Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a4d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N VAL 24.A O no hydrogen 2.744 N/A HIS 5.A N GLU 105.A OE2 no hydrogen 2.673 N/A HIS 5.A NE2 HIS 21.A ND1 no hydrogen 2.910 N/A ALA 6.A N VAL 22.A O no hydrogen 2.909 N/A LEU 7.A N LEU 103.A O no hydrogen 3.003 N/A GLN 8.A N GLU 20.A O no hydrogen 3.024 N/A TYR 9.A N CYS 65.A O no hydrogen 3.055 N/A GLY 13.A N GLN 51.A O no hydrogen 2.980 N/A GLY 18.A N GLY 14.A O no hydrogen 2.936 N/A GLY 18.A N GLY 15.A O no hydrogen 3.133 N/A LEU 19.A N ALA 16.A O no hydrogen 3.231 N/A GLU 20.A N GLN 8.A O no hydrogen 2.821 N/A HIS 21.A ND1 HIS 5.A NE2 no hydrogen 2.910 N/A HIS 21.A NE2 GLU 308.A OE1 no hydrogen 2.743 N/A VAL 22.A N ALA 6.A O no hydrogen 2.749 N/A VAL 24.A N MET 4.A O no hydrogen 2.842 N/A VAL 26.A N LYS 2.A O no hydrogen 3.069 N/A LYS 30.A N GLU 33.A OE1 no hydrogen 2.815 N/A GLU 33.A N LYS 30.A O no hydrogen 3.036 N/A VAL 34.A N ALA 109.A O no hydrogen 2.704 N/A CYS 35.A N GLU 77.A O no hydrogen 2.793 N/A CYS 35.A SG PRO 27.A O no hydrogen 3.882 N/A CYS 35.A SG ALA 107.A O no hydrogen 4.042 N/A LEU 36.A N ALA 107.A O no hydrogen 2.767 N/A LYS 37.A N GLU 74.A O no hydrogen 2.653 N/A LEU 38.A N GLU 105.A O no hydrogen 2.917 N/A GLU 39.A N ALA 72.A O no hydrogen 2.816 N/A ALA 40.A N ALA 72.A O no hydrogen 3.056 N/A THR 41.A N VAL 325.A O no hydrogen 2.730 N/A THR 41.A OG1 GLY 102.A O no hydrogen 2.752 N/A SER 42.A N ASP 70.A O no hydrogen 2.906 N/A SER 42.A OG ALA 127.A O no hydrogen 2.791 N/A LEU 43.A N ILE 323.A O no hydrogen 3.152 N/A ASN 44.A N ASP 47.A OD2 no hydrogen 3.002 N/A ASN 44.A ND2 ASP 70.A OD2 no hydrogen 2.909 N/A ASP 47.A N ASN 44.A O no hydrogen 2.827 N/A TRP 48.A N PRO 45.A O no hydrogen 3.035 N/A LYS 49.A N PRO 45.A O no hydrogen 3.128 N/A ILE 50.A N VAL 46.A O no hydrogen 2.875 N/A GLN 51.A NE2 GLY 15.A O no hydrogen 2.963 N/A LYS 52.A N TRP 48.A O no hydrogen 2.944 N/A GLY 53.A N LYS 49.A O no hydrogen 3.119 N/A GLY 53.A N ILE 50.A O no hydrogen 3.184 N/A MET 54.A N LYS 49.A O no hydrogen 3.077 N/A ARG 56.A N GLY 53.A O no hydrogen 3.485 N/A PHE 58.A N ILE 55.A O no hydrogen 2.911 N/A LEU 59.A N ILE 55.A O no hydrogen 3.000 N/A ARG 61.A NH1 PHE 58.A O no hydrogen 2.812 N/A CYS 65.A N TYR 9.A O no hydrogen 3.045 N/A CYS 65.A SG TYR 9.A OH no hydrogen 3.416 N/A THR 69.A OG1 ASP 70.A OD1 no hydrogen 3.280 N/A VAL 71.A N ALA 93.A O no hydrogen 3.234 N/A ALA 72.A N ALA 40.A O no hydrogen 2.860 N/A GLY 73.A N VAL 91.A O no hydrogen 2.980 N/A GLU 74.A N LYS 37.A O no hydrogen 2.887 N/A VAL 75.A N ASP 89.A O no hydrogen 2.962 N/A VAL 76.A N CYS 35.A O no hydrogen 2.788 N/A GLY 79.A N GLU 33.A O no hydrogen 3.061 N/A GLY 81.A N SER 31.A O no hydrogen 2.809 N/A VAL 82.A N GLY 79.A O no hydrogen 3.134 N/A LYS 83.A N GLU 111.A OE2 no hydrogen 2.975 N/A ASN 84.A N GLU 111.A OE2 no hydrogen 3.057 N/A LYS 86.A N ASP 89.A OD2 no hydrogen 3.090 N/A GLY 88.A N VAL 75.A O no hydrogen 2.736 N/A ASP 89.A N LYS 86.A O no hydrogen 3.312 N/A LYS 90.A NZ GLU 39.A OE2 no hydrogen 2.806 N/A LYS 90.A NZ GLU 74.A OE1 no hydrogen 2.965 N/A VAL 91.A N GLY 73.A O no hydrogen 2.876 N/A VAL 92.A N VAL 115.A O no hydrogen 2.941 N/A ALA 93.A N VAL 71.A O no hydrogen 2.882 N/A VAL 94.A N LEU 113.A O no hydrogen 3.009 N/A LEU 95.A N THR 69.A O no hydrogen 2.792 N/A LEU 98.A N SER 96.A OG no hydrogen 2.989 N/A GLY 99.A N SER 96.A O no hydrogen 3.236 N/A GLY 100.A N SER 96.A O no hydrogen 2.860 N/A GLY 102.A N PRO 67.A O no hydrogen 3.021 N/A LEU 103.A N PRO 67.A O no hydrogen 3.157 N/A GLU 105.A N HIS 5.A O no hydrogen 3.217 N/A ALA 107.A N LEU 36.A O no hydrogen 3.042 N/A ALA 109.A N VAL 34.A O no hydrogen 2.932 N/A GLU 111.A N ASN 32.A O no hydrogen 2.919 N/A LEU 113.A N THR 110.A O no hydrogen 3.218 N/A THR 114.A N GLU 111.A O no hydrogen 3.142 N/A THR 114.A OG1 THR 110.A O no hydrogen 2.762 N/A VAL 115.A N VAL 92.A O no hydrogen 2.890 N/A ARG 117.A N LYS 90.A O no hydrogen 2.911 N/A ARG 117.A NE VAL 121.A O no hydrogen 3.212 N/A ARG 117.A NH1 GLU 39.A OE1 no hydrogen 2.975 N/A ARG 117.A NH1 GLY 73.A O no hydrogen 3.350 N/A ARG 117.A NH1 VAL 91.A O no hydrogen 3.182 N/A ARG 117.A NH2 GLU 39.A OE1 no hydrogen 2.841 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 2.793 N/A VAL 121.A N PRO 118.A O no hydrogen 2.978 N/A GLU 125.A N GLU 125.A OE1 no hydrogen 2.990 N/A ALA 126.A N GLY 122.A O no hydrogen 3.114 N/A ALA 126.A N ALA 123.A O no hydrogen 3.195 N/A ALA 127.A N ALA 123.A O no hydrogen 2.821 N/A LEU 129.A N ALA 126.A O no hydrogen 3.117 N/A VAL 131.A N ASP 70.A OD2 no hydrogen 2.992 N/A GLY 133.A N LEU 129.A O no hydrogen 2.752 N/A LEU 134.A N LEU 129.A O no hydrogen 3.335 N/A LEU 134.A N PRO 130.A O no hydrogen 3.407 N/A THR 135.A N VAL 131.A O no hydrogen 3.095 N/A THR 135.A OG1 VAL 131.A O no hydrogen 2.848 N/A ALA 136.A N ALA 132.A O no hydrogen 3.196 N/A LEU 137.A N GLY 133.A O no hydrogen 2.975 N/A GLN 138.A N LEU 134.A O no hydrogen 2.858 N/A GLN 138.A NE2 LEU 274.A O no hydrogen 3.135 N/A ALA 139.A N THR 135.A O no hydrogen 3.008 N/A LEU 140.A N ALA 136.A O no hydrogen 3.204 N/A THR 141.A N LEU 137.A O no hydrogen 3.020 N/A THR 141.A OG1 LEU 137.A O no hydrogen 3.149 N/A ASN 142.A N GLN 138.A O no hydrogen 2.922 N/A ALA 144.A N ALA 139.A O no hydrogen 3.231 N/A LEU 146.A N LEU 140.A O no hydrogen 2.875 N/A THR 151.A N ASP 149.A OD1 no hydrogen 2.596 N/A THR 151.A OG1 ASP 149.A OD1 no hydrogen 2.768 N/A ASN 156.A N ASP 221.A OD2 no hydrogen 2.868 N/A ASN 156.A ND2 LYS 219.A O no hydrogen 3.019 N/A ILE 157.A N HIS 180.A O no hydrogen 2.767 N/A LEU 158.A N ALA 222.A O no hydrogen 3.106 N/A VAL 159.A N THR 182.A O no hydrogen 2.795 N/A THR 160.A N VAL 224.A O no hydrogen 3.176 N/A THR 160.A OG1 HIS 225.A ND1 no hydrogen 2.837 N/A ALA 161.A N THR 184.A OG1 no hydrogen 3.180 N/A ALA 162.A N THR 184.A O no hydrogen 2.893 N/A GLY 164.A N ALA 161.A O no hydrogen 3.118 N/A HIS 168.A N GLY 164.A O no hydrogen 2.877 N/A HIS 168.A ND1 GLY 165.A O no hydrogen 2.774 N/A TYR 169.A N VAL 166.A O no hydrogen 3.115 N/A TYR 169.A OH THR 296.A OG1 no hydrogen 2.634 N/A ALA 170.A N VAL 166.A O no hydrogen 2.852 N/A VAL 171.A N GLY 167.A O no hydrogen 2.964 N/A GLN 172.A NE2 HIS 168.A O no hydrogen 2.966 N/A GLN 172.A NE2 LYS 295.A O no hydrogen 2.902 N/A LEU 173.A N TYR 169.A O no hydrogen 2.849 N/A ALA 174.A N ALA 170.A O no hydrogen 2.871 N/A LYS 175.A N VAL 171.A O no hydrogen 3.244 N/A LYS 175.A NZ ALA 179.A O no hydrogen 3.009 N/A LYS 175.A NZ ASP 199.A OD1 no hydrogen 3.315 N/A LYS 175.A NZ ASP 199.A OD2 no hydrogen 2.905 N/A LEU 176.A N GLN 172.A O no hydrogen 3.201 N/A ALA 177.A N LEU 173.A O no hydrogen 3.240 N/A ALA 177.A N ALA 174.A O no hydrogen 3.125 N/A ASN 178.A N LYS 175.A O no hydrogen 2.948 N/A ALA 179.A N ALA 174.A O no hydrogen 3.312 N/A HIS 180.A N ALA 155.A O no hydrogen 2.776 N/A VAL 181.A N ASP 199.A OD2 no hydrogen 2.808 N/A THR 182.A N ILE 157.A O no hydrogen 2.765 N/A THR 182.A OG1 GLU 200.A OE1 no hydrogen 2.842 N/A ALA 183.A N GLU 200.A O no hydrogen 2.844 N/A THR 184.A N VAL 159.A O no hydrogen 3.069 N/A CYS 185.A N LEU 202.A O no hydrogen 2.972 N/A CYS 185.A SG GLY 186.A O no hydrogen 3.364 N/A ARG 188.A NH1 THR 320.A OG1 no hydrogen 3.056 N/A ARG 188.A NH2 HIS 318.A O no hydrogen 3.283 N/A ASN 189.A N GLY 186.A O no hydrogen 3.164 N/A VAL 193.A N ASN 189.A O no hydrogen 2.794 N/A LYS 194.A N ILE 190.A O no hydrogen 3.106 N/A LYS 194.A NZ GLU 191.A OE2 no hydrogen 3.486 N/A SER 195.A N GLU 191.A O no hydrogen 3.070 N/A SER 195.A OG PHE 192.A O no hydrogen 2.507 N/A LEU 196.A N PHE 192.A O no hydrogen 3.332 N/A LEU 196.A N VAL 193.A O no hydrogen 3.243 N/A GLY 197.A N LYS 194.A O no hydrogen 3.028 N/A ALA 198.A N VAL 193.A O no hydrogen 3.479 N/A ASP 199.A N VAL 181.A O no hydrogen 2.960 N/A GLU 200.A N VAL 181.A O no hydrogen 3.162 N/A LEU 202.A N ALA 183.A O no hydrogen 2.698 N/A TYR 204.A N CYS 185.A O no hydrogen 3.096 N/A LYS 205.A N ASP 203.A OD1 no hydrogen 3.254 N/A THR 206.A N ASP 203.A O no hydrogen 3.053 N/A THR 206.A OG1 ASP 203.A O no hydrogen 2.730 N/A THR 206.A OG1 GLU 208.A OE1 no hydrogen 3.161 N/A GLY 209.A N THR 206.A OG1 no hydrogen 3.134 N/A ALA 210.A N THR 206.A O no hydrogen 3.007 N/A ALA 211.A N PRO 207.A O no hydrogen 3.083 N/A LEU 212.A N GLY 209.A O no hydrogen 3.021 N/A LYS 213.A N GLU 208.A O no hydrogen 3.068 N/A SER 214.A OG GLU 200.A OE1 no hydrogen 2.908 N/A SER 214.A OG GLU 200.A OE2 no hydrogen 3.269 N/A SER 216.A N SER 214.A OG no hydrogen 3.393 N/A SER 216.A OG GLU 200.A OE2 no hydrogen 2.436 N/A SER 216.A OG SER 214.A OG no hydrogen 3.417 N/A GLY 217.A N SER 214.A O no hydrogen 3.004 N/A LYS 218.A N SER 214.A OG no hydrogen 3.139 N/A TYR 220.A N ASN 238.A O no hydrogen 2.662 N/A TYR 220.A OH LEU 212.A O no hydrogen 2.931 N/A ASP 221.A N ASN 156.A O no hydrogen 2.801 N/A ALA 222.A N ASN 156.A O no hydrogen 3.425 N/A VAL 223.A N LYS 244.A O no hydrogen 2.821 N/A VAL 224.A N LEU 158.A O no hydrogen 2.741 N/A HIS 225.A N ILE 246.A O no hydrogen 2.989 N/A HIS 225.A ND1 THR 160.A OG1 no hydrogen 2.837 N/A CYS 226.A N THR 160.A OG1 no hydrogen 2.845 N/A CYS 226.A SG VAL 224.A O no hydrogen 3.738 N/A ALA 227.A N THR 160.A OG1 no hydrogen 3.288 N/A VAL 234.A N PRO 231.A O no hydrogen 2.909 N/A GLU 236.A N PHE 232.A O no hydrogen 2.975 N/A ASN 238.A N PHE 235.A O no hydrogen 2.854 N/A ASN 238.A ND2 ALA 211.A O no hydrogen 2.925 N/A ASN 238.A ND2 VAL 234.A O no hydrogen 3.013 N/A LEU 239.A N GLU 236.A O no hydrogen 3.125 N/A SER 240.A N TYR 220.A O no hydrogen 2.869 N/A SER 240.A OG TYR 220.A O no hydrogen 3.479 N/A SER 240.A OG ASP 221.A OD1 no hydrogen 3.065 N/A GLY 243.A N SER 240.A O no hydrogen 3.072 N/A LYS 244.A N ASP 221.A O no hydrogen 2.951 N/A LYS 244.A NZ PRO 143.A O no hydrogen 3.013 N/A VAL 245.A N GLN 269.A O no hydrogen 2.893 N/A ILE 246.A N VAL 223.A O no hydrogen 2.806 N/A ASP 247.A N VAL 271.A O no hydrogen 2.913 N/A ILE 248.A N HIS 225.A O no hydrogen 3.361 N/A THR 249.A N ASP 247.A OD1 no hydrogen 3.049 N/A MET 255.A N GLY 251.A O no hydrogen 2.981 N/A TRP 256.A N PRO 252.A O no hydrogen 2.933 N/A THR 257.A N ASN 253.A O no hydrogen 2.823 N/A THR 257.A OG1 ASN 253.A O no hydrogen 3.034 N/A TYR 258.A N ALA 254.A O no hydrogen 2.836 N/A ALA 259.A N MET 255.A O no hydrogen 2.920 N/A VAL 260.A N TRP 256.A O no hydrogen 2.997 N/A LYS 261.A N THR 257.A O no hydrogen 2.883 N/A LYS 262.A N TYR 258.A O no hydrogen 2.884 N/A ILE 263.A N ALA 259.A O no hydrogen 2.846 N/A THR 264.A N VAL 260.A O no hydrogen 2.835 N/A THR 264.A OG1 VAL 260.A O no hydrogen 2.514 N/A MET 265.A N LYS 262.A O no hydrogen 2.982 N/A SER 266.A N LYS 261.A O no hydrogen 3.066 N/A SER 266.A OG LYS 268.A O no hydrogen 2.528 N/A LYS 267.A NZ GLU 241.A OE2 no hydrogen 3.073 N/A LYS 268.A NZ GLU 236.A O no hydrogen 2.996 N/A GLN 269.A N GLY 243.A O no hydrogen 3.060 N/A VAL 271.A N VAL 245.A O no hydrogen 2.803 N/A LEU 273.A N ASP 247.A O no hydrogen 3.236 N/A ILE 276.A N GLN 138.A OE1 no hydrogen 2.918 N/A ASN 281.A N LYS 278.A O no hydrogen 3.053 N/A LEU 282.A N LYS 278.A O no hydrogen 3.055 N/A GLU 283.A N ALA 279.A O no hydrogen 2.724 N/A PHE 284.A N GLU 280.A O no hydrogen 2.939 N/A MET 285.A N ASN 281.A O no hydrogen 2.831 N/A VAL 286.A N LEU 282.A O no hydrogen 2.840 N/A ASN 287.A N GLU 283.A O no hydrogen 2.977 N/A ASN 287.A ND2 GLU 291.A OE2 no hydrogen 3.382 N/A LEU 288.A N PHE 284.A O no hydrogen 3.115 N/A VAL 289.A N MET 285.A O no hydrogen 3.077 N/A LYS 290.A N VAL 286.A O no hydrogen 3.006 N/A GLU 291.A N ASN 287.A O no hydrogen 2.960 N/A GLY 292.A N VAL 289.A O no hydrogen 3.121 N/A LYS 293.A N LEU 288.A O no hydrogen 2.955 N/A VAL 294.A N LEU 288.A O no hydrogen 3.332 N/A LYS 295.A N GLN 172.A OE1 no hydrogen 2.842 N/A THR 296.A OG1 GLU 125.A O no hydrogen 2.940 N/A THR 296.A OG1 TYR 169.A OH no hydrogen 2.634 N/A VAL 297.A N HIS 168.A NE2 no hydrogen 3.100 N/A ASP 299.A N LYS 322.A O no hydrogen 2.881 N/A SER 300.A OG ASP 299.A OD1 no hydrogen 2.851 N/A SER 300.A OG HIS 302.A NE2 no hydrogen 2.822 N/A LYS 301.A NZ GLU 326.A OE2 no hydrogen 3.264 N/A HIS 302.A N ILE 324.A O no hydrogen 2.841 N/A HIS 302.A NE2 SER 300.A OG no hydrogen 2.822 N/A LEU 304.A N GLU 326.A O no hydrogen 2.770 N/A LYS 306.A N PRO 303.A O no hydrogen 2.913 N/A ALA 307.A N LEU 304.A O no hydrogen 3.110 N/A GLU 308.A N GLU 308.A OE1 no hydrogen 2.744 N/A ASP 309.A N LYS 306.A O no hydrogen 2.851 N/A TRP 311.A N ALA 307.A O no hydrogen 2.982 N/A TRP 311.A NE1 GLN 51.A OE1 no hydrogen 2.820 N/A ALA 312.A N GLU 308.A O no hydrogen 3.009 N/A LYS 313.A N ASP 309.A O no hydrogen 3.056 N/A LYS 313.A NZ ASP 299.A OD1 no hydrogen 2.649 N/A LYS 313.A NZ ASP 299.A OD2 no hydrogen 3.538 N/A SER 314.A N ALA 310.A O no hydrogen 2.999 N/A ILE 315.A N TRP 311.A O no hydrogen 2.939 N/A ASP 316.A N ALA 312.A O no hydrogen 2.971 N/A GLY 317.A N SER 314.A O no hydrogen 2.969 N/A THR 320.A N ASP 299.A OD2 no hydrogen 2.897 N/A THR 320.A OG1 ASN 189.A OD1 no hydrogen 3.132 N/A GLY 321.A N SER 163.A O no hydrogen 2.985 N/A LYS 322.A N VAL 297.A O no hydrogen 2.875 N/A LYS 322.A NZ LEU 43.A O no hydrogen 2.966 N/A ILE 324.A N SER 300.A O no hydrogen 2.969 N/A VAL 325.A N THR 41.A O no hydrogen 2.667 N/A GLU 326.A N HIS 302.A O no hydrogen 2.780 N/A