hydrogen 2.937 N/A MET 41.A N ALA 37.A O no hydrogen 2.853 N/A ARG 42.A N VAL 38.A O no hydrogen 3.000 N/A ARG 42.A NH1 GLU 71.A OE2 no hydrogen 2.962 N/A ASN 43.A N ASP 39.A O no hydrogen 3.111 N/A ASN 43.A ND2 ASP 39.A OD1 no hydrogen 3.026 N/A ARG 44.A N ALA 40.A O no hydrogen 3.084 N/A ARG 44.A NH1 GLU 9.A OE1 no hydrogen 2.972 N/A ARG 44.A NH1 ARG 44.A O no hydrogen 3.023 N/A ARG 44.A NH2 GLU 9.A OE1 no hydrogen 2.911 N/A ARG 44.A NH2 GLU 12.A OE1 no hydrogen 2.582 N/A MET 45.A N MET 41.A O no hydrogen 2.975 N/A ASN 46.A N ARG 42.A O no hydrogen 2.850 N/A GLN 47.A N ARG 44.A O no hydrogen 3.167 N/A GLN 47.A NE2 ASN 43.A O no hydrogen 3.305 N/A ILE 48.A N MET 45.A O no hydrogen 2.953 N/A MET 50.A N ILE 48.A O no hydrogen 2.923 N/A ARG 51.A NH1 LEU 90.A O no hydrogen 3.470 N/A GLY 52.A N VAL 73.A O no hydrogen 2.930 N/A ARG 53.A N ILE 93.A O no hydrogen 2.892 N/A ARG 53.A NE ASP 94.A OD1 no hydrogen 3.031 N/A ARG 53.A NH2 ASP 94.A OD1 no hydrogen 3.015 N/A ARG 53.A NH2 ASP 94.A OD2 no hydrogen 2.735 N/A ILE 54.A N GLU 71.A O no hydrogen 2.941 N/A VAL 55.A N ILE 95.A O no hydrogen 2.961 N/A GLU 58.A N LEU 67.A O no hydrogen 3.007 N/A GLU 60.A N GLU 63.A OE1 no hydrogen 3.232 N/A GLU 63.A N GLU 60.A O no hydrogen 2.722 N/A ILE 69.A N GLY 59.A O no hydrogen 2.840 N/A GLY 70.A N ILE 54.A O no hydrogen 2.575 N/A GLU 71.A N TYR 68.A O no hydrogen 3.053 N/A VAL 73.A N GLY 52.A O no hydrogen 3.005 N/A GLY 74.A N ASN 46.A OD1 no hydrogen 2.942 N/A ILE 75.A N ILE 48.A O no hydrogen 2.868 N/A CYS 76.A N MET 50.A O no hydrogen 3.088 N/A CYS 76.A SG GLU 89.A O no hydrogen 3.817 N/A THR 77.A N GLY 74.A O no hydrogen 3.383 N/A THR 77.A OG1 GLY 74.A O no hydrogen 2.725 N/A ARG 78.A N ILE 75.A O no hydrogen 3.402 N/A ARG 78.A NH2 ASP 80.A OD2 no hydrogen 3.022 N/A ALA 81.A N ARG 78.A O no hydrogen 3.070 N/A GLN 83.A N ASP 80.A O no hydrogen 2.947 N/A TYR 84.A N ALA 81.A O no hydrogen 2.855 N/A CYS 85.A N ALA 81.A O no hydrogen 2.714 N/A ASN 86.A N GLU 89.A OE1 no hydrogen 2.596 N/A LEU 90.A N ASN 86.A O no hydrogen 2.920 N/A LEU 90.A N PRO 87.A O no hydrogen 2.956 N/A ILE 91.A N GLU 88.A O no hydrogen 3.332 N/A ILE 93.A N ARG 51.A O no hydrogen 2.977 N/A ASP 94.A N SER 120.A O no hydrogen 2.737 N/A ILE 95.A N ARG 53.A O no hydrogen 2.820 N/A ALA 96.A N ALA 118.A O no hydrogen 2.740 N/A VAL 97.A N ILE 56.A O no hydrogen 2.870 N/A ASP 98.A N VAL 116.A O no hydrogen 2.880 N/A CYS 100.A SG SER 21.A OG no hydrogen 3.434 N/A CYS 100.A SG SER 113.A OG no hydrogen 3.754 N/A GLU 101.A N MET 114.A O no hydrogen 2.744 N/A ASN 104.A ND2 ASP 199.A OD2 no hydrogen 3.372 N/A CYS 106.A N GLY 102.A O no hydrogen 3.187 N/A CYS 106.A SG SER 21.A O no hydrogen 3.299 N/A CYS 106.A SG SER 21.A OG no hydrogen 3.691 N/A ALA 107.A N THR 103.A O no hydrogen 2.886 N/A TYR 108.A N ASN 104.A O no hydrogen 3.097 N/A GLY 109.A N CYS 106.A O no hydrogen 3.471 N/A GLN 110.A N LEU 105.A O no hydrogen 2.699 N/A GLN 110.A NE2 TYR 108.A O no hydrogen 3.218 N/A GLY 112.A N PRO 301.A O no hydrogen 2.887 N/A SER 113.A N THR 300.A OG1 no hydrogen 3.120 N/A SER 113.A OG GLU 101.A O no hydrogen 3.534 N/A SER 113.A OG GLY 102.A O no hydrogen 3.304 N/A MET 114.A N GLU 101.A O no hydrogen 3.436 N/A ALA 115.A N CYS 297.A O no hydrogen 2.862 N/A VAL 116.A N ASP 98.A O no hydrogen 3.090 N/A LEU 117.A N ALA 295.A O no hydrogen 2.976 N/A ALA 118.A N ALA 96.A O no hydrogen 2.846 N/A ILE 119.A N LEU 293.A O no hydrogen 2.924 N/A SER 120.A N ASP 94.A O no hydrogen 3.042 N/A SER 120.A OG GLU 121.A OE2 no hydrogen 2.992 N/A SER 120.A OG THR 291.A O no hydrogen 2.699 N/A LYS 122.A N GLU 92.A O no hydrogen 2.958 N/A LYS 122.A NZ GLU 92.A OE2 no hydrogen 3.367 N/A GLY 123.A N ASP 94.A OD2 no hydrogen 2.846 N/A GLY 124.A N GLU 121.A O no hydrogen 2.823 N/A PHE 126.A N LEU 286.A O no hydrogen 2.762 N/A PHE 131.A N PRO 129.A O no hydrogen 2.680 N/A TYR 132.A OH THR 254.A OG1 no hydrogen 3.027 N/A MET 133.A N GLY 222.A O no hydrogen 2.637 N/A LYS 134.A N GLN 244.A O no hydrogen 2.810 N/A LYS 134.A NZ ILE 148.A O no hydrogen 3.128 N/A LYS 135.A N GLY 220.A O no hydrogen 2.793 N/A LYS 135.A NZ ASP 201.A OD1 no hydrogen 3.278 N/A LYS 135.A NZ ASP 201.A OD2 no hydrogen 2.623 N/A LYS 135.A NZ ALA 223.A O no hydrogen 2.922 N/A LEU 136.A N GLN 242.A O no hydrogen 3.020 N/A ALA 137.A N LEU 218.A O no hydrogen 3.151 N/A ALA 138.A N HIS 240.A O no hydrogen 3.235 N/A ALA 142.A N PRO 139.A O no hydrogen 2.884 N/A LYS 143.A N PRO 140.A O no hydrogen 3.119 N/A LYS 143.A NZ GLU 284.A OE2 no hydrogen 2.783 N/A GLY 144.A N HIS 240.A ND1 no hydrogen 3.119 N/A LYS 145.A N ALA 142.A O no hydrogen 2.883 N/A VAL 146.A N ALA 142.A O no hydrogen 3.214 N/A ASP 147.A N ASN 155.A OD1 no hydrogen 2.950 N/A ILE 148.A N GLN 242.A OE1 no hydrogen 2.809 N/A ARG 149.A N ASP 147.A OD2 no hydrogen 2.847 N/A ARG 149.A NH1 ASP 147.A OD2 no hydrogen 3.520 N/A ASN 150.A N ASP 147.A O no hydrogen 2.930 N/A ASN 150.A ND2 ASN 155.A OD1 no hydrogen 3.406 N/A SER 151.A OG THR 153.A OG1 no hydrogen 2.983 N/A THR 153.A N GLU 186.A OE2 no hydrogen 3.137 N/A THR 153.A OG1 SER 151.A OG no hydrogen 2.983 N/A GLU 154.A N SER 151.A OG no hydrogen 3.051 N/A ASN 155.A N SER 151.A O no hydrogen 2.962 N/A ASN 155.A ND2 ASP 147.A O no hydrogen 2.814 N/A LEU 156.A N ALA 152.A O no hydrogen 2.973 N/A LYS 157.A N THR 153.A O no hydrogen 3.225 N/A ILE 158.A N GLU 154.A O no hydrogen 3.015 N/A LEU 159.A N ASN 155.A O no hydrogen 2.822 N/A SER 160.A N LEU 156.A O no hydrogen 2.772 N/A SER 160.A OG ARG 165.A O no hydrogen 2.650 N/A GLU 161.A N LYS 157.A O no hydrogen 3.334 N/A CYS 162.A N ILE 158.A O no hydrogen 2.926 N/A CYS 162.A SG ALA 141.A O no hydrogen 3.698 N/A CYS 162.A SG ILE 158.A O no hydrogen 3.300 N/A LEU 163.A N LEU 159.A O no hydrogen 2.933 N/A ARG 165.A N SER 160.A O no hydrogen 3.171 N/A ARG 165.A NH2 GLU 169.A OE1 no hydrogen 3.091 N/A GLU 169.A N ALA 166.A O no hydrogen 3.017 N/A LEU 170.A N ILE 167.A O no hydrogen 3.139 N/A VAL 171.A N HIS 216.A ND1 no hydrogen 3.080 N/A VAL 172.A N ARG 193.A O no hydrogen 2.919 N/A VAL 173.A N ALA 217.A O no hydrogen 2.956 N/A VAL 174.A N GLN 195.A O no hydrogen 3.101 N/A LYS 176.A N ILE 197.A O no hydrogen 2.846 N/A ARG 177.A NH1 LYS 176.A O no hydrogen 3.017 N/A ARG 177.A NH1 SER 198.A O no hydrogen 2.873 N/A ARG 177.A NH2 SER 198.A O no hydrogen 3.131 N/A ARG 177.A NH2 ASP 199.A OD1 no hydrogen 3.155 N/A ARG 179.A NE VAL 252.A O no hydrogen 3.371 N/A HIS 180.A N ARG 177.A O no hydrogen 2.974 N/A HIS 180.A ND1 MET 175.A O no hydrogen 2.877 N/A ASN 181.A N ASP 178.A O no hydrogen 3.307 N/A ILE 184.A N HIS 180.A O no hydrogen 2.821 N/A GLN 185.A N ASN 181.A O no hydrogen 3.031 N/A GLN 185.A NE2 ASP 189.A OD1 no hydrogen 2.652 N/A GLU 186.A N ASP 182.A O no hydrogen 2.977 N/A ILE 187.A N LEU 183.A O no hydrogen 3.109 N/A ARG 188.A N ILE 184.A O no hydrogen 3.199 N/A ASP 189.A N GLN 185.A O no hydrogen 2.876 N/A ALA 190.A N GLU 186.A O no hydrogen 2.836 N/A GLY 191.A N ARG 188.A O no hydrogen 2.655 N/A ALA 192.A N ILE 187.A O no hydrogen 3.061 N/A ARG 193.A N LEU 170.A O no hydrogen 2.958 N/A ARG 193.A NE ASP 168.A O no hydrogen 2.956 N/A GLN 195.A N VAL 172.A O no hydrogen 2.814 N/A ILE 197.A N VAL 174.A O no hydrogen 3.182 N/A VAL 202.A N GLU 101.A OE1 no hydrogen 3.237 N/A SER 203.A OG GLY 112.A O no hydrogen 3.095 N/A SER 203.A OG GLY 200.A O no hydrogen 3.420 N/A ALA 205.A N ASP 201.A O no hydrogen 3.122 N/A LEU 206.A N VAL 202.A O no hydrogen 3.074 N/A ALA 207.A N SER 203.A O no hydrogen 2.989 N/A CYS 208.A N ALA 205.A O no hydrogen 3.252 N/A CYS 208.A SG ALA 204.A O no hydrogen 3.529 N/A ALA 209.A N LEU 206.A O no hydrogen 3.147 N/A PHE 210.A N ALA 207.A O no hydrogen 3.158 N/A THR 213.A OG1 ALA 207.A O no hydrogen 2.816 N/A THR 213.A OG1 PHE 210.A O no hydrogen 3.146 N/A ILE 215.A N THR 213.A OG1 no hydrogen 3.391 N/A HIS 216.A N VAL 171.A O no hydrogen 3.010 N/A ALA 217.A N VAL 171.A O no hydrogen 3.318 N/A LEU 218.A N ALA 137.A O no hydrogen 2.945 N/A MET 219.A N VAL 173.A O no hydrogen 3.181 N/A ILE 221.A N HIS 180.A NE2 no hydrogen 2.914 N/A GLY 222.A N MET 133.A O no hydrogen 2.686 N/A ALA 224.A N PHE 131.A O no hydrogen 2.728 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.640 N/A GLY 227.A N ALA 223.A O no hydrogen 3.166 N/A VAL 228.A N ALA 224.A O no hydrogen 3.200 N/A VAL 228.A N PRO 225.A O no hydrogen 3.058 N/A ILE 229.A N PRO 225.A O no hydrogen 3.380 N/A SER 230.A N GLU 226.A O no hydrogen 3.135 N/A SER 230.A OG GLU 226.A O no hydrogen 3.336 N/A ALA 231.A N GLY 227.A O no hydrogen 2.863 N/A ALA 232.A N VAL 228.A O no hydrogen 3.033 N/A ALA 233.A N ILE 229.A O no hydrogen 3.221 N/A MET 234.A N SER 230.A O no hydrogen 3.037 N/A ARG 235.A N ALA 231.A O no hydrogen 2.884 N/A ARG 235.A NH1 ALA 287.A O no hydrogen 3.036 N/A ARG 235.A NH1 GLY 289.A O no hydrogen 2.485 N/A ARG 235.A NH2 GLY 289.A O no hydrogen 3.183 N/A ARG 235.A NH2 GLU 290.A O no hydrogen 3.497 N/A ALA 236.A N ALA 232.A O no hydrogen 3.128 N/A LEU 237.A N ALA 233.A O no hydrogen 2.877 N/A GLY 239.A N MET 234.A O no hydrogen 2.888 N/A HIS 240.A N ALA 138.A O no hydrogen 2.856 N/A HIS 240.A NE2 GLN 242.A OE1 no hydrogen 2.724 N/A GLN 242.A N LEU 136.A O no hydrogen 3.063 N/A GLN 242.A NE2 ASP 147.A OD1 no hydrogen 2.993 N/A GLN 242.A NE2 GLU 282.A OE2 no hydrogen 3.279 N/A GLY 243.A N TYR 281.A O no hydrogen 3.008 N/A GLN 244.A N LYS 134.A O no hydrogen 2.914 N/A GLN 244.A NE2 ASP 278.A O no hydrogen 2.850 N/A VAL 246.A N TYR 132.A O no hydrogen 2.967 N/A TYR 247.A OH ASP 278.A OD1 no hydrogen 2.830 N/A ALA 250.A N ASP 248.A OD1 no hydrogen 3.484 N/A VAL 251.A N ASP 248.A O no hydrogen 2.785 N/A MET 253.A N PRO 249.A O no hydrogen 3.062 N/A THR 254.A OG1 TYR 132.A OH no hydrogen 3.027 N/A GLU 256.A N GLU 256.A OE1 no hydrogen 3.197 N/A TRP 257.A N THR 254.A O no hydrogen 3.380 N/A ALA 258.A N LYS 255.A O no hydrogen 3.222 N/A ARG 260.A N TRP 257.A O no hydrogen 3.302 N/A ARG 260.A NH1 ASN 265.A OD1 no hydrogen 3.243 N/A ARG 262.A NH1 GLU 263.A OE2 no hydrogen 3.407 N/A GLY 264.A N THR 261.A OG1 no hydrogen 3.070 N/A ASN 265.A N THR 261.A O no hydrogen 2.990 N/A ASN 265.A ND2 TYR 247.A O no hydrogen 2.876 N/A LEU 266.A N ARG 262.A O no hydrogen 2.908 N/A GLU 267.A N GLU 263.A O no hydrogen 3.014 N/A GLU 268.A N GLY 264.A O no hydrogen 3.091 N/A LEU 269.A N ASN 265.A O no hydrogen 2.966 N/A LYS 270.A N LEU 266.A O no hydrogen 3.086 N/A LYS 271.A N GLU 267.A O no hydrogen 3.047 N/A LYS 271.A NZ GLU 267.A OE2 no hydrogen 3.192 N/A ALA 272.A N GLU 268.A O no hydrogen 3.163 N/A ALA 272.A N LEU 269.A O no hydrogen 3.114 N/A GLY 273.A N LYS 270.A O no hydrogen 2.743 N/A ILE 274.A N LEU 269.A O no hydrogen 3.087 N/A ASP 278.A N ASP 276.A OD1 no hydrogen 3.397 N/A LYS 279.A N ASP 276.A O no hydrogen 3.213 N/A LYS 279.A NZ VAL 280.A O no hydrogen 3.186 N/A LYS 279.A NZ GLU 285.A OE1 no hydrogen 3.092 N/A LYS 279.A NZ GLU 285.A OE2 no hydrogen 2.945 N/A TYR 281.A N GLY 243.A O no hydrogen 2.691 N/A GLU 282.A N GLU 285.A OE1 no hydrogen 2.886 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 2.785 N/A GLU 285.A N GLU 282.A O no hydrogen 2.939 N/A LEU 286.A N GLU 282.A O no hydrogen 3.073 N/A ALA 287.A N ALA 283.A O no hydrogen 2.895 N/A SER 288.A N GLY 124.A O no hydrogen 2.752 N/A GLY 289.A N GLY 124.A O no hydrogen 3.167 N/A THR 291.A N GLU 121.A OE2 no hydrogen 2.624 N/A THR 291.A OG1 GLU 121.A OE1 no hydrogen 3.364 N/A VAL 292.A N THR 324.A OG1 no hydrogen 2.837 N/A LEU 293.A N ILE 119.A O no hydrogen 2.824 N/A PHE 294.A N ILE 322.A O no hydrogen 3.025 N/A ALA 295.A N LEU 117.A O no hydrogen 3.043 N/A ALA 296.A N LEU 320.A O no hydrogen 2.803 N/A CYS 297.A N ALA 115.A O no hydrogen 2.869 N/A CYS 297.A SG GLY 298.A O no hydrogen 3.744 N/A CYS 297.A SG GLN 318.A O no hydrogen 3.364 N/A CYS 297.A SG SER 319.A OG no hydrogen 3.229 N/A GLY 298.A N GLN 318.A O no hydrogen 3.144 N/A ILE 299.A N SER 113.A O no hydrogen 2.900 N/A THR 300.A N SER 113.A O no hydrogen 3.412 N/A THR 300.A OG1 GLN 110.A O no hydrogen 2.480 N/A GLY 302.A N MET 305.A O no hydrogen 2.912 N/A LYS 306.A N GLN 318.A OE1 no hydrogen 3.049 N/A VAL 308.A N ILE 299.A O no hydrogen 2.951 N/A ARG 309.A N ARG 316.A O no hydrogen 3.128 N/A PHE 311.A N GLY 314.A O no hydrogen 2.948 N/A GLY 314.A N PHE 311.A O no hydrogen 2.929 N/A ALA 315.A N HIS 336.A O no hydrogen 3.102 N/A ARG 316.A N ARG 309.A O no hydrogen 2.745 N/A ARG 316.A NE ASP 333.A OD1 no hydrogen 2.617 N/A ARG 316.A NH2 ASP 333.A OD1 no hydrogen 3.325 N/A THR 317.A N THR 334.A O no hydrogen 2.958 N/A THR 317.A OG1 HIS 336.A NE2 no hydrogen 2.941 N/A GLN 318.A NE2 ASP 333.A OD2 no hydrogen 2.845 N/A SER 319.A N VAL 332.A O no hydrogen 2.805 N/A LEU 320.A N ALA 296.A O no hydrogen 2.789 N/A VAL 321.A N ARG 330.A O no hydrogen 2.845 N/A ILE 322.A N PHE 294.A O no hydrogen 2.793 N/A SER 323.A N THR 328.A O no hydrogen 2.995 N/A SER 323.A OG SER 326.A OG no hydrogen 3.123 N/A THR 324.A N VAL 292.A O no hydrogen 3.157 N/A THR 324.A OG1 VAL 292.A O no hydrogen 3.344 N/A GLN 325.A N SER 323.A OG no hydrogen 3.046 N/A GLN 325.A NE2 MET 2.A O no hydrogen 3.277 N/A SER 326.A N SER 323.A OG no hydrogen 2.910 N/A SER 326.A OG SER 323.A OG no hydrogen 3.123 N/A SER 326.A OG THR 328.A OG1 no hydrogen 2.787 N/A THR 328.A N SER 323.A O no hydrogen 3.222 N/A THR 328.A OG1 SER 326.A OG no hydrogen 2.787 N/A ARG 330.A N VAL 321.A O no hydrogen 2.819 N/A VAL 332.A N SER 319.A O no hydrogen 2.724 N/A THR 334.A N THR 317.A O no hydrogen 2.918 N/A THR 334.A OG1 GLU 15.A OE2 no hydrogen 2.709 N/A HIS 336.A N ALA 315.A O no hydrogen 2.783 N/A HIS 336.A NE2 THR 317.A OG1 no hydrogen 2.941 N/A PHE 338.A N GLY 313.A O no hydrogen 2.703 N/A